NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
12938 1ttx 6705 cing 1-original 9 DYANA/DIANA pseudocontact shift


  3 ILE  N      -0.01 1   0.10  0.50
  3 ILE  HN      0.06 1   0.10  0.50
  4 THR  N      -0.01 1   0.10  0.50
  4 THR  HN      0.00 1   0.10  0.50
  5 ASP  N       0.00 1   0.10  0.50
  5 ASP  HN      0.01 1   0.10  0.50
  6 VAL  N       0.11 1   0.10  0.50
  6 VAL  HN      0.06 1   0.10  0.50
  7 LEU  N       0.00 1   0.10  0.50
  7 LEU  HN      0.01 1   0.10  0.50
  8 SER  N      -0.02 1   0.10  0.50
  8 SER  HN     -0.01 1   0.10  0.50
  9 ALA  N      -0.10 1   0.10  0.50
  9 ALA  HN     -0.14 1   0.10  0.50
 10 ASP  N      -0.13 1   0.10  0.50
 10 ASP  HN     -0.18 1   0.10  0.50
 11 ASP  N      -0.17 1   0.10  0.50
 11 ASP  HN     -0.24 1   0.10  0.50
 12 ILE  N      -0.34 1   0.10  0.50
 12 ILE  HN     -0.35 1   0.10  0.50
 13 ALA  N      -0.32 1   0.10  0.50
 13 ALA  HN     -0.37 1   0.10  0.50
 14 ALA  N      -0.37 1   0.10  0.50
 14 ALA  HN     -0.41 1   0.10  0.50
 15 ALA  N      -0.52 1   0.10  0.50
 15 ALA  HN     -0.57 1   0.10  0.50
 16 LEU  N      -0.65 1   0.10  0.50
 16 LEU  HN     -0.66 1   0.10  0.50
 19 CYS  N      -0.59 1   0.10  0.50
 19 CYS  HN     -0.75 1   0.10  0.50
 20 ARG  N      -0.69 1   0.10  0.50
 20 ARG  HN     -0.63 1   0.10  0.50
 21 ASP  N      -0.65 1   0.10  0.50
 21 ASP  HN     -0.61 1   0.10  0.50
 23 ASP  N      -0.69 1   0.10  0.50
 23 ASP  HN     -0.91 1   0.10  0.50
 24 THR  N      -0.89 1   0.10  0.50
 24 THR  HN     -0.85 1   0.10  0.50
 25 PHE  N      -1.11 1   0.10  0.50
 25 PHE  HN     -1.20 1   0.10  0.50
 26 GLU  N      -1.53 1   0.10  0.50
 26 GLU  HN     -1.47 1   0.10  0.50
 28 GLN  N      -2.12 1   0.10  0.50
 28 GLN  HN     -2.16 1   0.10  0.50
 29 LYS  N      -1.29 1   0.10  0.50
 29 LYS  HN     -1.47 1   0.10  0.50
 30 PHE  N      -1.34 1   0.10  0.50
 30 PHE  HN     -1.54 1   0.10  0.50
 31 PHE  N      -1.43 1   0.10  0.50
 31 PHE  HN     -1.72 1   0.10  0.50
 32 GLN  N      -0.94 1   0.10  0.50
 32 GLN  HN     -1.12 1   0.10  0.50
 33 THR  N      -0.70 1   0.10  0.50
 33 THR  HN     -0.85 1   0.10  0.50
 34 SER  N      -0.62 1   0.10  0.50
 34 SER  HN     -0.80 1   0.10  0.50
 35 GLY  N      -0.43 1   0.10  0.50
 35 GLY  HN     -0.58 1   0.10  0.50
 36 LEU  N      -0.61 1   0.10  0.50
 36 LEU  HN     -0.63 1   0.10  0.50
 37 SER  N      -0.63 1   0.10  0.50
 37 SER  HN     -0.68 1   0.10  0.50
 38 LYS  N      -0.30 1   0.10  0.50
 38 LYS  HN     -0.30 1   0.10  0.50
 39 MET  N       0.14 1   0.10  0.50
 39 MET  HN     -0.09 1   0.10  0.50
 40 SER  N       0.40 1   0.10  0.50
 40 SER  HN      0.45 1   0.10  0.50
 41 ALA  N       0.77 1   0.10  0.50
 41 ALA  HN      1.09 1   0.10  0.50
 43 GLN  N       1.01 1   0.10  0.50
 43 GLN  HN      1.11 1   0.10  0.50
 44 VAL  N       1.04 1   0.10  0.50
 44 VAL  HN      1.09 1   0.10  0.50
 45 LYS  N       2.11 1   0.10  0.50
 45 LYS  HN      2.05 1   0.10  0.50
 47 VAL  N       0.95 1   0.10  0.50
 47 VAL  HN      1.11 1   0.10  0.50
 48 PHE  N       1.23 1   0.10  0.50
 48 PHE  HN      1.53 1   0.10  0.50
 49 ARG  N       2.16 1   0.10  0.50
 49 ARG  HN      2.15 1   0.10  0.50
 50 PHE  N       1.12 1   0.10  0.50
 50 PHE  HN      1.09 1   0.10  0.50
 53 ASN  N       0.28 1   0.10  0.50
 53 ASN  HN     -0.25 1   0.10  0.50
 54 ASP  N       0.29 1   0.10  0.50
 54 ASP  HN      0.27 1   0.10  0.50
 55 GLN  N       1.07 1   0.10  0.50
 55 GLN  HN      1.05 1   0.10  0.50
 67 PHE  N      -2.35 1   0.10  0.50
 67 PHE  HN     -2.46 1   0.10  0.50
 68 LEU  N      -1.65 1   0.10  0.50
 68 LEU  HN     -1.69 1   0.10  0.50
 69 GLN  N      -1.16 1   0.10  0.50
 69 GLN  HN     -1.18 1   0.10  0.50
 70 LYS  N      -0.90 1   0.10  0.50
 70 LYS  HN     -1.05 1   0.10  0.50
 71 PHE  N      -0.82 1   0.10  0.50
 71 PHE  HN     -0.72 1   0.10  0.50
 73 SER  N      -0.38 1   0.10  0.50
 73 SER  HN     -0.37 1   0.10  0.50
 74 GLY  N      -0.39 1   0.10  0.50
 74 GLY  HN     -0.42 1   0.10  0.50
 75 ALA  N      -0.53 1   0.10  0.50
 75 ALA  HN     -0.58 1   0.10  0.50
 76 ARG  N      -0.74 1   0.10  0.50
 76 ARG  HN     -0.80 1   0.10  0.50
 78 LEU  N      -1.51 1   0.10  0.50
 78 LEU  HN     -1.67 1   0.10  0.50
 79 THR  N      -1.54 1   0.10  0.50
 79 THR  HN     -1.44 1   0.10  0.50
 80 GLU  N      -1.14 1   0.10  0.50
 80 GLU  HN     -0.92 1   0.10  0.50
 81 SER  N      -1.03 1   0.10  0.50
 81 SER  HN     -0.89 1   0.10  0.50
 82 GLU  N      -1.94 1   0.10  0.50
 82 GLU  HN     -1.48 1   0.10  0.50
 83 THR  N      -2.69 1   0.10  0.50
 83 THR  HN     -2.29 1   0.10  0.50
 84 LYS  N      -2.86 1   0.10  0.50
 84 LYS  HN     -2.28 1   0.10  0.50
 85 SER  N      -2.56 1   0.10  0.50
 85 SER  HN     -2.47 1   0.10  0.50
 69 GLN  NE2    -0.85 1   0.10  0.50
 69 GLN  HE21   -0.77 1   0.10  0.50
 69 GLN  HE22   -0.74 1   0.10  0.50
 17 GLN  NE2    -0.37 1   0.10  0.50
 17 GLN  HE21   -0.34 1   0.10  0.50
 17 GLN  HE22   -0.37 1   0.10  0.50
 32 GLN  NE2    -0.70 1   0.10  0.50
 32 GLN  HE21   -0.71 1   0.10  0.50
 32 GLN  HE22   -0.64 1   0.10  0.50
 53 ASN  ND2    -0.30 1   0.10  0.50
 53 ASN  HD21   -0.39 1   0.10  0.50
 53 ASN  HD22   -0.36 1   0.10  0.50
 28 GLN  NE2    -1.69 1   0.10  0.50
 28 GLN  HE21   -1.72 1   0.10  0.50
 28 GLN  HE22   -1.60 1   0.10  0.50
 55 GLN  NE2     1.12 1   0.10  0.50
 55 GLN  HE21    1.15 1   0.10  0.50
 55 GLN  HE22    1.12 1   0.10  0.50
 43 GLN  NE2     0.48 1   0.10  0.50
 43 GLN  HE21    0.49 1   0.10  0.50
 43 GLN  HE22    0.40 1   0.10  0.50
150 LTNS PCN

(Residual dipolar coupling) 
  7 LEU  HN     -4.14  0.50  0.10
  8 SER  HN      0.22  0.50  0.10
  9 ALA  HN     27.33  0.50  0.10
 10 ASP- HN     13.71  0.50  0.10
 11 ASP- HN     16.99  0.50  0.10
 12 ILE  HN     23.39  0.50  0.10
 14 ALA  HN     15.10  0.50  0.10
 16 LEU  HN     22.34  0.50  0.10
 19 CYS  HN     22.19  0.50  0.10
 23 ASP- HN      8.50  0.50  0.10
 24 THR  HN      2.30  0.50  0.10
 25 PHE  HN      1.60  0.50  0.10
 26 GLU- HN      4.67  0.50  0.10
 28 GLN  HN     17.55  0.50  0.10
 30 PHE  HN     11.18  0.50  0.10
 31 PHE  HN     19.30  0.50  0.10
 33 THR  HN     17.85  0.50  0.10
 34 SER  HN      7.39  0.50  0.10
 35 GLY  HN     16.32  0.50  0.10
 39 MET  HN     15.52  0.50  0.10
 40 SER  HN      9.64  0.50  0.10
 45 LYS+ HN     -0.06  0.50  0.10
 49 ARG+ HN      4.34  0.50  0.10
 50 PHE  HN    -10.01  0.50  0.10
 53 ASN  HN      8.44  0.50  0.10
 54 ASP- HN     12.32  0.50  0.10
 55 GLN  HN      7.12  0.50  0.10
 68 LEU  HN     17.30  0.50  0.10
 69 GLN  HN      6.44  0.50  0.10
 71 PHE  HN     14.27  0.50  0.10
 75 ALA  HN      4.71  0.50  0.10
 76 ARG+ HN     -3.42  0.50  0.10
 78 LEU  HN     -2.79  0.50  0.10
 79 THR  HN     -8.73  0.50  0.10
 80 GLU- HN      5.19  0.50  0.10
 83 THR  HN      2.33  0.50  0.10
109 SER  HN     -6.62  0.50  0.10
150 LTNS

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H1       MET   1 -15.705   0.588   2.445
    2   2H    MET   1           H2       MET   1 -16.468   0.441   0.991
    3   3H    MET   1           H3       MET   1 -15.051   1.276   1.104
    4    HA   MET   1           HA       MET   1 -16.923   2.796   0.941
    5   1HB   MET   1          2HB       MET   1 -17.766   1.222   3.394
    6   2HB   MET   1          3HB       MET   1 -18.377   2.846   3.045
    7   1HG   MET   1          2HG       MET   1 -19.343   2.162   0.960
    8   2HG   MET   1          3HG       MET   1 -18.694   0.519   1.115
    9   1HE   MET   1          1HE       MET   1 -21.790   1.454   0.569
   10   2HE   MET   1          2HE       MET   1 -21.207  -0.230   0.504
   11   3HE   MET   1          3HE       MET   1 -22.612   0.191   1.513
   12    H    SER   2           H        SER   2 -14.630   3.665   1.137
   13    HA   SER   2           HA       SER   2 -14.533   5.510   3.293
   14   1HB   SER   2          2HB       SER   2 -12.215   3.507   3.287
   15   2HB   SER   2          3HB       SER   2 -12.454   4.905   4.344
   16    HG   SER   2           HG       SER   2 -14.526   3.598   4.843
   17    H    ILE   3           H        ILE   3 -12.163   3.784   1.275
   18    HA   ILE   3           HA       ILE   3 -10.972   6.340   0.450
   19    HB   ILE   3           HB       ILE   3  -9.081   5.080  -0.167
   20   1HG1  ILE   3          2HG1      ILE   3  -9.331   2.442   0.202
   21   2HG1  ILE   3          3HG1      ILE   3 -10.963   2.723  -0.359
   22   1HG2  ILE   3          1HG2      ILE   3  -8.484   4.016   1.869
   23   2HG2  ILE   3          2HG2      ILE   3  -9.657   5.280   2.298
   24   3HG2  ILE   3          3HG2      ILE   3 -10.146   3.575   2.248
   25   1HD1  ILE   3          1HD1      ILE   3  -9.535   2.146  -2.246
   26   2HD1  ILE   3          2HD1      ILE   3  -9.910   3.859  -2.434
   27   3HD1  ILE   3          3HD1      ILE   3  -8.338   3.369  -1.783
   28    H    THR   4           H        THR   4 -12.904   3.709  -0.959
   29    HA   THR   4           HA       THR   4 -12.334   3.973  -3.604
   30    HB   THR   4           HB       THR   4 -13.240   2.009  -2.355
   31    HG1  THR   4           1HG      THR   4 -14.532   3.279  -4.370
   32   1HG2  THR   4          1HG2      THR   4 -14.867   3.235  -0.814
   33   2HG2  THR   4          2HG2      THR   4 -15.867   3.592  -2.230
   34   3HG2  THR   4          3HG2      THR   4 -15.612   1.915  -1.736
   35    H    ASP   5           H        ASP   5 -14.013   6.201  -1.588
   36    HA   ASP   5           HA       ASP   5 -15.145   7.540  -3.965
   37   1HB   ASP   5          2HB       ASP   5 -16.933   6.164  -2.825
   38   2HB   ASP   5          3HB       ASP   5 -16.654   7.105  -1.345
   39    H    VAL   6           H        VAL   6 -12.694   7.846  -2.259
   40    HA   VAL   6           HA       VAL   6 -13.248  10.589  -1.186
   41    HB   VAL   6           HB       VAL   6 -12.012   8.710   0.153
   42   1HG1  VAL   6          1HG1      VAL   6  -9.560   9.905  -1.070
   43   2HG1  VAL   6          2HG1      VAL   6  -9.696   8.581   0.087
   44   3HG1  VAL   6          3HG1      VAL   6 -10.233   8.340  -1.577
   45   1HG2  VAL   6          1HG2      VAL   6 -12.412  10.954   0.998
   46   2HG2  VAL   6          2HG2      VAL   6 -10.765  10.429   1.389
   47   3HG2  VAL   6          3HG2      VAL   6 -11.033  11.575   0.057
   48    H    LEU   7           H        LEU   7 -11.206   8.761  -3.384
   49    HA   LEU   7           HA       LEU   7 -10.722  10.747  -5.309
   50   1HB   LEU   7          2HB       LEU   7  -9.659  12.076  -3.629
   51   2HB   LEU   7          3HB       LEU   7  -8.845  10.701  -2.912
   52    HG   LEU   7           HG       LEU   7  -7.959  11.012  -5.677
   53   1HD1  LEU   7          1HD1      LEU   7  -6.854  13.223  -5.288
   54   2HD1  LEU   7          2HD1      LEU   7  -8.632  13.350  -5.307
   55   3HD1  LEU   7          3HD1      LEU   7  -7.763  13.370  -3.756
   56   1HD2  LEU   7          1HD2      LEU   7  -6.547  11.342  -2.976
   57   2HD2  LEU   7          2HD2      LEU   7  -6.745   9.800  -3.835
   58   3HD2  LEU   7          3HD2      LEU   7  -5.773  11.086  -4.550
   59    H    SER   8           H        SER   8  -8.889   8.473  -3.238
   60    HA   SER   8           HA       SER   8  -7.065   7.494  -4.837
   61   1HB   SER   8          2HB       SER   8  -7.816   5.216  -3.384
   62   2HB   SER   8          3HB       SER   8  -6.649   6.464  -2.947
   63    HG   SER   8           HG       SER   8  -9.440   6.467  -2.324
   64    H    ALA   9           H        ALA   9 -10.434   6.511  -5.190
   65    HA   ALA   9           HA       ALA   9 -10.226   4.153  -6.682
   66   1HB   ALA   9          1HB       ALA   9 -12.337   5.159  -5.970
   67   2HB   ALA   9          2HB       ALA   9 -12.078   6.537  -7.068
   68   3HB   ALA   9          3HB       ALA   9 -12.343   4.905  -7.729
   69    H    ASP  10           H        ASP  10  -9.835   7.560  -7.832
   70    HA   ASP  10           HA       ASP  10  -9.545   6.769 -10.614
   71   1HB   ASP  10          2HB       ASP  10 -10.295   9.031  -9.827
   72   2HB   ASP  10          3HB       ASP  10  -8.647   9.336  -9.241
   73    H    ASP  11           H        ASP  11  -7.367   7.488  -7.888
   74    HA   ASP  11           HA       ASP  11  -4.942   7.523  -9.342
   75   1HB   ASP  11          2HB       ASP  11  -5.347   6.807  -6.407
   76   2HB   ASP  11          3HB       ASP  11  -3.898   7.432  -7.207
   77    H    ILE  12           H        ILE  12  -6.658   4.898  -7.553
   78    HA   ILE  12           HA       ILE  12  -4.680   2.948  -8.097
   79    HB   ILE  12           HB       ILE  12  -6.218   1.351  -7.415
   80   1HG1  ILE  12          2HG1      ILE  12  -8.304   3.447  -7.203
   81   2HG1  ILE  12          3HG1      ILE  12  -8.317   2.080  -8.320
   82   1HG2  ILE  12          1HG2      ILE  12  -6.426   2.065  -5.078
   83   2HG2  ILE  12          2HG2      ILE  12  -4.883   2.556  -5.771
   84   3HG2  ILE  12          3HG2      ILE  12  -6.174   3.748  -5.552
   85   1HD1  ILE  12          1HD1      ILE  12  -9.811   1.531  -6.565
   86   2HD1  ILE  12          2HD1      ILE  12  -8.357   0.549  -6.303
   87   3HD1  ILE  12          3HD1      ILE  12  -8.660   2.002  -5.309
   88    H    ALA  13           H        ALA  13  -7.673   3.929  -9.833
   89    HA   ALA  13           HA       ALA  13  -7.526   1.964 -11.877
   90   1HB   ALA  13          1HB       ALA  13  -8.730   3.604 -13.289
   91   2HB   ALA  13          2HB       ALA  13  -9.455   3.402 -11.681
   92   3HB   ALA  13          3HB       ALA  13  -8.492   4.846 -12.050
   93    H    ALA  14           H        ALA  14  -5.781   5.110 -11.572
   94    HA   ALA  14           HA       ALA  14  -4.272   4.765 -13.987
   95   1HB   ALA  14          1HB       ALA  14  -2.754   6.430 -13.107
   96   2HB   ALA  14          2HB       ALA  14  -4.434   6.915 -12.801
   97   3HB   ALA  14          3HB       ALA  14  -3.436   6.278 -11.481
   98    H    ALA  15           H        ALA  15  -3.340   4.024 -10.584
   99    HA   ALA  15           HA       ALA  15  -0.833   2.977 -10.892
  100   1HB   ALA  15          1HB       ALA  15  -2.109   3.326  -8.718
  101   2HB   ALA  15          2HB       ALA  15  -2.930   1.791  -9.036
  102   3HB   ALA  15          3HB       ALA  15  -1.177   1.818  -8.822
  103    H    LEU  16           H        LEU  16  -3.897   1.311 -11.162
  104    HA   LEU  16           HA       LEU  16  -3.169  -1.328 -11.540
  105   1HB   LEU  16          2HB       LEU  16  -5.460  -0.802 -11.228
  106   2HB   LEU  16          3HB       LEU  16  -5.448   0.386 -12.526
  107    HG   LEU  16           HG       LEU  16  -5.320  -1.382 -14.231
  108   1HD1  LEU  16          1HD1      LEU  16  -4.209  -3.183 -12.914
  109   2HD1  LEU  16          2HD1      LEU  16  -5.647  -3.301 -11.876
  110   3HD1  LEU  16          3HD1      LEU  16  -5.749  -3.727 -13.597
  111   1HD2  LEU  16          1HD2      LEU  16  -7.597  -1.708 -12.242
  112   2HD2  LEU  16          2HD2      LEU  16  -7.472  -0.442 -13.481
  113   3HD2  LEU  16          3HD2      LEU  16  -7.628  -2.139 -13.965
  114    H    GLN  17           H        GLN  17  -3.329   1.348 -13.935
  115    HA   GLN  17           HA       GLN  17  -2.704  -0.534 -16.141
  116   1HB   GLN  17          2HB       GLN  17  -3.326   2.432 -16.131
  117   2HB   GLN  17          3HB       GLN  17  -2.934   1.454 -17.562
  118   1HG   GLN  17          2HG       GLN  17  -4.839  -0.087 -16.988
  119   2HG   GLN  17          3HG       GLN  17  -5.268   0.991 -15.649
  120   1HE2  GLN  17          1HE2      GLN  17  -7.335   1.528 -16.483
  121   2HE2  GLN  17          2HE2      GLN  17  -7.521   2.455 -17.963
  122    H    GLU  18           H        GLU  18  -1.219   2.175 -14.361
  123    HA   GLU  18           HA       GLU  18   1.019   2.316 -16.127
  124   1HB   GLU  18          2HB       GLU  18   1.799   4.038 -14.831
  125   2HB   GLU  18          3HB       GLU  18   0.050   4.105 -14.651
  126   1HG   GLU  18          2HG       GLU  18   0.487   4.377 -12.476
  127   2HG   GLU  18          3HG       GLU  18   0.634   2.616 -12.458
  128    H    CYS  19           H        CYS  19   0.486   0.564 -13.077
  129    HA   CYS  19           HA       CYS  19   2.936  -1.099 -13.610
  130   1HB   CYS  19          2HB       CYS  19   1.437  -0.557 -11.033
  131   2HB   CYS  19          3HB       CYS  19   2.569  -1.905 -11.292
  132    HG   CYS  19           HG       CYS  19   3.144   1.326 -11.553
  133    H    ARG  20           H        ARG  20   1.137  -1.628 -15.464
  134    HA   ARG  20           HA       ARG  20  -0.802  -3.648 -14.585
  135   1HB   ARG  20          2HB       ARG  20  -0.136  -2.294 -17.082
  136   2HB   ARG  20          3HB       ARG  20  -0.088  -4.020 -17.355
  137   1HG   ARG  20          2HG       ARG  20  -2.432  -2.682 -15.975
  138   2HG   ARG  20          3HG       ARG  20  -2.341  -2.832 -17.721
  139   1HD   ARG  20          2HD       ARG  20  -2.085  -5.198 -15.826
  140   2HD   ARG  20          3HD       ARG  20  -3.651  -4.594 -16.409
  141    HE   ARG  20           HE       ARG  20  -2.116  -4.893 -18.701
  142   1HH1  ARG  20          2HH2      ARG  20  -3.169  -7.048 -16.130
  143   2HH1  ARG  20          1HH2      ARG  20  -3.368  -8.447 -17.140
  144   1HH2  ARG  20          2HH1      ARG  20  -2.401  -6.703 -20.103
  145   2HH2  ARG  20          1HH1      ARG  20  -2.916  -8.233 -19.474
  146    H    ASP  21           H        ASP  21   2.506  -3.518 -15.831
  147    HA   ASP  21           HA       ASP  21   2.505  -6.229 -16.650
  148   1HB   ASP  21          2HB       ASP  21   4.454  -3.911 -16.648
  149   2HB   ASP  21          3HB       ASP  21   5.064  -5.526 -16.969
  150    HA   PRO  22           HA       PRO  22   3.782  -8.311 -13.076
  151   1HB   PRO  22          2HB       PRO  22   5.278 -10.409 -13.995
  152   2HB   PRO  22          3HB       PRO  22   3.514 -10.264 -14.261
  153   1HG   PRO  22          2HG       PRO  22   5.738  -9.462 -16.158
  154   2HG   PRO  22          3HG       PRO  22   4.304 -10.466 -16.527
  155   1HD   PRO  22          2HD       PRO  22   4.350  -7.813 -17.087
  156   2HD   PRO  22          3HD       PRO  22   2.863  -8.566 -16.442
  157    H    ASP  23           H        ASP  23   5.186  -7.619 -11.586
  158    HA   ASP  23           HA       ASP  23   6.971  -7.569 -10.388
  159   1HB   ASP  23          2HB       ASP  23   8.623  -8.444 -12.787
  160   2HB   ASP  23          3HB       ASP  23   9.233  -8.192 -11.154
  161    H    THR  24           H        THR  24   5.748  -5.354 -11.601
  162    HA   THR  24           HA       THR  24   7.981  -3.496 -12.397
  163    HB   THR  24           HB       THR  24   5.069  -3.269 -13.127
  164    HG1  THR  24           1HG      THR  24   5.488  -4.544 -14.685
  165   1HG2  THR  24          1HG2      THR  24   7.589  -1.952 -14.246
  166   2HG2  THR  24          2HG2      THR  24   5.989  -1.883 -15.006
  167   3HG2  THR  24          3HG2      THR  24   6.241  -1.116 -13.438
  168    H    PHE  25           H        PHE  25   6.020  -4.164  -9.718
  169    HA   PHE  25           HA       PHE  25   4.732  -1.597  -9.466
  170   1HB   PHE  25          2HB       PHE  25   3.840  -3.879  -8.907
  171   2HB   PHE  25          3HB       PHE  25   4.865  -3.870  -7.479
  172    HD1  PHE  25           HD1      PHE  25   1.820  -2.568  -9.080
  173    HD2  PHE  25           HD2      PHE  25   4.323  -2.364  -5.571
  174    HE1  PHE  25           HE1      PHE  25  -0.094  -1.711  -7.763
  175    HE2  PHE  25           HE2      PHE  25   2.405  -1.477  -4.268
  176    HZ   PHE  25           HZ       PHE  25   0.183  -1.225  -5.338
  177    H    GLU  26           H        GLU  26   6.604  -0.149  -9.297
  178    HA   GLU  26           HA       GLU  26   8.480  -0.391  -7.176
  179   1HB   GLU  26          2HB       GLU  26   7.908   1.628  -9.271
  180   2HB   GLU  26          3HB       GLU  26   8.332   2.344  -7.719
  181   1HG   GLU  26          2HG       GLU  26  10.349   0.593  -7.799
  182   2HG   GLU  26          3HG       GLU  26  10.060   0.757  -9.538
  183    HA   PRO  27           HA       PRO  27   5.967   0.903  -3.887
  184   1HB   PRO  27          2HB       PRO  27   7.821   1.808  -2.008
  185   2HB   PRO  27          3HB       PRO  27   7.545   0.096  -2.418
  186   1HG   PRO  27          2HG       PRO  27   9.768   1.868  -3.406
  187   2HG   PRO  27          3HG       PRO  27   9.808   0.133  -2.976
  188   1HD   PRO  27          2HD       PRO  27   9.660   1.016  -5.556
  189   2HD   PRO  27          3HD       PRO  27   8.984  -0.543  -4.985
  190    H    GLN  28           H        GLN  28   8.605   3.375  -4.105
  191    HA   GLN  28           HA       GLN  28   7.073   5.585  -3.205
  192   1HB   GLN  28          2HB       GLN  28   9.520   5.380  -4.992
  193   2HB   GLN  28          3HB       GLN  28   8.839   6.926  -4.452
  194   1HG   GLN  28          2HG       GLN  28   9.197   6.399  -2.128
  195   2HG   GLN  28          3HG       GLN  28   9.605   4.719  -2.497
  196   1HE2  GLN  28          1HE2      GLN  28  10.737   8.084  -3.250
  197   2HE2  GLN  28          2HE2      GLN  28  12.432   7.628  -3.259
  198    H    LYS  29           H        LYS  29   7.681   4.373  -6.499
  199    HA   LYS  29           HA       LYS  29   6.160   6.201  -7.942
  200   1HB   LYS  29          2HB       LYS  29   7.590   4.304  -8.881
  201   2HB   LYS  29          3HB       LYS  29   6.289   3.189  -8.417
  202   1HG   LYS  29          2HG       LYS  29   5.979   3.587 -10.715
  203   2HG   LYS  29          3HG       LYS  29   4.724   4.512  -9.909
  204   1HD   LYS  29          2HD       LYS  29   6.380   6.538 -10.057
  205   2HD   LYS  29          3HD       LYS  29   7.350   5.501 -11.122
  206   1HE   LYS  29          2HE       LYS  29   5.452   5.274 -12.665
  207   2HE   LYS  29          3HE       LYS  29   4.383   6.137 -11.534
  208   1HZ   LYS  29          1HZ       LYS  29   5.739   8.087 -11.855
  209   2HZ   LYS  29          2HZ       LYS  29   6.653   7.294 -12.983
  210   3HZ   LYS  29          3HZ       LYS  29   5.044   7.550 -13.249
  211    H    PHE  30           H        PHE  30   5.017   3.057  -6.527
  212    HA   PHE  30           HA       PHE  30   2.331   3.435  -7.163
  213   1HB   PHE  30          2HB       PHE  30   3.149   1.289  -6.468
  214   2HB   PHE  30          3HB       PHE  30   3.617   1.907  -4.887
  215    HD1  PHE  30           HD1      PHE  30   2.133   1.604  -3.079
  216    HD2  PHE  30           HD2      PHE  30   0.580   1.678  -7.103
  217    HE1  PHE  30           HE1      PHE  30  -0.165   1.357  -2.200
  218    HE2  PHE  30           HE2      PHE  30  -1.726   1.423  -6.212
  219    HZ   PHE  30           HZ       PHE  30  -2.101   1.382  -3.760
  220    H    PHE  31           H        PHE  31   3.990   4.359  -4.082
  221    HA   PHE  31           HA       PHE  31   1.703   5.385  -2.801
  222   1HB   PHE  31          2HB       PHE  31   4.599   6.282  -2.560
  223   2HB   PHE  31          3HB       PHE  31   3.320   6.715  -1.434
  224    HD1  PHE  31           HD1      PHE  31   6.095   4.917  -1.311
  225    HD2  PHE  31           HD2      PHE  31   1.852   4.285  -0.856
  226    HE1  PHE  31           HE1      PHE  31   6.535   3.010   0.188
  227    HE2  PHE  31           HE2      PHE  31   2.303   2.487   0.767
  228    HZ   PHE  31           HZ       PHE  31   4.653   1.856   1.314
  229    H    GLN  32           H        GLN  32   3.755   6.926  -5.262
  230    HA   GLN  32           HA       GLN  32   2.505   9.570  -4.961
  231   1HB   GLN  32          2HB       GLN  32   4.209   8.302  -7.128
  232   2HB   GLN  32          3HB       GLN  32   3.623   9.965  -7.159
  233   1HG   GLN  32          2HG       GLN  32   5.009   9.212  -4.616
  234   2HG   GLN  32          3HG       GLN  32   6.003   9.105  -6.063
  235   1HE2  GLN  32          1HE2      GLN  32   4.410  11.376  -3.826
  236   2HE2  GLN  32          2HE2      GLN  32   5.001  12.787  -4.654
  237    H    THR  33           H        THR  33   2.334   6.896  -7.399
  238    HA   THR  33           HA       THR  33   0.457   8.213  -8.880
  239    HB   THR  33           HB       THR  33   2.149   6.143  -9.328
  240    HG1  THR  33           1HG      THR  33  -0.263   6.707 -10.555
  241   1HG2  THR  33          1HG2      THR  33   1.051   4.064  -9.692
  242   2HG2  THR  33          2HG2      THR  33   0.609   4.512  -8.033
  243   3HG2  THR  33          3HG2      THR  33  -0.542   4.765  -9.357
  244    H    SER  34           H        SER  34   0.074   6.182  -6.107
  245    HA   SER  34           HA       SER  34  -2.745   5.611  -6.462
  246   1HB   SER  34          2HB       SER  34  -1.124   4.064  -5.412
  247   2HB   SER  34          3HB       SER  34  -0.918   5.186  -4.064
  248    HG   SER  34           HG       SER  34  -3.506   4.335  -4.766
  249    H    GLY  35           H        GLY  35  -0.977   8.371  -5.390
  250   1HA   GLY  35          1HA       GLY  35  -1.951  10.402  -4.859
  251   2HA   GLY  35          2HA       GLY  35  -3.495   9.618  -4.505
  252    H    LEU  36           H        LEU  36  -1.561   7.673  -2.890
  253    HA   LEU  36           HA       LEU  36  -2.228   8.489  -0.308
  254   1HB   LEU  36          2HB       LEU  36   0.042   6.736  -1.342
  255   2HB   LEU  36          3HB       LEU  36  -0.507   6.783   0.325
  256    HG   LEU  36           HG       LEU  36  -2.269   5.950  -2.031
  257   1HD1  LEU  36          1HD1      LEU  36  -0.844   4.246   0.047
  258   2HD1  LEU  36          2HD1      LEU  36  -1.982   3.667  -1.191
  259   3HD1  LEU  36          3HD1      LEU  36  -0.432   4.362  -1.680
  260   1HD2  LEU  36          1HD2      LEU  36  -3.643   6.787  -0.192
  261   2HD2  LEU  36          2HD2      LEU  36  -3.734   5.026  -0.231
  262   3HD2  LEU  36          3HD2      LEU  36  -2.709   5.827   0.980
  263    H    SER  37           H        SER  37   0.787   9.110  -2.161
  264    HA   SER  37           HA       SER  37   2.012  10.585   0.030
  265   1HB   SER  37          2HB       SER  37   3.509   9.505  -1.455
  266   2HB   SER  37          3HB       SER  37   2.609  10.060  -2.874
  267    HG   SER  37           HG       SER  37   4.524  11.417  -1.367
  268    H    LYS  38           H        LYS  38  -0.554  11.396  -2.015
  269    HA   LYS  38           HA       LYS  38   0.056  14.283  -1.887
  270   1HB   LYS  38          2HB       LYS  38  -1.239  12.698  -3.859
  271   2HB   LYS  38          3HB       LYS  38  -2.541  13.535  -3.022
  272   1HG   LYS  38          2HG       LYS  38  -1.906  14.956  -4.784
  273   2HG   LYS  38          3HG       LYS  38  -1.206  15.687  -3.322
  274   1HD   LYS  38          2HD       LYS  38   0.971  14.374  -3.921
  275   2HD   LYS  38          3HD       LYS  38   0.220  14.020  -5.470
  276   1HE   LYS  38          2HE       LYS  38   0.876  16.777  -4.302
  277   2HE   LYS  38          3HE       LYS  38   1.743  15.959  -5.608
  278   1HZ   LYS  38          1HZ       LYS  38  -1.048  16.897  -5.726
  279   2HZ   LYS  38          2HZ       LYS  38   0.243  17.594  -6.466
  280   3HZ   LYS  38          3HZ       LYS  38  -0.266  16.102  -6.938
  281    H    MET  39           H        MET  39  -2.077  11.730  -0.671
  282    HA   MET  39           HA       MET  39  -3.849  13.332   0.837
  283   1HB   MET  39          2HB       MET  39  -2.731  10.546   1.384
  284   2HB   MET  39          3HB       MET  39  -4.009  11.305   2.312
  285   1HG   MET  39          2HG       MET  39  -5.375  11.485   0.212
  286   2HG   MET  39          3HG       MET  39  -4.131  10.531  -0.611
  287   1HE   MET  39          1HE       MET  39  -5.859   8.662  -1.353
  288   2HE   MET  39          2HE       MET  39  -7.054   7.964  -0.233
  289   3HE   MET  39          3HE       MET  39  -7.126   9.696  -0.642
  290    H    SER  40           H        SER  40  -3.881  13.827   3.082
  291    HA   SER  40           HA       SER  40  -1.286  14.649   4.185
  292   1HB   SER  40          2HB       SER  40  -3.335  16.086   4.352
  293   2HB   SER  40          3HB       SER  40  -4.082  14.843   5.379
  294    HG   SER  40           HG       SER  40  -1.816  16.454   5.913
  295    H    ALA  41           H        ALA  41  -0.552  13.972   6.245
  296    HA   ALA  41           HA       ALA  41  -0.223  11.328   6.857
  297   1HB   ALA  41          1HB       ALA  41  -0.397  13.711   8.745
  298   2HB   ALA  41          2HB       ALA  41   0.228  12.116   9.193
  299   3HB   ALA  41          3HB       ALA  41   1.057  13.070   7.942
  300    H    ASN  42           H        ASN  42  -2.840  13.431   8.055
  301    HA   ASN  42           HA       ASN  42  -4.097  11.655   9.844
  302   1HB   ASN  42          2HB       ASN  42  -5.470  13.687   8.025
  303   2HB   ASN  42          3HB       ASN  42  -6.111  12.999   9.521
  304   1HD2  ASN  42          1HD2      ASN  42  -4.574  15.721   8.246
  305   2HD2  ASN  42          2HD2      ASN  42  -3.879  16.313   9.739
  306    H    GLN  43           H        GLN  43  -4.825  12.191   6.372
  307    HA   GLN  43           HA       GLN  43  -6.845  10.154   6.207
  308   1HB   GLN  43          2HB       GLN  43  -5.502  12.051   4.380
  309   2HB   GLN  43          3HB       GLN  43  -5.789  10.488   3.624
  310   1HG   GLN  43          2HG       GLN  43  -7.945  12.064   5.079
  311   2HG   GLN  43          3HG       GLN  43  -7.647  12.149   3.334
  312   1HE2  GLN  43          1HE2      GLN  43 -10.176  11.375   4.243
  313   2HE2  GLN  43          2HE2      GLN  43 -10.382   9.671   3.884
  314    H    VAL  44           H        VAL  44  -3.279  10.212   5.554
  315    HA   VAL  44           HA       VAL  44  -3.126   7.632   4.403
  316    HB   VAL  44           HB       VAL  44  -1.232   9.485   5.899
  317   1HG1  VAL  44          1HG1      VAL  44   0.617   8.152   4.944
  318   2HG1  VAL  44          2HG1      VAL  44  -0.311   7.317   6.193
  319   3HG1  VAL  44          3HG1      VAL  44  -0.579   6.916   4.465
  320   1HG2  VAL  44          1HG2      VAL  44  -2.106  10.263   3.687
  321   2HG2  VAL  44          2HG2      VAL  44  -0.377   9.934   3.632
  322   3HG2  VAL  44          3HG2      VAL  44  -1.533   8.766   2.948
  323    H    LYS  45           H        LYS  45  -2.952   8.757   7.824
  324    HA   LYS  45           HA       LYS  45  -2.501   6.163   8.906
  325   1HB   LYS  45          2HB       LYS  45  -2.123   8.397   9.982
  326   2HB   LYS  45          3HB       LYS  45  -3.858   8.526  10.279
  327   1HG   LYS  45          2HG       LYS  45  -3.796   7.012  11.997
  328   2HG   LYS  45          3HG       LYS  45  -2.629   5.954  11.183
  329   1HD   LYS  45          2HD       LYS  45  -0.798   7.539  11.656
  330   2HD   LYS  45          3HD       LYS  45  -1.939   8.627  12.475
  331   1HE   LYS  45          2HE       LYS  45  -2.396   6.848  14.169
  332   2HE   LYS  45          3HE       LYS  45  -1.276   5.759  13.329
  333   1HZ   LYS  45          1HZ       LYS  45  -0.216   6.824  15.186
  334   2HZ   LYS  45          2HZ       LYS  45   0.495   7.327  13.792
  335   3HZ   LYS  45          3HZ       LYS  45  -0.544   8.321  14.591
  336    H    ASP  46           H        ASP  46  -5.576   8.035   8.456
  337    HA   ASP  46           HA       ASP  46  -7.352   6.090   9.422
  338   1HB   ASP  46          2HB       ASP  46  -7.561   8.329   7.434
  339   2HB   ASP  46          3HB       ASP  46  -8.800   7.079   7.363
  340    H    VAL  47           H        VAL  47  -6.182   6.398   6.009
  341    HA   VAL  47           HA       VAL  47  -7.494   4.052   5.184
  342    HB   VAL  47           HB       VAL  47  -6.118   3.947   3.240
  343   1HG1  VAL  47          1HG1      VAL  47  -6.603   6.889   3.752
  344   2HG1  VAL  47          2HG1      VAL  47  -6.820   5.970   2.262
  345   3HG1  VAL  47          3HG1      VAL  47  -7.942   5.755   3.625
  346   1HG2  VAL  47          1HG2      VAL  47  -4.321   5.441   2.747
  347   2HG2  VAL  47          2HG2      VAL  47  -4.462   6.095   4.382
  348   3HG2  VAL  47          3HG2      VAL  47  -3.898   4.422   4.142
  349    H    PHE  48           H        PHE  48  -4.194   4.305   6.628
  350    HA   PHE  48           HA       PHE  48  -3.610   1.542   6.532
  351   1HB   PHE  48          2HB       PHE  48  -2.966   3.388   8.826
  352   2HB   PHE  48          3HB       PHE  48  -2.208   1.844   8.461
  353    HD1  PHE  48           HD1      PHE  48  -2.214   2.665   5.246
  354    HD2  PHE  48           HD2      PHE  48  -0.693   4.309   8.946
  355    HE1  PHE  48           HE1      PHE  48  -0.500   3.902   3.997
  356    HE2  PHE  48           HE2      PHE  48   1.009   5.539   7.684
  357    HZ   PHE  48           HZ       PHE  48   1.127   5.351   5.206
  358    H    ARG  49           H        ARG  49  -5.738   3.259   8.865
  359    HA   ARG  49           HA       ARG  49  -6.113   0.978  10.581
  360   1HB   ARG  49          2HB       ARG  49  -8.147   3.158   9.960
  361   2HB   ARG  49          3HB       ARG  49  -8.197   1.999  11.286
  362   1HG   ARG  49          2HG       ARG  49  -6.075   2.935  12.197
  363   2HG   ARG  49          3HG       ARG  49  -6.046   4.112  10.882
  364   1HD   ARG  49          2HD       ARG  49  -7.002   5.307  12.711
  365   2HD   ARG  49          3HD       ARG  49  -8.294   4.956  11.589
  366    HE   ARG  49           HE       ARG  49  -9.344   3.634  13.129
  367   1HH1  ARG  49          2HH2      ARG  49  -6.019   4.087  14.144
  368   2HH1  ARG  49          1HH2      ARG  49  -6.226   3.476  15.760
  369   1HH2  ARG  49          2HH1      ARG  49  -9.688   2.772  15.262
  370   2HH2  ARG  49          1HH1      ARG  49  -8.379   2.687  16.393
  371    H    PHE  50           H        PHE  50  -7.722   2.016   7.511
  372    HA   PHE  50           HA       PHE  50  -9.549  -0.229   7.564
  373   1HB   PHE  50          2HB       PHE  50  -8.657   1.323   5.137
  374   2HB   PHE  50          3HB       PHE  50 -10.155   0.419   5.352
  375    HD1  PHE  50           HD1      PHE  50 -10.970   1.455   8.137
  376    HD2  PHE  50           HD2      PHE  50  -9.559   3.471   4.596
  377    HE1  PHE  50           HE1      PHE  50 -11.707   3.619   9.067
  378    HE2  PHE  50           HE2      PHE  50 -10.166   5.654   5.607
  379    HZ   PHE  50           HZ       PHE  50 -11.210   5.735   7.858
  380    H    ILE  51           H        ILE  51  -6.235   0.239   6.324
  381    HA   ILE  51           HA       ILE  51  -6.137  -2.232   4.869
  382    HB   ILE  51           HB       ILE  51  -3.811  -0.803   6.170
  383   1HG1  ILE  51          2HG1      ILE  51  -4.632   0.812   4.642
  384   2HG1  ILE  51          3HG1      ILE  51  -3.360  -0.019   3.786
  385   1HG2  ILE  51          1HG2      ILE  51  -3.382  -3.193   5.483
  386   2HG2  ILE  51          2HG2      ILE  51  -3.824  -2.746   3.833
  387   3HG2  ILE  51          3HG2      ILE  51  -2.427  -1.988   4.627
  388   1HD1  ILE  51          1HD1      ILE  51  -6.362  -0.382   3.411
  389   2HD1  ILE  51          2HD1      ILE  51  -5.193   0.357   2.307
  390   3HD1  ILE  51          3HD1      ILE  51  -5.135  -1.384   2.596
  391    H    ASP  52           H        ASP  52  -4.918  -1.534   8.238
  392    HA   ASP  52           HA       ASP  52  -4.376  -4.368   8.610
  393   1HB   ASP  52          2HB       ASP  52  -3.010  -2.601   9.736
  394   2HB   ASP  52          3HB       ASP  52  -4.386  -2.243  10.786
  395    H    ASN  53           H        ASN  53  -6.569  -4.928   7.950
  396    HA   ASN  53           HA       ASN  53  -8.973  -4.646   9.275
  397   1HB   ASN  53          2HB       ASN  53  -8.510  -5.966   7.207
  398   2HB   ASN  53          3HB       ASN  53  -7.763  -7.234   8.171
  399   1HD2  ASN  53          1HD2      ASN  53  -9.099  -8.831   9.019
  400   2HD2  ASN  53          2HD2      ASN  53 -10.852  -8.738   8.994
  401    H    ASP  54           H        ASP  54  -6.385  -6.988   9.997
  402    HA   ASP  54           HA       ASP  54  -7.505  -8.300  12.171
  403   1HB   ASP  54          2HB       ASP  54  -4.558  -7.782  11.624
  404   2HB   ASP  54          3HB       ASP  54  -5.263  -9.176  12.453
  405    H    GLN  55           H        GLN  55  -6.150  -5.106  12.043
  406    HA   GLN  55           HA       GLN  55  -5.664  -3.527  13.476
  407   1HB   GLN  55          2HB       GLN  55  -7.263  -2.974  14.947
  408   2HB   GLN  55          3HB       GLN  55  -8.101  -4.238  14.053
  409   1HG   GLN  55          2HG       GLN  55  -7.298  -5.817  15.993
  410   2HG   GLN  55          3HG       GLN  55  -6.906  -4.325  16.842
  411   1HE2  GLN  55          1HE2      GLN  55  -8.564  -3.474  18.090
  412   2HE2  GLN  55          2HE2      GLN  55 -10.256  -3.888  17.857
  413    H    SER  56           H        SER  56  -4.153  -6.229  13.750
  414    HA   SER  56           HA       SER  56  -3.338  -6.467  16.417
  415   1HB   SER  56          2HB       SER  56  -1.499  -7.911  15.297
  416   2HB   SER  56          3HB       SER  56  -3.204  -8.351  15.096
  417    HG   SER  56           HG       SER  56  -2.253  -8.430  13.086
  418    H    GLY  57           H        GLY  57  -2.338  -3.992  14.253
  419   1HA   GLY  57          1HA       GLY  57  -1.063  -2.175  14.898
  420   2HA   GLY  57          2HA       GLY  57  -0.526  -3.031  16.347
  421    H    TYR  58           H        TYR  58  -0.308  -4.174  13.021
  422    HA   TYR  58           HA       TYR  58   2.269  -3.348  12.282
  423   1HB   TYR  58          2HB       TYR  58   2.087  -6.020  13.705
  424   2HB   TYR  58          3HB       TYR  58   3.010  -5.954  12.216
  425    HD1  TYR  58           HD1      TYR  58   4.584  -3.751  12.024
  426    HD2  TYR  58           HD2      TYR  58   3.574  -5.946  15.582
  427    HE1  TYR  58           HE1      TYR  58   6.670  -2.961  13.082
  428    HE2  TYR  58           HE2      TYR  58   5.721  -5.250  16.610
  429    HH   TYR  58           HH       TYR  58   7.685  -2.734  15.340
  430    H    LEU  59           H        LEU  59   2.481  -3.778  10.083
  431    HA   LEU  59           HA       LEU  59   0.180  -5.209   8.795
  432   1HB   LEU  59          2HB       LEU  59   2.069  -3.019   7.916
  433   2HB   LEU  59          3HB       LEU  59   1.124  -3.976   6.765
  434    HG   LEU  59           HG       LEU  59   0.100  -1.819   7.221
  435   1HD1  LEU  59          1HD1      LEU  59  -1.652  -4.088   8.239
  436   2HD1  LEU  59          2HD1      LEU  59  -2.158  -2.578   7.465
  437   3HD1  LEU  59          3HD1      LEU  59  -1.249  -3.785   6.537
  438   1HD2  LEU  59          1HD2      LEU  59   0.768  -1.587   9.627
  439   2HD2  LEU  59          2HD2      LEU  59  -0.929  -1.206   9.280
  440   3HD2  LEU  59          3HD2      LEU  59  -0.518  -2.747  10.042
  441    H    ASP  60           H        ASP  60   1.430  -7.043   9.776
  442    HA   ASP  60           HA       ASP  60   3.853  -7.993   8.843
  443   1HB   ASP  60          2HB       ASP  60   1.379  -9.665   9.437
  444   2HB   ASP  60          3HB       ASP  60   3.070 -10.135   9.665
  445    H    GLU  61           H        GLU  61   4.497  -9.376   7.091
  446    HA   GLU  61           HA       GLU  61   3.649  -8.802   4.588
  447   1HB   GLU  61          2HB       GLU  61   4.936 -11.366   5.602
  448   2HB   GLU  61          3HB       GLU  61   4.515 -11.119   3.907
  449   1HG   GLU  61          2HG       GLU  61   5.846  -8.937   3.993
  450   2HG   GLU  61          3HG       GLU  61   6.546  -9.553   5.502
  451    H    GLU  62           H        GLU  62   2.458 -11.670   6.407
  452    HA   GLU  62           HA       GLU  62   0.898 -12.491   4.170
  453   1HB   GLU  62          2HB       GLU  62   1.858 -13.954   6.027
  454   2HB   GLU  62          3HB       GLU  62   0.442 -13.509   6.997
  455   1HG   GLU  62          2HG       GLU  62  -1.048 -14.484   5.342
  456   2HG   GLU  62          3HG       GLU  62   0.268 -14.606   4.152
  457    H    GLU  63           H        GLU  63   0.250 -10.095   6.598
  458    HA   GLU  63           HA       GLU  63  -2.645 -10.041   6.084
  459   1HB   GLU  63          2HB       GLU  63  -0.830  -7.947   7.299
  460   2HB   GLU  63          3HB       GLU  63  -2.594  -7.949   7.285
  461   1HG   GLU  63          2HG       GLU  63  -2.649  -9.919   8.758
  462   2HG   GLU  63          3HG       GLU  63  -0.871  -9.991   8.771
  463    H    LEU  64           H        LEU  64   0.350  -8.303   5.202
  464    HA   LEU  64           HA       LEU  64  -0.746  -6.442   3.384
  465   1HB   LEU  64          2HB       LEU  64   1.394  -5.956   3.983
  466   2HB   LEU  64          3HB       LEU  64   1.923  -7.617   3.897
  467    HG   LEU  64           HG       LEU  64   1.998  -7.507   1.422
  468   1HD1  LEU  64          1HD1      LEU  64   0.510  -5.637   0.869
  469   2HD1  LEU  64          2HD1      LEU  64   1.466  -4.528   1.871
  470   3HD1  LEU  64          3HD1      LEU  64   2.138  -5.230   0.380
  471   1HD2  LEU  64          1HD2      LEU  64   3.628  -5.459   2.986
  472   2HD2  LEU  64          2HD2      LEU  64   3.997  -7.187   2.808
  473   3HD2  LEU  64          3HD2      LEU  64   4.064  -6.118   1.400
  474    H    LYS  65           H        LYS  65  -0.088  -9.897   2.932
  475    HA   LYS  65           HA       LYS  65  -0.534 -10.144   0.206
  476   1HB   LYS  65          2HB       LYS  65  -0.070 -11.981   1.893
  477   2HB   LYS  65          3HB       LYS  65  -1.812 -11.981   2.245
  478   1HG   LYS  65          2HG       LYS  65  -2.304 -12.583  -0.100
  479   2HG   LYS  65          3HG       LYS  65  -0.599 -12.414  -0.522
  480   1HD   LYS  65          2HD       LYS  65  -1.267 -14.742  -0.321
  481   2HD   LYS  65          3HD       LYS  65  -0.025 -14.344   0.879
  482   1HE   LYS  65          2HE       LYS  65  -1.587 -14.342   2.688
  483   2HE   LYS  65          3HE       LYS  65  -2.984 -14.219   1.609
  484   1HZ   LYS  65          1HZ       LYS  65  -2.704 -16.412   2.542
  485   2HZ   LYS  65          2HZ       LYS  65  -2.593 -16.450   0.900
  486   3HZ   LYS  65          3HZ       LYS  65  -1.236 -16.582   1.840
  487    H    PHE  66           H        PHE  66  -2.924  -8.853   2.449
  488    HA   PHE  66           HA       PHE  66  -4.724  -8.640   0.102
  489   1HB   PHE  66          2HB       PHE  66  -6.673  -8.737   1.716
  490   2HB   PHE  66          3HB       PHE  66  -5.817 -10.239   1.453
  491    HD1  PHE  66           HD1      PHE  66  -4.782 -11.430   3.262
  492    HD2  PHE  66           HD2      PHE  66  -6.250  -7.422   3.911
  493    HE1  PHE  66           HE1      PHE  66  -4.650 -11.768   5.710
  494    HE2  PHE  66           HE2      PHE  66  -5.996  -7.745   6.361
  495    HZ   PHE  66           HZ       PHE  66  -5.270  -9.927   7.262
  496    H    PHE  67           H        PHE  67  -2.655  -6.805   0.950
  497    HA   PHE  67           HA       PHE  67  -3.680  -4.596   2.373
  498   1HB   PHE  67          2HB       PHE  67  -1.359  -4.871   1.919
  499   2HB   PHE  67          3HB       PHE  67  -1.585  -4.807   0.188
  500    HD1  PHE  67           HD1      PHE  67  -0.828  -2.921   3.157
  501    HD2  PHE  67           HD2      PHE  67  -2.087  -2.636  -0.943
  502    HE1  PHE  67           HE1      PHE  67  -0.251  -0.511   3.143
  503    HE2  PHE  67           HE2      PHE  67  -1.618  -0.211  -0.929
  504    HZ   PHE  67           HZ       PHE  67  -0.687   0.863   1.115
  505    H    LEU  68           H        LEU  68  -3.346  -4.691  -1.230
  506    HA   LEU  68           HA       LEU  68  -5.343  -2.587  -1.457
  507   1HB   LEU  68          2HB       LEU  68  -3.108  -3.185  -2.879
  508   2HB   LEU  68          3HB       LEU  68  -4.316  -4.032  -3.822
  509    HG   LEU  68           HG       LEU  68  -5.563  -1.745  -3.874
  510   1HD1  LEU  68          1HD1      LEU  68  -4.200  -0.702  -2.030
  511   2HD1  LEU  68          2HD1      LEU  68  -2.751  -0.880  -3.039
  512   3HD1  LEU  68          3HD1      LEU  68  -4.059   0.201  -3.552
  513   1HD2  LEU  68          1HD2      LEU  68  -4.504  -2.584  -5.871
  514   2HD2  LEU  68          2HD2      LEU  68  -4.016  -0.899  -5.691
  515   3HD2  LEU  68          3HD2      LEU  68  -2.884  -2.197  -5.250
  516    H    GLN  69           H        GLN  69  -5.618  -5.979  -1.293
  517    HA   GLN  69           HA       GLN  69  -7.800  -6.601  -3.009
  518   1HB   GLN  69          2HB       GLN  69  -7.119  -7.565  -0.215
  519   2HB   GLN  69          3HB       GLN  69  -8.413  -8.255  -1.186
  520   1HG   GLN  69          2HG       GLN  69  -5.501  -8.270  -2.045
  521   2HG   GLN  69          3HG       GLN  69  -6.336  -9.591  -1.225
  522   1HE2  GLN  69          1HE2      GLN  69  -5.757  -8.095  -4.308
  523   2HE2  GLN  69          2HE2      GLN  69  -6.805  -9.190  -5.205
  524    H    LYS  70           H        LYS  70  -7.622  -4.490  -0.202
  525    HA   LYS  70           HA       LYS  70 -10.488  -4.616   0.407
  526   1HB   LYS  70          2HB       LYS  70  -8.497  -2.570   1.417
  527   2HB   LYS  70          3HB       LYS  70 -10.022  -3.115   2.138
  528   1HG   LYS  70          2HG       LYS  70  -8.792  -5.508   2.132
  529   2HG   LYS  70          3HG       LYS  70  -7.345  -4.524   1.952
  530   1HD   LYS  70          2HD       LYS  70  -7.518  -4.895   4.239
  531   2HD   LYS  70          3HD       LYS  70  -8.028  -3.228   4.003
  532   1HE   LYS  70          2HE       LYS  70 -10.289  -5.187   3.835
  533   2HE   LYS  70          3HE       LYS  70  -9.413  -5.292   5.356
  534   1HZ   LYS  70          1HZ       LYS  70 -11.158  -3.747   5.572
  535   2HZ   LYS  70          2HZ       LYS  70  -9.718  -2.945   5.652
  536   3HZ   LYS  70          3HZ       LYS  70 -10.630  -2.855   4.283
  537    H    PHE  71           H        PHE  71  -8.511  -3.001  -1.900
  538    HA   PHE  71           HA       PHE  71 -10.401  -0.710  -2.245
  539   1HB   PHE  71          2HB       PHE  71  -7.674  -1.235  -3.462
  540   2HB   PHE  71          3HB       PHE  71  -8.677   0.181  -3.702
  541    HD1  PHE  71           HD1      PHE  71  -8.961  -0.406  -0.213
  542    HD2  PHE  71           HD2      PHE  71  -6.200   0.955  -3.225
  543    HE1  PHE  71           HE1      PHE  71  -7.672   0.794   1.503
  544    HE2  PHE  71           HE2      PHE  71  -5.011   2.303  -1.523
  545    HZ   PHE  71           HZ       PHE  71  -5.751   2.232   0.847
  546    H    GLU  72           H        GLU  72  -8.629  -3.281  -4.015
  547    HA   GLU  72           HA       GLU  72 -10.742  -3.354  -6.128
  548   1HB   GLU  72          2HB       GLU  72  -7.932  -2.871  -6.422
  549   2HB   GLU  72          3HB       GLU  72  -8.175  -4.554  -6.886
  550   1HG   GLU  72          2HG       GLU  72  -9.732  -2.192  -8.024
  551   2HG   GLU  72          3HG       GLU  72  -8.312  -2.932  -8.774
  552    H    SER  73           H        SER  73 -10.870  -5.672  -6.965
  553    HA   SER  73           HA       SER  73 -10.771  -7.616  -4.683
  554   1HB   SER  73          2HB       SER  73 -12.037  -7.865  -7.446
  555   2HB   SER  73          3HB       SER  73 -12.171  -9.013  -6.098
  556    HG   SER  73           HG       SER  73 -12.981  -6.980  -4.945
  557    H    GLY  74           H        GLY  74  -9.420  -6.772  -7.813
  558   1HA   GLY  74          1HA       GLY  74  -7.861  -9.352  -7.984
  559   2HA   GLY  74          2HA       GLY  74  -8.490  -8.434  -9.361
  560    H    ALA  75           H        ALA  75  -6.988  -7.196  -6.389
  561    HA   ALA  75           HA       ALA  75  -5.141  -5.541  -7.893
  562   1HB   ALA  75          1HB       ALA  75  -4.376  -4.811  -5.762
  563   2HB   ALA  75          2HB       ALA  75  -6.142  -4.813  -5.758
  564   3HB   ALA  75          3HB       ALA  75  -5.262  -6.101  -4.908
  565    H    ARG  76           H        ARG  76  -2.739  -5.765  -6.325
  566    HA   ARG  76           HA       ARG  76  -1.679  -7.903  -8.063
  567   1HB   ARG  76          2HB       ARG  76  -0.941  -5.278  -7.823
  568   2HB   ARG  76          3HB       ARG  76   0.094  -5.984  -6.578
  569   1HG   ARG  76          2HG       ARG  76   1.318  -6.019  -8.607
  570   2HG   ARG  76          3HG       ARG  76   0.843  -7.688  -8.301
  571   1HD   ARG  76          2HD       ARG  76  -0.272  -7.769 -10.331
  572   2HD   ARG  76          3HD       ARG  76  -1.329  -6.478  -9.803
  573    HE   ARG  76           HE       ARG  76  -0.212  -4.948 -11.071
  574   1HH1  ARG  76          2HH2      ARG  76   1.740  -7.865 -10.775
  575   2HH1  ARG  76          1HH2      ARG  76   3.187  -7.004 -11.233
  576   1HH2  ARG  76          2HH1      ARG  76   1.615  -4.056 -12.137
  577   2HH2  ARG  76          1HH1      ARG  76   3.005  -5.076 -12.493
  578    H    GLU  77           H        GLU  77  -2.284  -7.280  -4.825
  579    HA   GLU  77           HA       GLU  77  -0.351  -7.934  -3.316
  580   1HB   GLU  77          2HB       GLU  77  -2.928  -9.282  -2.565
  581   2HB   GLU  77          3HB       GLU  77  -1.795  -8.340  -1.577
  582   1HG   GLU  77          2HG       GLU  77  -3.913  -7.370  -3.513
  583   2HG   GLU  77          3HG       GLU  77  -3.712  -7.000  -1.794
  584    H    LEU  78           H        LEU  78  -2.287 -10.452  -4.772
  585    HA   LEU  78           HA       LEU  78  -1.198 -12.779  -3.774
  586   1HB   LEU  78          2HB       LEU  78  -1.791 -12.496  -6.735
  587   2HB   LEU  78          3HB       LEU  78  -1.883 -13.921  -5.712
  588    HG   LEU  78           HG       LEU  78  -4.070 -13.509  -5.949
  589   1HD1  LEU  78          1HD1      LEU  78  -3.624 -13.347  -3.497
  590   2HD1  LEU  78          2HD1      LEU  78  -3.734 -11.576  -3.627
  591   3HD1  LEU  78          3HD1      LEU  78  -5.124 -12.578  -4.039
  592   1HD2  LEU  78          1HD2      LEU  78  -3.958 -11.652  -7.428
  593   2HD2  LEU  78          2HD2      LEU  78  -5.163 -11.299  -6.181
  594   3HD2  LEU  78          3HD2      LEU  78  -3.576 -10.520  -6.125
  595    H    THR  79           H        THR  79   0.289 -10.727  -6.357
  596    HA   THR  79           HA       THR  79   2.480 -12.560  -6.819
  597    HB   THR  79           HB       THR  79   2.339  -9.584  -7.453
  598    HG1  THR  79           1HG      THR  79   2.288 -11.032  -9.554
  599   1HG2  THR  79          1HG2      THR  79   4.122 -10.233  -9.113
  600   2HG2  THR  79          2HG2      THR  79   4.654 -10.539  -7.458
  601   3HG2  THR  79          3HG2      THR  79   4.110 -11.880  -8.469
  602    H    GLU  80           H        GLU  80   3.630 -13.043  -5.087
  603    HA   GLU  80           HA       GLU  80   4.208 -11.469  -2.847
  604   1HB   GLU  80          2HB       GLU  80   6.032 -13.588  -4.049
  605   2HB   GLU  80          3HB       GLU  80   6.199 -12.772  -2.481
  606   1HG   GLU  80          2HG       GLU  80   4.002 -13.671  -1.764
  607   2HG   GLU  80          3HG       GLU  80   3.906 -14.599  -3.272
  608    H    SER  81           H        SER  81   6.059 -11.627  -5.915
  609    HA   SER  81           HA       SER  81   8.316 -10.144  -5.160
  610   1HB   SER  81          2HB       SER  81   8.045 -11.352  -7.324
  611   2HB   SER  81          3HB       SER  81   6.878 -10.130  -7.852
  612    HG   SER  81           HG       SER  81   8.731  -9.576  -8.685
  613    H    GLU  82           H        GLU  82   5.281  -8.895  -6.616
  614    HA   GLU  82           HA       GLU  82   5.997  -6.144  -6.526
  615   1HB   GLU  82          2HB       GLU  82   3.243  -7.455  -6.534
  616   2HB   GLU  82          3HB       GLU  82   3.595  -5.805  -7.035
  617   1HG   GLU  82          2HG       GLU  82   4.841  -8.218  -8.461
  618   2HG   GLU  82          3HG       GLU  82   3.254  -7.584  -8.869
  619    H    THR  83           H        THR  83   4.006  -8.231  -4.393
  620    HA   THR  83           HA       THR  83   3.428  -6.349  -2.430
  621    HB   THR  83           HB       THR  83   3.445  -9.286  -2.649
  622    HG1  THR  83           1HG      THR  83   1.777  -8.184  -0.898
  623   1HG2  THR  83          1HG2      THR  83   4.838  -9.368  -0.675
  624   2HG2  THR  83          2HG2      THR  83   3.847  -8.146   0.140
  625   3HG2  THR  83          3HG2      THR  83   3.180  -9.748  -0.236
  626    H    LYS  84           H        LYS  84   6.394  -8.309  -2.810
  627    HA   LYS  84           HA       LYS  84   7.554  -7.386  -0.336
  628   1HB   LYS  84          2HB       LYS  84   8.567  -9.120  -2.596
  629   2HB   LYS  84          3HB       LYS  84   9.613  -8.595  -1.264
  630   1HG   LYS  84          2HG       LYS  84   8.180  -9.570   0.415
  631   2HG   LYS  84          3HG       LYS  84   6.935  -9.935  -0.776
  632   1HD   LYS  84          2HD       LYS  84   8.289 -11.608  -1.847
  633   2HD   LYS  84          3HD       LYS  84   9.684 -11.220  -0.807
  634   1HE   LYS  84          2HE       LYS  84   8.518 -11.924   1.194
  635   2HE   LYS  84          3HE       LYS  84   6.968 -12.041   0.347
  636   1HZ   LYS  84          1HZ       LYS  84   9.233 -13.825  -0.219
  637   2HZ   LYS  84          2HZ       LYS  84   7.972 -14.154   0.789
  638   3HZ   LYS  84          3HZ       LYS  84   7.680 -13.953  -0.782
  639    H    SER  85           H        SER  85   7.693  -6.323  -3.704
  640    HA   SER  85           HA       SER  85   9.806  -4.427  -3.403
  641   1HB   SER  85          2HB       SER  85   7.328  -4.228  -5.182
  642   2HB   SER  85          3HB       SER  85   8.839  -3.337  -5.353
  643    HG   SER  85           HG       SER  85   8.522  -6.174  -5.512
  644    H    LEU  86           H        LEU  86   6.261  -4.208  -2.836
  645    HA   LEU  86           HA       LEU  86   6.282  -1.547  -1.754
  646   1HB   LEU  86          2HB       LEU  86   4.299  -2.625  -2.566
  647   2HB   LEU  86          3HB       LEU  86   4.370  -3.867  -1.332
  648    HG   LEU  86           HG       LEU  86   2.679  -2.102  -1.002
  649   1HD1  LEU  86          1HD1      LEU  86   4.560  -2.011   1.365
  650   2HD1  LEU  86          2HD1      LEU  86   2.788  -2.050   1.285
  651   3HD1  LEU  86          3HD1      LEU  86   3.717  -3.499   0.886
  652   1HD2  LEU  86          1HD2      LEU  86   4.979  -0.239  -0.286
  653   2HD2  LEU  86          2HD2      LEU  86   4.018  -0.146  -1.780
  654   3HD2  LEU  86          3HD2      LEU  86   3.239   0.097  -0.207
  655    H    MET  87           H        MET  87   6.251  -4.704  -0.001
  656    HA   MET  87           HA       MET  87   6.655  -3.814   2.542
  657   1HB   MET  87          2HB       MET  87   6.454  -6.242   1.783
  658   2HB   MET  87          3HB       MET  87   8.167  -6.164   1.362
  659   1HG   MET  87          2HG       MET  87   8.450  -5.374   3.897
  660   2HG   MET  87          3HG       MET  87   6.866  -6.135   4.066
  661   1HE   MET  87          1HE       MET  87  10.678  -6.527   3.460
  662   2HE   MET  87          2HE       MET  87  10.845  -8.262   3.105
  663   3HE   MET  87          3HE       MET  87  10.104  -7.184   1.905
  664    H    ALA  88           H        ALA  88   9.246  -4.481   0.191
  665    HA   ALA  88           HA       ALA  88  11.501  -4.200   1.710
  666   1HB   ALA  88          1HB       ALA  88  11.011  -3.480  -1.216
  667   2HB   ALA  88          2HB       ALA  88  12.625  -3.590  -0.476
  668   3HB   ALA  88          3HB       ALA  88  11.583  -5.020  -0.564
  669    H    ALA  89           H        ALA  89   9.876  -1.545  -0.086
  670    HA   ALA  89           HA       ALA  89  11.738   0.453   1.000
  671   1HB   ALA  89          1HB       ALA  89   9.200   0.627  -0.622
  672   2HB   ALA  89          2HB       ALA  89  10.163   2.044  -0.157
  673   3HB   ALA  89          3HB       ALA  89  10.892   0.803  -1.190
  674    H    ALA  90           H        ALA  90   8.346  -0.582   1.614
  675    HA   ALA  90           HA       ALA  90   7.611   1.487   3.422
  676   1HB   ALA  90          1HB       ALA  90   6.800  -1.442   3.418
  677   2HB   ALA  90          2HB       ALA  90   5.923  -0.096   4.180
  678   3HB   ALA  90          3HB       ALA  90   6.068  -0.178   2.407
  679    H    ASP  91           H        ASP  91   9.382  -1.564   3.963
  680    HA   ASP  91           HA       ASP  91   9.408  -1.220   6.815
  681   1HB   ASP  91          2HB       ASP  91   9.423  -3.448   5.608
  682   2HB   ASP  91          3HB       ASP  91  11.116  -3.147   5.179
  683    H    ASN  92           H        ASN  92  10.334   0.915   6.975
  684    HA   ASN  92           HA       ASN  92  13.127   1.318   6.186
  685   1HB   ASN  92          2HB       ASN  92  12.952   3.487   7.182
  686   2HB   ASN  92          3HB       ASN  92  11.537   3.173   6.170
  687   1HD2  ASN  92          1HD2      ASN  92  11.251   5.261   7.928
  688   2HD2  ASN  92          2HD2      ASN  92  10.251   4.752   9.265
  689    H    ASP  93           H        ASP  93  12.996  -0.993   7.649
  690    HA   ASP  93           HA       ASP  93  14.675  -0.379  10.047
  691   1HB   ASP  93          2HB       ASP  93  12.566  -2.574   9.763
  692   2HB   ASP  93          3HB       ASP  93  13.877  -2.623  10.934
  693    H    GLY  94           H        GLY  94  13.508  -2.976   7.843
  694   1HA   GLY  94          1HA       GLY  94  14.856  -4.536   6.645
  695   2HA   GLY  94          2HA       GLY  94  16.261  -4.127   7.643
  696    H    ASP  95           H        ASP  95  12.823  -4.726   8.512
  697    HA   ASP  95           HA       ASP  95  13.607  -7.238   9.898
  698   1HB   ASP  95          2HB       ASP  95  12.248  -6.874  11.777
  699   2HB   ASP  95          3HB       ASP  95  13.411  -5.555  11.657
  700    H    GLY  96           H        GLY  96  10.843  -5.311   8.698
  701   1HA   GLY  96          1HA       GLY  96   9.842  -6.191   6.606
  702   2HA   GLY  96          2HA       GLY  96   9.855  -7.814   7.300
  703    H    LYS  97           H        LYS  97   9.101  -6.782   9.974
  704    HA   LYS  97           HA       LYS  97   6.195  -6.588   9.679
  705   1HB   LYS  97          2HB       LYS  97   6.185  -6.322  12.120
  706   2HB   LYS  97          3HB       LYS  97   7.025  -7.771  11.569
  707   1HG   LYS  97          2HG       LYS  97   9.221  -6.653  11.946
  708   2HG   LYS  97          3HG       LYS  97   8.363  -5.212  12.522
  709   1HD   LYS  97          2HD       LYS  97   7.359  -6.582  14.353
  710   2HD   LYS  97          3HD       LYS  97   8.200  -8.003  13.738
  711   1HE   LYS  97          2HE       LYS  97   9.375  -7.003  15.684
  712   2HE   LYS  97          3HE       LYS  97  10.383  -7.044  14.226
  713   1HZ   LYS  97          1HZ       LYS  97  10.052  -4.791  13.881
  714   2HZ   LYS  97          2HZ       LYS  97   8.919  -4.630  15.091
  715   3HZ   LYS  97          3HZ       LYS  97  10.511  -4.945  15.430
  716    H    ILE  98           H        ILE  98   5.299  -4.728   8.944
  717    HA   ILE  98           HA       ILE  98   6.827  -2.194   9.151
  718    HB   ILE  98           HB       ILE  98   4.605  -3.102   7.338
  719   1HG1  ILE  98          2HG1      ILE  98   7.357  -2.215   6.465
  720   2HG1  ILE  98          3HG1      ILE  98   7.234  -3.812   7.172
  721   1HG2  ILE  98          1HG2      ILE  98   6.196  -0.490   7.325
  722   2HG2  ILE  98          2HG2      ILE  98   5.007  -0.987   6.124
  723   3HG2  ILE  98          3HG2      ILE  98   4.485  -0.626   7.773
  724   1HD1  ILE  98          1HD1      ILE  98   5.507  -2.873   4.849
  725   2HD1  ILE  98          2HD1      ILE  98   7.017  -3.799   4.732
  726   3HD1  ILE  98          3HD1      ILE  98   5.599  -4.513   5.534
  727    H    GLY  99           H        GLY  99   6.279  -0.925  10.858
  728   1HA   GLY  99          1HA       GLY  99   3.656  -0.934  12.099
  729   2HA   GLY  99          2HA       GLY  99   4.953   0.245  12.346
  730    H    ALA 100           H        ALA 100   2.234   0.974  12.220
  731    HA   ALA 100           HA       ALA 100   1.405   2.081   9.721
  732   1HB   ALA 100          1HB       ALA 100   0.093   3.639  11.144
  733   2HB   ALA 100          2HB       ALA 100  -0.102   1.948  11.648
  734   3HB   ALA 100          3HB       ALA 100   0.947   3.044  12.580
  735    H    GLU 101           H        GLU 101   3.557   3.212  12.309
  736    HA   GLU 101           HA       GLU 101   4.053   5.800  11.385
  737   1HB   GLU 101          2HB       GLU 101   4.941   4.157  13.503
  738   2HB   GLU 101          3HB       GLU 101   6.424   4.515  12.616
  739   1HG   GLU 101          2HG       GLU 101   6.049   6.900  12.860
  740   2HG   GLU 101          3HG       GLU 101   4.417   6.632  13.508
  741    H    GLU 102           H        GLU 102   5.921   2.800  10.755
  742    HA   GLU 102           HA       GLU 102   7.822   3.753   8.954
  743   1HB   GLU 102          2HB       GLU 102   6.372   1.080   8.823
  744   2HB   GLU 102          3HB       GLU 102   7.961   1.472   8.157
  745   1HG   GLU 102          2HG       GLU 102   8.749   1.878  10.535
  746   2HG   GLU 102          3HG       GLU 102   7.194   1.265  11.110
  747    H    PHE 103           H        PHE 103   4.536   2.437   8.249
  748    HA   PHE 103           HA       PHE 103   4.703   2.963   5.445
  749   1HB   PHE 103          2HB       PHE 103   2.441   2.385   7.351
  750   2HB   PHE 103          3HB       PHE 103   2.076   3.104   5.797
  751    HD1  PHE 103           HD1      PHE 103   3.240   2.173   3.669
  752    HD2  PHE 103           HD2      PHE 103   2.204  -0.013   7.240
  753    HE1  PHE 103           HE1      PHE 103   3.038   0.093   2.338
  754    HE2  PHE 103           HE2      PHE 103   2.116  -2.108   5.894
  755    HZ   PHE 103           HZ       PHE 103   2.490  -2.065   3.483
  756    H    GLN 104           H        GLN 104   3.510   5.060   8.106
  757    HA   GLN 104           HA       GLN 104   2.501   7.204   6.464
  758   1HB   GLN 104          2HB       GLN 104   2.251   6.843   9.037
  759   2HB   GLN 104          3HB       GLN 104   3.839   7.609   9.161
  760   1HG   GLN 104          2HG       GLN 104   2.929   9.533   7.797
  761   2HG   GLN 104          3HG       GLN 104   1.337   8.760   7.837
  762   1HE2  GLN 104          1HE2      GLN 104   2.861  11.257   9.167
  763   2HE2  GLN 104          2HE2      GLN 104   2.186  11.227  10.785
  764    H    GLU 105           H        GLU 105   5.775   6.673   7.945
  765    HA   GLU 105           HA       GLU 105   7.153   8.848   6.836
  766   1HB   GLU 105          2HB       GLU 105   7.866   6.027   7.629
  767   2HB   GLU 105          3HB       GLU 105   9.031   6.896   6.643
  768   1HG   GLU 105          2HG       GLU 105   7.887   8.257   9.094
  769   2HG   GLU 105          3HG       GLU 105   9.156   7.034   9.257
  770    H    MET 106           H        MET 106   6.804   5.577   5.329
  771    HA   MET 106           HA       MET 106   8.195   6.438   3.025
  772   1HB   MET 106          2HB       MET 106   7.163   3.970   3.955
  773   2HB   MET 106          3HB       MET 106   6.362   4.230   2.401
  774   1HG   MET 106          2HG       MET 106   9.341   4.349   2.995
  775   2HG   MET 106          3HG       MET 106   8.524   3.062   2.110
  776   1HE   MET 106          1HE       MET 106  11.008   3.865   0.879
  777   2HE   MET 106          2HE       MET 106  11.054   5.295  -0.182
  778   3HE   MET 106          3HE       MET 106  11.032   5.496   1.581
  779    H    VAL 107           H        VAL 107   4.703   6.272   3.664
  780    HA   VAL 107           HA       VAL 107   3.882   7.166   1.064
  781    HB   VAL 107           HB       VAL 107   2.544   7.230   3.798
  782   1HG1  VAL 107          1HG1      VAL 107   1.520   9.016   2.525
  783   2HG1  VAL 107          2HG1      VAL 107   1.507   8.012   1.056
  784   3HG1  VAL 107          3HG1      VAL 107   0.442   7.616   2.419
  785   1HG2  VAL 107          1HG2      VAL 107   2.929   4.966   2.700
  786   2HG2  VAL 107          2HG2      VAL 107   1.212   5.385   2.854
  787   3HG2  VAL 107          3HG2      VAL 107   2.024   5.567   1.297
  788    H    HIS 108           H        HIS 108   4.944   8.929   3.997
  789    HA   HIS 108           HA       HIS 108   3.800  11.429   3.281
  790   1HB   HIS 108          2HB       HIS 108   4.285  10.898   5.568
  791   2HB   HIS 108          3HB       HIS 108   5.996  10.622   5.214
  792    HD1  HIS 108           1HD      HIS 108   3.485  13.532   5.501
  793    HD2  HIS 108           2HD      HIS 108   7.602  12.668   5.451
  794    HE1  HIS 108           1HE      HIS 108   4.692  15.660   6.247
  795    H    SER 109           H        SER 109   6.650   9.682   2.358
  796    HA   SER 109           HA       SER 109   8.283  11.823   1.532
  797   1HB   SER 109          2HB       SER 109   9.082   9.469   1.880
  798   2HB   SER 109          3HB       SER 109   8.183   9.002   0.414
  799    HG   SER 109           HG       SER 109   9.413  10.822  -0.569
  Start of MODEL    2
    1   1H    MET   1           H1       MET   1 -15.705   0.588   2.445
    2   2H    MET   1           H2       MET   1 -16.468   0.441   0.991
    3   3H    MET   1           H3       MET   1 -15.051   1.276   1.104
    4    HA   MET   1           HA       MET   1 -16.923   2.796   0.941
    5   1HB   MET   1          2HB       MET   1 -17.766   1.222   3.394
    6   2HB   MET   1          3HB       MET   1 -18.377   2.846   3.045
    7   1HG   MET   1          2HG       MET   1 -19.343   2.162   0.960
    8   2HG   MET   1          3HG       MET   1 -18.694   0.519   1.115
    9   1HE   MET   1          1HE       MET   1 -21.790   1.454   0.569
   10   2HE   MET   1          2HE       MET   1 -21.207  -0.230   0.504
   11   3HE   MET   1          3HE       MET   1 -22.612   0.191   1.513
   12    H    SER   2           H        SER   2 -14.630   3.665   1.137
   13    HA   SER   2           HA       SER   2 -14.533   5.510   3.293
   14   1HB   SER   2          2HB       SER   2 -12.215   3.507   3.287
   15   2HB   SER   2          3HB       SER   2 -12.454   4.905   4.344
   16    HG   SER   2           HG       SER   2 -14.526   3.598   4.843
   17    H    ILE   3           H        ILE   3 -12.163   3.784   1.275
   18    HA   ILE   3           HA       ILE   3 -10.972   6.340   0.450
   19    HB   ILE   3           HB       ILE   3  -9.081   5.080  -0.167
   20   1HG1  ILE   3          2HG1      ILE   3  -9.331   2.442   0.202
   21   2HG1  ILE   3          3HG1      ILE   3 -10.963   2.723  -0.359
   22   1HG2  ILE   3          1HG2      ILE   3  -8.484   4.016   1.869
   23   2HG2  ILE   3          2HG2      ILE   3  -9.657   5.280   2.298
   24   3HG2  ILE   3          3HG2      ILE   3 -10.146   3.575   2.248
   25   1HD1  ILE   3          1HD1      ILE   3  -9.535   2.146  -2.246
   26   2HD1  ILE   3          2HD1      ILE   3  -9.910   3.859  -2.434
   27   3HD1  ILE   3          3HD1      ILE   3  -8.338   3.369  -1.783
   28    H    THR   4           H        THR   4 -12.904   3.709  -0.959
   29    HA   THR   4           HA       THR   4 -12.334   3.973  -3.604
   30    HB   THR   4           HB       THR   4 -13.240   2.009  -2.355
   31    HG1  THR   4           1HG      THR   4 -14.532   3.279  -4.370
   32   1HG2  THR   4          1HG2      THR   4 -14.867   3.235  -0.814
   33   2HG2  THR   4          2HG2      THR   4 -15.867   3.592  -2.230
   34   3HG2  THR   4          3HG2      THR   4 -15.612   1.915  -1.736
   35    H    ASP   5           H        ASP   5 -14.013   6.201  -1.588
   36    HA   ASP   5           HA       ASP   5 -15.145   7.540  -3.965
   37   1HB   ASP   5          2HB       ASP   5 -16.933   6.164  -2.825
   38   2HB   ASP   5          3HB       ASP   5 -16.654   7.105  -1.345
   39    H    VAL   6           H        VAL   6 -12.694   7.846  -2.259
   40    HA   VAL   6           HA       VAL   6 -13.248  10.589  -1.186
   41    HB   VAL   6           HB       VAL   6 -12.012   8.710   0.153
   42   1HG1  VAL   6          1HG1      VAL   6  -9.560   9.905  -1.070
   43   2HG1  VAL   6          2HG1      VAL   6  -9.696   8.581   0.087
   44   3HG1  VAL   6          3HG1      VAL   6 -10.233   8.340  -1.577
   45   1HG2  VAL   6          1HG2      VAL   6 -12.412  10.954   0.998
   46   2HG2  VAL   6          2HG2      VAL   6 -10.765  10.429   1.389
   47   3HG2  VAL   6          3HG2      VAL   6 -11.033  11.575   0.057
   48    H    LEU   7           H        LEU   7 -11.206   8.761  -3.384
   49    HA   LEU   7           HA       LEU   7 -10.722  10.747  -5.309
   50   1HB   LEU   7          2HB       LEU   7  -9.659  12.076  -3.629
   51   2HB   LEU   7          3HB       LEU   7  -8.845  10.701  -2.912
   52    HG   LEU   7           HG       LEU   7  -7.959  11.012  -5.677
   53   1HD1  LEU   7          1HD1      LEU   7  -6.854  13.223  -5.288
   54   2HD1  LEU   7          2HD1      LEU   7  -8.632  13.350  -5.307
   55   3HD1  LEU   7          3HD1      LEU   7  -7.763  13.370  -3.756
   56   1HD2  LEU   7          1HD2      LEU   7  -6.547  11.342  -2.976
   57   2HD2  LEU   7          2HD2      LEU   7  -6.745   9.800  -3.835
   58   3HD2  LEU   7          3HD2      LEU   7  -5.773  11.086  -4.550
   59    H    SER   8           H        SER   8  -8.889   8.473  -3.238
   60    HA   SER   8           HA       SER   8  -7.065   7.494  -4.837
   61   1HB   SER   8          2HB       SER   8  -7.816   5.216  -3.384
   62   2HB   SER   8          3HB       SER   8  -6.649   6.464  -2.947
   63    HG   SER   8           HG       SER   8  -9.440   6.467  -2.324
   64    H    ALA   9           H        ALA   9 -10.434   6.511  -5.190
   65    HA   ALA   9           HA       ALA   9 -10.226   4.153  -6.682
   66   1HB   ALA   9          1HB       ALA   9 -12.337   5.159  -5.970
   67   2HB   ALA   9          2HB       ALA   9 -12.078   6.537  -7.068
   68   3HB   ALA   9          3HB       ALA   9 -12.343   4.905  -7.729
   69    H    ASP  10           H        ASP  10  -9.835   7.560  -7.832
   70    HA   ASP  10           HA       ASP  10  -9.545   6.769 -10.614
   71   1HB   ASP  10          2HB       ASP  10 -10.295   9.031  -9.827
   72   2HB   ASP  10          3HB       ASP  10  -8.647   9.336  -9.241
   73    H    ASP  11           H        ASP  11  -7.367   7.488  -7.888
   74    HA   ASP  11           HA       ASP  11  -4.942   7.523  -9.342
   75   1HB   ASP  11          2HB       ASP  11  -5.347   6.807  -6.407
   76   2HB   ASP  11          3HB       ASP  11  -3.898   7.432  -7.207
   77    H    ILE  12           H        ILE  12  -6.658   4.898  -7.553
   78    HA   ILE  12           HA       ILE  12  -4.680   2.948  -8.097
   79    HB   ILE  12           HB       ILE  12  -6.218   1.351  -7.415
   80   1HG1  ILE  12          2HG1      ILE  12  -8.304   3.447  -7.203
   81   2HG1  ILE  12          3HG1      ILE  12  -8.317   2.080  -8.320
   82   1HG2  ILE  12          1HG2      ILE  12  -6.426   2.065  -5.078
   83   2HG2  ILE  12          2HG2      ILE  12  -4.883   2.556  -5.771
   84   3HG2  ILE  12          3HG2      ILE  12  -6.174   3.748  -5.552
   85   1HD1  ILE  12          1HD1      ILE  12  -9.811   1.531  -6.565
   86   2HD1  ILE  12          2HD1      ILE  12  -8.357   0.549  -6.303
   87   3HD1  ILE  12          3HD1      ILE  12  -8.660   2.002  -5.309
   88    H    ALA  13           H        ALA  13  -7.673   3.929  -9.833
   89    HA   ALA  13           HA       ALA  13  -7.526   1.964 -11.877
   90   1HB   ALA  13          1HB       ALA  13  -8.730   3.604 -13.289
   91   2HB   ALA  13          2HB       ALA  13  -9.455   3.402 -11.681
   92   3HB   ALA  13          3HB       ALA  13  -8.492   4.846 -12.050
   93    H    ALA  14           H        ALA  14  -5.781   5.110 -11.572
   94    HA   ALA  14           HA       ALA  14  -4.272   4.765 -13.987
   95   1HB   ALA  14          1HB       ALA  14  -2.754   6.430 -13.107
   96   2HB   ALA  14          2HB       ALA  14  -4.434   6.915 -12.801
   97   3HB   ALA  14          3HB       ALA  14  -3.436   6.278 -11.481
   98    H    ALA  15           H        ALA  15  -3.340   4.024 -10.584
   99    HA   ALA  15           HA       ALA  15  -0.833   2.977 -10.892
  100   1HB   ALA  15          1HB       ALA  15  -2.109   3.326  -8.718
  101   2HB   ALA  15          2HB       ALA  15  -2.930   1.791  -9.036
  102   3HB   ALA  15          3HB       ALA  15  -1.177   1.818  -8.822
  103    H    LEU  16           H        LEU  16  -3.897   1.311 -11.162
  104    HA   LEU  16           HA       LEU  16  -3.169  -1.328 -11.540
  105   1HB   LEU  16          2HB       LEU  16  -5.460  -0.802 -11.228
  106   2HB   LEU  16          3HB       LEU  16  -5.448   0.386 -12.526
  107    HG   LEU  16           HG       LEU  16  -5.320  -1.382 -14.231
  108   1HD1  LEU  16          1HD1      LEU  16  -4.209  -3.183 -12.914
  109   2HD1  LEU  16          2HD1      LEU  16  -5.647  -3.301 -11.876
  110   3HD1  LEU  16          3HD1      LEU  16  -5.749  -3.727 -13.597
  111   1HD2  LEU  16          1HD2      LEU  16  -7.597  -1.708 -12.242
  112   2HD2  LEU  16          2HD2      LEU  16  -7.472  -0.442 -13.481
  113   3HD2  LEU  16          3HD2      LEU  16  -7.628  -2.139 -13.965
  114    H    GLN  17           H        GLN  17  -3.329   1.348 -13.935
  115    HA   GLN  17           HA       GLN  17  -2.704  -0.534 -16.141
  116   1HB   GLN  17          2HB       GLN  17  -3.326   2.432 -16.131
  117   2HB   GLN  17          3HB       GLN  17  -2.934   1.454 -17.562
  118   1HG   GLN  17          2HG       GLN  17  -4.839  -0.087 -16.988
  119   2HG   GLN  17          3HG       GLN  17  -5.268   0.991 -15.649
  120   1HE2  GLN  17          1HE2      GLN  17  -7.335   1.528 -16.483
  121   2HE2  GLN  17          2HE2      GLN  17  -7.521   2.455 -17.963
  122    H    GLU  18           H        GLU  18  -1.219   2.175 -14.361
  123    HA   GLU  18           HA       GLU  18   1.019   2.316 -16.127
  124   1HB   GLU  18          2HB       GLU  18   1.799   4.038 -14.831
  125   2HB   GLU  18          3HB       GLU  18   0.050   4.105 -14.651
  126   1HG   GLU  18          2HG       GLU  18   0.487   4.377 -12.476
  127   2HG   GLU  18          3HG       GLU  18   0.634   2.616 -12.458
  128    H    CYS  19           H        CYS  19   0.486   0.564 -13.077
  129    HA   CYS  19           HA       CYS  19   2.936  -1.099 -13.610
  130   1HB   CYS  19          2HB       CYS  19   1.437  -0.557 -11.033
  131   2HB   CYS  19          3HB       CYS  19   2.569  -1.905 -11.292
  132    HG   CYS  19           HG       CYS  19   3.144   1.326 -11.553
  133    H    ARG  20           H        ARG  20   1.137  -1.628 -15.464
  134    HA   ARG  20           HA       ARG  20  -0.802  -3.648 -14.585
  135   1HB   ARG  20          2HB       ARG  20  -0.136  -2.294 -17.082
  136   2HB   ARG  20          3HB       ARG  20  -0.088  -4.020 -17.355
  137   1HG   ARG  20          2HG       ARG  20  -2.432  -2.682 -15.975
  138   2HG   ARG  20          3HG       ARG  20  -2.341  -2.832 -17.721
  139   1HD   ARG  20          2HD       ARG  20  -2.085  -5.198 -15.826
  140   2HD   ARG  20          3HD       ARG  20  -3.651  -4.594 -16.409
  141    HE   ARG  20           HE       ARG  20  -2.116  -4.893 -18.701
  142   1HH1  ARG  20          2HH2      ARG  20  -3.169  -7.048 -16.130
  143   2HH1  ARG  20          1HH2      ARG  20  -3.368  -8.447 -17.140
  144   1HH2  ARG  20          2HH1      ARG  20  -2.401  -6.703 -20.103
  145   2HH2  ARG  20          1HH1      ARG  20  -2.916  -8.233 -19.474
  146    H    ASP  21           H        ASP  21   2.506  -3.518 -15.831
  147    HA   ASP  21           HA       ASP  21   2.505  -6.229 -16.650
  148   1HB   ASP  21          2HB       ASP  21   4.454  -3.911 -16.648
  149   2HB   ASP  21          3HB       ASP  21   5.064  -5.526 -16.969
  150    HA   PRO  22           HA       PRO  22   3.782  -8.311 -13.076
  151   1HB   PRO  22          2HB       PRO  22   5.278 -10.409 -13.995
  152   2HB   PRO  22          3HB       PRO  22   3.514 -10.264 -14.261
  153   1HG   PRO  22          2HG       PRO  22   5.738  -9.462 -16.158
  154   2HG   PRO  22          3HG       PRO  22   4.304 -10.466 -16.527
  155   1HD   PRO  22          2HD       PRO  22   4.350  -7.813 -17.087
  156   2HD   PRO  22          3HD       PRO  22   2.863  -8.566 -16.442
  157    H    ASP  23           H        ASP  23   5.186  -7.619 -11.586
  158    HA   ASP  23           HA       ASP  23   6.971  -7.569 -10.388
  159   1HB   ASP  23          2HB       ASP  23   8.623  -8.444 -12.787
  160   2HB   ASP  23          3HB       ASP  23   9.233  -8.192 -11.154
  161    H    THR  24           H        THR  24   5.748  -5.354 -11.601
  162    HA   THR  24           HA       THR  24   7.981  -3.496 -12.397
  163    HB   THR  24           HB       THR  24   5.069  -3.269 -13.127
  164    HG1  THR  24           1HG      THR  24   5.488  -4.544 -14.685
  165   1HG2  THR  24          1HG2      THR  24   7.589  -1.952 -14.246
  166   2HG2  THR  24          2HG2      THR  24   5.989  -1.883 -15.006
  167   3HG2  THR  24          3HG2      THR  24   6.241  -1.116 -13.438
  168    H    PHE  25           H        PHE  25   6.020  -4.164  -9.718
  169    HA   PHE  25           HA       PHE  25   4.732  -1.597  -9.466
  170   1HB   PHE  25          2HB       PHE  25   3.840  -3.879  -8.907
  171   2HB   PHE  25          3HB       PHE  25   4.865  -3.870  -7.479
  172    HD1  PHE  25           1HD      PHE  25   1.820  -2.568  -9.080
  173    HD2  PHE  25           2HD      PHE  25   4.323  -2.364  -5.571
  174    HE1  PHE  25           1HE      PHE  25  -0.094  -1.711  -7.763
  175    HE2  PHE  25           2HE      PHE  25   2.405  -1.477  -4.268
  176    HZ   PHE  25           HZ       PHE  25   0.183  -1.225  -5.338
  177    H    GLU  26           H        GLU  26   6.604  -0.149  -9.297
  178    HA   GLU  26           HA       GLU  26   8.480  -0.391  -7.176
  179   1HB   GLU  26          2HB       GLU  26   7.908   1.628  -9.271
  180   2HB   GLU  26          3HB       GLU  26   8.332   2.344  -7.719
  181   1HG   GLU  26          2HG       GLU  26  10.349   0.593  -7.799
  182   2HG   GLU  26          3HG       GLU  26  10.060   0.757  -9.538
  183    HA   PRO  27           HA       PRO  27   5.967   0.903  -3.887
  184   1HB   PRO  27          2HB       PRO  27   7.821   1.808  -2.008
  185   2HB   PRO  27          3HB       PRO  27   7.545   0.096  -2.418
  186   1HG   PRO  27          2HG       PRO  27   9.768   1.868  -3.406
  187   2HG   PRO  27          3HG       PRO  27   9.808   0.133  -2.976
  188   1HD   PRO  27          2HD       PRO  27   9.660   1.016  -5.556
  189   2HD   PRO  27          3HD       PRO  27   8.984  -0.543  -4.985
  190    H    GLN  28           H        GLN  28   8.605   3.375  -4.105
  191    HA   GLN  28           HA       GLN  28   7.073   5.585  -3.205
  192   1HB   GLN  28          2HB       GLN  28   9.520   5.380  -4.992
  193   2HB   GLN  28          3HB       GLN  28   8.839   6.926  -4.452
  194   1HG   GLN  28          2HG       GLN  28   9.197   6.399  -2.128
  195   2HG   GLN  28          3HG       GLN  28   9.605   4.719  -2.497
  196   1HE2  GLN  28          1HE2      GLN  28  10.737   8.084  -3.250
  197   2HE2  GLN  28          2HE2      GLN  28  12.432   7.628  -3.259
  198    H    LYS  29           H        LYS  29   7.681   4.373  -6.499
  199    HA   LYS  29           HA       LYS  29   6.160   6.201  -7.942
  200   1HB   LYS  29          2HB       LYS  29   7.590   4.304  -8.881
  201   2HB   LYS  29          3HB       LYS  29   6.289   3.189  -8.417
  202   1HG   LYS  29          2HG       LYS  29   5.979   3.587 -10.715
  203   2HG   LYS  29          3HG       LYS  29   4.724   4.512  -9.909
  204   1HD   LYS  29          2HD       LYS  29   6.380   6.538 -10.057
  205   2HD   LYS  29          3HD       LYS  29   7.350   5.501 -11.122
  206   1HE   LYS  29          2HE       LYS  29   5.452   5.274 -12.665
  207   2HE   LYS  29          3HE       LYS  29   4.383   6.137 -11.534
  208   1HZ   LYS  29          1HZ       LYS  29   5.739   8.087 -11.855
  209   2HZ   LYS  29          2HZ       LYS  29   6.653   7.294 -12.983
  210   3HZ   LYS  29          3HZ       LYS  29   5.044   7.550 -13.249
  211    H    PHE  30           H        PHE  30   5.017   3.057  -6.527
  212    HA   PHE  30           HA       PHE  30   2.331   3.435  -7.163
  213   1HB   PHE  30          2HB       PHE  30   3.149   1.289  -6.468
  214   2HB   PHE  30          3HB       PHE  30   3.617   1.907  -4.887
  215    HD1  PHE  30           1HD      PHE  30   2.133   1.604  -3.079
  216    HD2  PHE  30           2HD      PHE  30   0.580   1.678  -7.103
  217    HE1  PHE  30           1HE      PHE  30  -0.165   1.357  -2.200
  218    HE2  PHE  30           2HE      PHE  30  -1.726   1.423  -6.212
  219    HZ   PHE  30           HZ       PHE  30  -2.101   1.382  -3.760
  220    H    PHE  31           H        PHE  31   3.990   4.359  -4.082
  221    HA   PHE  31           HA       PHE  31   1.703   5.385  -2.801
  222   1HB   PHE  31          2HB       PHE  31   4.599   6.282  -2.560
  223   2HB   PHE  31          3HB       PHE  31   3.320   6.715  -1.434
  224    HD1  PHE  31           1HD      PHE  31   6.095   4.917  -1.311
  225    HD2  PHE  31           2HD      PHE  31   1.852   4.285  -0.856
  226    HE1  PHE  31           1HE      PHE  31   6.535   3.010   0.188
  227    HE2  PHE  31           2HE      PHE  31   2.303   2.487   0.767
  228    HZ   PHE  31           HZ       PHE  31   4.653   1.856   1.314
  229    H    GLN  32           H        GLN  32   3.755   6.926  -5.262
  230    HA   GLN  32           HA       GLN  32   2.505   9.570  -4.961
  231   1HB   GLN  32          2HB       GLN  32   4.209   8.302  -7.128
  232   2HB   GLN  32          3HB       GLN  32   3.623   9.965  -7.159
  233   1HG   GLN  32          2HG       GLN  32   5.009   9.212  -4.616
  234   2HG   GLN  32          3HG       GLN  32   6.003   9.105  -6.063
  235   1HE2  GLN  32          1HE2      GLN  32   4.410  11.376  -3.826
  236   2HE2  GLN  32          2HE2      GLN  32   5.001  12.787  -4.654
  237    H    THR  33           H        THR  33   2.334   6.896  -7.399
  238    HA   THR  33           HA       THR  33   0.457   8.213  -8.880
  239    HB   THR  33           HB       THR  33   2.149   6.143  -9.328
  240    HG1  THR  33           1HG      THR  33  -0.263   6.707 -10.555
  241   1HG2  THR  33          1HG2      THR  33   1.051   4.064  -9.692
  242   2HG2  THR  33          2HG2      THR  33   0.609   4.512  -8.033
  243   3HG2  THR  33          3HG2      THR  33  -0.542   4.765  -9.357
  244    H    SER  34           H        SER  34   0.074   6.182  -6.107
  245    HA   SER  34           HA       SER  34  -2.745   5.611  -6.462
  246   1HB   SER  34          2HB       SER  34  -1.124   4.064  -5.412
  247   2HB   SER  34          3HB       SER  34  -0.918   5.186  -4.064
  248    HG   SER  34           HG       SER  34  -3.506   4.335  -4.766
  249    H    GLY  35           H        GLY  35  -0.977   8.371  -5.390
  250   1HA   GLY  35          1HA       GLY  35  -1.951  10.402  -4.859
  251   2HA   GLY  35          2HA       GLY  35  -3.495   9.618  -4.505
  252    H    LEU  36           H        LEU  36  -1.561   7.673  -2.890
  253    HA   LEU  36           HA       LEU  36  -2.228   8.489  -0.308
  254   1HB   LEU  36          2HB       LEU  36   0.042   6.736  -1.342
  255   2HB   LEU  36          3HB       LEU  36  -0.507   6.783   0.325
  256    HG   LEU  36           HG       LEU  36  -2.269   5.950  -2.031
  257   1HD1  LEU  36          1HD1      LEU  36  -0.844   4.246   0.047
  258   2HD1  LEU  36          2HD1      LEU  36  -1.982   3.667  -1.191
  259   3HD1  LEU  36          3HD1      LEU  36  -0.432   4.362  -1.680
  260   1HD2  LEU  36          1HD2      LEU  36  -3.643   6.787  -0.192
  261   2HD2  LEU  36          2HD2      LEU  36  -3.734   5.026  -0.231
  262   3HD2  LEU  36          3HD2      LEU  36  -2.709   5.827   0.980
  263    H    SER  37           H        SER  37   0.787   9.110  -2.161
  264    HA   SER  37           HA       SER  37   2.012  10.585   0.030
  265   1HB   SER  37          2HB       SER  37   3.509   9.505  -1.455
  266   2HB   SER  37          3HB       SER  37   2.609  10.060  -2.874
  267    HG   SER  37           HG       SER  37   4.524  11.417  -1.367
  268    H    LYS  38           H        LYS  38  -0.554  11.396  -2.015
  269    HA   LYS  38           HA       LYS  38   0.056  14.283  -1.887
  270   1HB   LYS  38          2HB       LYS  38  -1.239  12.698  -3.859
  271   2HB   LYS  38          3HB       LYS  38  -2.541  13.535  -3.022
  272   1HG   LYS  38          2HG       LYS  38  -1.906  14.956  -4.784
  273   2HG   LYS  38          3HG       LYS  38  -1.206  15.687  -3.322
  274   1HD   LYS  38          2HD       LYS  38   0.971  14.374  -3.921
  275   2HD   LYS  38          3HD       LYS  38   0.220  14.020  -5.470
  276   1HE   LYS  38          2HE       LYS  38   0.876  16.777  -4.302
  277   2HE   LYS  38          3HE       LYS  38   1.743  15.959  -5.608
  278   1HZ   LYS  38          1HZ       LYS  38  -1.048  16.897  -5.726
  279   2HZ   LYS  38          2HZ       LYS  38   0.243  17.594  -6.466
  280   3HZ   LYS  38          3HZ       LYS  38  -0.266  16.102  -6.938
  281    H    MET  39           H        MET  39  -2.077  11.730  -0.671
  282    HA   MET  39           HA       MET  39  -3.849  13.332   0.837
  283   1HB   MET  39          2HB       MET  39  -2.731  10.546   1.384
  284   2HB   MET  39          3HB       MET  39  -4.009  11.305   2.312
  285   1HG   MET  39          2HG       MET  39  -5.375  11.485   0.212
  286   2HG   MET  39          3HG       MET  39  -4.131  10.531  -0.611
  287   1HE   MET  39          1HE       MET  39  -5.859   8.662  -1.353
  288   2HE   MET  39          2HE       MET  39  -7.054   7.964  -0.233
  289   3HE   MET  39          3HE       MET  39  -7.126   9.696  -0.642
  290    H    SER  40           H        SER  40  -3.881  13.827   3.082
  291    HA   SER  40           HA       SER  40  -1.286  14.649   4.185
  292   1HB   SER  40          2HB       SER  40  -3.335  16.086   4.352
  293   2HB   SER  40          3HB       SER  40  -4.082  14.843   5.379
  294    HG   SER  40           HG       SER  40  -1.816  16.454   5.913
  295    H    ALA  41           H        ALA  41  -0.552  13.972   6.245
  296    HA   ALA  41           HA       ALA  41  -0.223  11.328   6.857
  297   1HB   ALA  41          1HB       ALA  41  -0.397  13.711   8.745
  298   2HB   ALA  41          2HB       ALA  41   0.228  12.116   9.193
  299   3HB   ALA  41          3HB       ALA  41   1.057  13.070   7.942
  300    H    ASN  42           H        ASN  42  -2.840  13.431   8.055
  301    HA   ASN  42           HA       ASN  42  -4.097  11.655   9.844
  302   1HB   ASN  42          2HB       ASN  42  -5.470  13.687   8.025
  303   2HB   ASN  42          3HB       ASN  42  -6.111  12.999   9.521
  304   1HD2  ASN  42          1HD2      ASN  42  -4.574  15.721   8.246
  305   2HD2  ASN  42          2HD2      ASN  42  -3.879  16.313   9.739
  306    H    GLN  43           H        GLN  43  -4.825  12.191   6.372
  307    HA   GLN  43           HA       GLN  43  -6.845  10.154   6.207
  308   1HB   GLN  43          2HB       GLN  43  -5.502  12.051   4.380
  309   2HB   GLN  43          3HB       GLN  43  -5.789  10.488   3.624
  310   1HG   GLN  43          2HG       GLN  43  -7.945  12.064   5.079
  311   2HG   GLN  43          3HG       GLN  43  -7.647  12.149   3.334
  312   1HE2  GLN  43          1HE2      GLN  43 -10.176  11.375   4.243
  313   2HE2  GLN  43          2HE2      GLN  43 -10.382   9.671   3.884
  314    H    VAL  44           H        VAL  44  -3.279  10.212   5.554
  315    HA   VAL  44           HA       VAL  44  -3.126   7.632   4.403
  316    HB   VAL  44           HB       VAL  44  -1.232   9.485   5.899
  317   1HG1  VAL  44          1HG1      VAL  44   0.617   8.152   4.944
  318   2HG1  VAL  44          2HG1      VAL  44  -0.311   7.317   6.193
  319   3HG1  VAL  44          3HG1      VAL  44  -0.579   6.916   4.465
  320   1HG2  VAL  44          1HG2      VAL  44  -2.106  10.263   3.687
  321   2HG2  VAL  44          2HG2      VAL  44  -0.377   9.934   3.632
  322   3HG2  VAL  44          3HG2      VAL  44  -1.533   8.766   2.948
  323    H    LYS  45           H        LYS  45  -2.952   8.757   7.824
  324    HA   LYS  45           HA       LYS  45  -2.501   6.163   8.906
  325   1HB   LYS  45          2HB       LYS  45  -2.123   8.397   9.982
  326   2HB   LYS  45          3HB       LYS  45  -3.858   8.526  10.279
  327   1HG   LYS  45          2HG       LYS  45  -3.796   7.012  11.997
  328   2HG   LYS  45          3HG       LYS  45  -2.629   5.954  11.183
  329   1HD   LYS  45          2HD       LYS  45  -0.798   7.539  11.656
  330   2HD   LYS  45          3HD       LYS  45  -1.939   8.627  12.475
  331   1HE   LYS  45          2HE       LYS  45  -2.396   6.848  14.169
  332   2HE   LYS  45          3HE       LYS  45  -1.276   5.759  13.329
  333   1HZ   LYS  45          1HZ       LYS  45  -0.216   6.824  15.186
  334   2HZ   LYS  45          2HZ       LYS  45   0.495   7.327  13.792
  335   3HZ   LYS  45          3HZ       LYS  45  -0.544   8.321  14.591
  336    H    ASP  46           H        ASP  46  -5.576   8.035   8.456
  337    HA   ASP  46           HA       ASP  46  -7.352   6.090   9.422
  338   1HB   ASP  46          2HB       ASP  46  -7.561   8.329   7.434
  339   2HB   ASP  46          3HB       ASP  46  -8.800   7.079   7.363
  340    H    VAL  47           H        VAL  47  -6.182   6.398   6.009
  341    HA   VAL  47           HA       VAL  47  -7.494   4.052   5.184
  342    HB   VAL  47           HB       VAL  47  -6.118   3.947   3.240
  343   1HG1  VAL  47          1HG1      VAL  47  -6.603   6.889   3.752
  344   2HG1  VAL  47          2HG1      VAL  47  -6.820   5.970   2.262
  345   3HG1  VAL  47          3HG1      VAL  47  -7.942   5.755   3.625
  346   1HG2  VAL  47          1HG2      VAL  47  -4.321   5.441   2.747
  347   2HG2  VAL  47          2HG2      VAL  47  -4.462   6.095   4.382
  348   3HG2  VAL  47          3HG2      VAL  47  -3.898   4.422   4.142
  349    H    PHE  48           H        PHE  48  -4.194   4.305   6.628
  350    HA   PHE  48           HA       PHE  48  -3.610   1.542   6.532
  351   1HB   PHE  48          2HB       PHE  48  -2.966   3.388   8.826
  352   2HB   PHE  48          3HB       PHE  48  -2.208   1.844   8.461
  353    HD1  PHE  48           1HD      PHE  48  -2.214   2.665   5.246
  354    HD2  PHE  48           2HD      PHE  48  -0.693   4.309   8.946
  355    HE1  PHE  48           1HE      PHE  48  -0.500   3.902   3.997
  356    HE2  PHE  48           2HE      PHE  48   1.009   5.539   7.684
  357    HZ   PHE  48           HZ       PHE  48   1.127   5.351   5.206
  358    H    ARG  49           H        ARG  49  -5.738   3.259   8.865
  359    HA   ARG  49           HA       ARG  49  -6.113   0.978  10.581
  360   1HB   ARG  49          2HB       ARG  49  -8.147   3.158   9.960
  361   2HB   ARG  49          3HB       ARG  49  -8.197   1.999  11.286
  362   1HG   ARG  49          2HG       ARG  49  -6.075   2.935  12.197
  363   2HG   ARG  49          3HG       ARG  49  -6.046   4.112  10.882
  364   1HD   ARG  49          2HD       ARG  49  -7.002   5.307  12.711
  365   2HD   ARG  49          3HD       ARG  49  -8.294   4.956  11.589
  366    HE   ARG  49           HE       ARG  49  -9.344   3.634  13.129
  367   1HH1  ARG  49          2HH2      ARG  49  -6.019   4.087  14.144
  368   2HH1  ARG  49          1HH2      ARG  49  -6.226   3.476  15.760
  369   1HH2  ARG  49          2HH1      ARG  49  -9.688   2.772  15.262
  370   2HH2  ARG  49          1HH1      ARG  49  -8.379   2.687  16.393
  371    H    PHE  50           H        PHE  50  -7.722   2.016   7.511
  372    HA   PHE  50           HA       PHE  50  -9.549  -0.229   7.564
  373   1HB   PHE  50          2HB       PHE  50  -8.657   1.323   5.137
  374   2HB   PHE  50          3HB       PHE  50 -10.155   0.419   5.352
  375    HD1  PHE  50           1HD      PHE  50 -10.970   1.455   8.137
  376    HD2  PHE  50           2HD      PHE  50  -9.559   3.471   4.596
  377    HE1  PHE  50           1HE      PHE  50 -11.707   3.619   9.067
  378    HE2  PHE  50           2HE      PHE  50 -10.166   5.654   5.607
  379    HZ   PHE  50           HZ       PHE  50 -11.210   5.735   7.858
  380    H    ILE  51           H        ILE  51  -6.235   0.239   6.324
  381    HA   ILE  51           HA       ILE  51  -6.137  -2.232   4.869
  382    HB   ILE  51           HB       ILE  51  -3.811  -0.803   6.170
  383   1HG1  ILE  51          2HG1      ILE  51  -4.632   0.812   4.642
  384   2HG1  ILE  51          3HG1      ILE  51  -3.360  -0.019   3.786
  385   1HG2  ILE  51          1HG2      ILE  51  -3.382  -3.193   5.483
  386   2HG2  ILE  51          2HG2      ILE  51  -3.824  -2.746   3.833
  387   3HG2  ILE  51          3HG2      ILE  51  -2.427  -1.988   4.627
  388   1HD1  ILE  51          1HD1      ILE  51  -6.362  -0.382   3.411
  389   2HD1  ILE  51          2HD1      ILE  51  -5.193   0.357   2.307
  390   3HD1  ILE  51          3HD1      ILE  51  -5.135  -1.384   2.596
  391    H    ASP  52           H        ASP  52  -4.918  -1.534   8.238
  392    HA   ASP  52           HA       ASP  52  -4.376  -4.368   8.610
  393   1HB   ASP  52          2HB       ASP  52  -3.010  -2.601   9.736
  394   2HB   ASP  52          3HB       ASP  52  -4.386  -2.243  10.786
  395    H    ASN  53           H        ASN  53  -6.569  -4.928   7.950
  396    HA   ASN  53           HA       ASN  53  -8.973  -4.646   9.275
  397   1HB   ASN  53          2HB       ASN  53  -8.510  -5.966   7.207
  398   2HB   ASN  53          3HB       ASN  53  -7.763  -7.234   8.171
  399   1HD2  ASN  53          1HD2      ASN  53  -9.099  -8.831   9.019
  400   2HD2  ASN  53          2HD2      ASN  53 -10.852  -8.738   8.994
  401    H    ASP  54           H        ASP  54  -6.385  -6.988   9.997
  402    HA   ASP  54           HA       ASP  54  -7.505  -8.300  12.171
  403   1HB   ASP  54          2HB       ASP  54  -4.558  -7.782  11.624
  404   2HB   ASP  54          3HB       ASP  54  -5.263  -9.176  12.453
  405    H    GLN  55           H        GLN  55  -6.150  -5.106  12.043
  406    HA   GLN  55           HA       GLN  55  -5.664  -3.527  13.476
  407   1HB   GLN  55          2HB       GLN  55  -7.263  -2.974  14.947
  408   2HB   GLN  55          3HB       GLN  55  -8.101  -4.238  14.053
  409   1HG   GLN  55          2HG       GLN  55  -7.298  -5.817  15.993
  410   2HG   GLN  55          3HG       GLN  55  -6.906  -4.325  16.842
  411   1HE2  GLN  55          1HE2      GLN  55  -8.564  -3.474  18.090
  412   2HE2  GLN  55          2HE2      GLN  55 -10.256  -3.888  17.857
  413    H    SER  56           H        SER  56  -4.153  -6.229  13.750
  414    HA   SER  56           HA       SER  56  -3.338  -6.467  16.417
  415   1HB   SER  56          2HB       SER  56  -1.499  -7.911  15.297
  416   2HB   SER  56          3HB       SER  56  -3.204  -8.351  15.096
  417    HG   SER  56           HG       SER  56  -2.253  -8.430  13.086
  418    H    GLY  57           H        GLY  57  -2.338  -3.992  14.253
  419   1HA   GLY  57          1HA       GLY  57  -1.063  -2.175  14.898
  420   2HA   GLY  57          2HA       GLY  57  -0.526  -3.031  16.347
  421    H    TYR  58           H        TYR  58  -0.308  -4.174  13.021
  422    HA   TYR  58           HA       TYR  58   2.269  -3.348  12.282
  423   1HB   TYR  58          2HB       TYR  58   2.087  -6.020  13.705
  424   2HB   TYR  58          3HB       TYR  58   3.010  -5.954  12.216
  425    HD1  TYR  58           HD1      TYR  58   4.584  -3.751  12.024
  426    HD2  TYR  58           HD2      TYR  58   3.574  -5.946  15.582
  427    HE1  TYR  58           HE1      TYR  58   6.670  -2.961  13.082
  428    HE2  TYR  58           HE2      TYR  58   5.721  -5.250  16.610
  429    HH   TYR  58           HH       TYR  58   7.685  -2.734  15.340
  430    H    LEU  59           H        LEU  59   2.481  -3.778  10.083
  431    HA   LEU  59           HA       LEU  59   0.180  -5.209   8.795
  432   1HB   LEU  59          2HB       LEU  59   2.069  -3.019   7.916
  433   2HB   LEU  59          3HB       LEU  59   1.124  -3.976   6.765
  434    HG   LEU  59           HG       LEU  59   0.100  -1.819   7.221
  435   1HD1  LEU  59          1HD1      LEU  59  -1.652  -4.088   8.239
  436   2HD1  LEU  59          2HD1      LEU  59  -2.158  -2.578   7.465
  437   3HD1  LEU  59          3HD1      LEU  59  -1.249  -3.785   6.537
  438   1HD2  LEU  59          1HD2      LEU  59   0.768  -1.587   9.627
  439   2HD2  LEU  59          2HD2      LEU  59  -0.929  -1.206   9.280
  440   3HD2  LEU  59          3HD2      LEU  59  -0.518  -2.747  10.042
  441    H    ASP  60           H        ASP  60   1.430  -7.043   9.776
  442    HA   ASP  60           HA       ASP  60   3.853  -7.993   8.843
  443   1HB   ASP  60          2HB       ASP  60   1.379  -9.665   9.437
  444   2HB   ASP  60          3HB       ASP  60   3.070 -10.135   9.665
  445    H    GLU  61           H        GLU  61   4.497  -9.376   7.091
  446    HA   GLU  61           HA       GLU  61   3.649  -8.802   4.588
  447   1HB   GLU  61          2HB       GLU  61   4.936 -11.366   5.602
  448   2HB   GLU  61          3HB       GLU  61   4.515 -11.119   3.907
  449   1HG   GLU  61          2HG       GLU  61   5.846  -8.937   3.993
  450   2HG   GLU  61          3HG       GLU  61   6.546  -9.553   5.502
  451    H    GLU  62           H        GLU  62   2.458 -11.670   6.407
  452    HA   GLU  62           HA       GLU  62   0.898 -12.491   4.170
  453   1HB   GLU  62          2HB       GLU  62   1.858 -13.954   6.027
  454   2HB   GLU  62          3HB       GLU  62   0.442 -13.509   6.997
  455   1HG   GLU  62          2HG       GLU  62  -1.048 -14.484   5.342
  456   2HG   GLU  62          3HG       GLU  62   0.268 -14.606   4.152
  457    H    GLU  63           H        GLU  63   0.250 -10.095   6.598
  458    HA   GLU  63           HA       GLU  63  -2.645 -10.041   6.084
  459   1HB   GLU  63          2HB       GLU  63  -0.830  -7.947   7.299
  460   2HB   GLU  63          3HB       GLU  63  -2.594  -7.949   7.285
  461   1HG   GLU  63          2HG       GLU  63  -2.649  -9.919   8.758
  462   2HG   GLU  63          3HG       GLU  63  -0.871  -9.991   8.771
  463    H    LEU  64           H        LEU  64   0.350  -8.303   5.202
  464    HA   LEU  64           HA       LEU  64  -0.746  -6.442   3.384
  465   1HB   LEU  64          2HB       LEU  64   1.394  -5.956   3.983
  466   2HB   LEU  64          3HB       LEU  64   1.923  -7.617   3.897
  467    HG   LEU  64           HG       LEU  64   1.998  -7.507   1.422
  468   1HD1  LEU  64          1HD1      LEU  64   0.510  -5.637   0.869
  469   2HD1  LEU  64          2HD1      LEU  64   1.466  -4.528   1.871
  470   3HD1  LEU  64          3HD1      LEU  64   2.138  -5.230   0.380
  471   1HD2  LEU  64          1HD2      LEU  64   3.628  -5.459   2.986
  472   2HD2  LEU  64          2HD2      LEU  64   3.997  -7.187   2.808
  473   3HD2  LEU  64          3HD2      LEU  64   4.064  -6.118   1.400
  474    H    LYS  65           H        LYS  65  -0.088  -9.897   2.932
  475    HA   LYS  65           HA       LYS  65  -0.534 -10.144   0.206
  476   1HB   LYS  65          2HB       LYS  65  -0.070 -11.981   1.893
  477   2HB   LYS  65          3HB       LYS  65  -1.812 -11.981   2.245
  478   1HG   LYS  65          2HG       LYS  65  -2.304 -12.583  -0.100
  479   2HG   LYS  65          3HG       LYS  65  -0.599 -12.414  -0.522
  480   1HD   LYS  65          2HD       LYS  65  -1.267 -14.742  -0.321
  481   2HD   LYS  65          3HD       LYS  65  -0.025 -14.344   0.879
  482   1HE   LYS  65          2HE       LYS  65  -1.587 -14.342   2.688
  483   2HE   LYS  65          3HE       LYS  65  -2.984 -14.219   1.609
  484   1HZ   LYS  65          1HZ       LYS  65  -2.704 -16.412   2.542
  485   2HZ   LYS  65          2HZ       LYS  65  -2.593 -16.450   0.900
  486   3HZ   LYS  65          3HZ       LYS  65  -1.236 -16.582   1.840
  487    H    PHE  66           H        PHE  66  -2.924  -8.853   2.449
  488    HA   PHE  66           HA       PHE  66  -4.724  -8.640   0.102
  489   1HB   PHE  66          2HB       PHE  66  -6.673  -8.737   1.716
  490   2HB   PHE  66          3HB       PHE  66  -5.817 -10.239   1.453
  491    HD1  PHE  66           1HD      PHE  66  -4.782 -11.430   3.262
  492    HD2  PHE  66           2HD      PHE  66  -6.250  -7.422   3.911
  493    HE1  PHE  66           1HE      PHE  66  -4.650 -11.768   5.710
  494    HE2  PHE  66           2HE      PHE  66  -5.996  -7.745   6.361
  495    HZ   PHE  66           HZ       PHE  66  -5.270  -9.927   7.262
  496    H    PHE  67           H        PHE  67  -2.655  -6.805   0.950
  497    HA   PHE  67           HA       PHE  67  -3.680  -4.596   2.373
  498   1HB   PHE  67          2HB       PHE  67  -1.359  -4.871   1.919
  499   2HB   PHE  67          3HB       PHE  67  -1.585  -4.807   0.188
  500    HD1  PHE  67           1HD      PHE  67  -0.828  -2.921   3.157
  501    HD2  PHE  67           2HD      PHE  67  -2.087  -2.636  -0.943
  502    HE1  PHE  67           1HE      PHE  67  -0.251  -0.511   3.143
  503    HE2  PHE  67           2HE      PHE  67  -1.618  -0.211  -0.929
  504    HZ   PHE  67           HZ       PHE  67  -0.687   0.863   1.115
  505    H    LEU  68           H        LEU  68  -3.346  -4.691  -1.230
  506    HA   LEU  68           HA       LEU  68  -5.343  -2.587  -1.457
  507   1HB   LEU  68          2HB       LEU  68  -3.108  -3.185  -2.879
  508   2HB   LEU  68          3HB       LEU  68  -4.316  -4.032  -3.822
  509    HG   LEU  68           HG       LEU  68  -5.563  -1.745  -3.874
  510   1HD1  LEU  68          1HD1      LEU  68  -4.200  -0.702  -2.030
  511   2HD1  LEU  68          2HD1      LEU  68  -2.751  -0.880  -3.039
  512   3HD1  LEU  68          3HD1      LEU  68  -4.059   0.201  -3.552
  513   1HD2  LEU  68          1HD2      LEU  68  -4.504  -2.584  -5.871
  514   2HD2  LEU  68          2HD2      LEU  68  -4.016  -0.899  -5.691
  515   3HD2  LEU  68          3HD2      LEU  68  -2.884  -2.197  -5.250
  516    H    GLN  69           H        GLN  69  -5.618  -5.979  -1.293
  517    HA   GLN  69           HA       GLN  69  -7.800  -6.601  -3.009
  518   1HB   GLN  69          2HB       GLN  69  -7.119  -7.565  -0.215
  519   2HB   GLN  69          3HB       GLN  69  -8.413  -8.255  -1.186
  520   1HG   GLN  69          2HG       GLN  69  -5.501  -8.270  -2.045
  521   2HG   GLN  69          3HG       GLN  69  -6.336  -9.591  -1.225
  522   1HE2  GLN  69          1HE2      GLN  69  -5.757  -8.095  -4.308
  523   2HE2  GLN  69          2HE2      GLN  69  -6.805  -9.190  -5.205
  524    H    LYS  70           H        LYS  70  -7.622  -4.490  -0.202
  525    HA   LYS  70           HA       LYS  70 -10.488  -4.616   0.407
  526   1HB   LYS  70          2HB       LYS  70  -8.497  -2.570   1.417
  527   2HB   LYS  70          3HB       LYS  70 -10.022  -3.115   2.138
  528   1HG   LYS  70          2HG       LYS  70  -8.792  -5.508   2.132
  529   2HG   LYS  70          3HG       LYS  70  -7.345  -4.524   1.952
  530   1HD   LYS  70          2HD       LYS  70  -7.518  -4.895   4.239
  531   2HD   LYS  70          3HD       LYS  70  -8.028  -3.228   4.003
  532   1HE   LYS  70          2HE       LYS  70 -10.289  -5.187   3.835
  533   2HE   LYS  70          3HE       LYS  70  -9.413  -5.292   5.356
  534   1HZ   LYS  70          1HZ       LYS  70 -11.158  -3.747   5.572
  535   2HZ   LYS  70          2HZ       LYS  70  -9.718  -2.945   5.652
  536   3HZ   LYS  70          3HZ       LYS  70 -10.630  -2.855   4.283
  537    H    PHE  71           H        PHE  71  -8.511  -3.001  -1.900
  538    HA   PHE  71           HA       PHE  71 -10.401  -0.710  -2.245
  539   1HB   PHE  71          2HB       PHE  71  -7.674  -1.235  -3.462
  540   2HB   PHE  71          3HB       PHE  71  -8.677   0.181  -3.702
  541    HD1  PHE  71           1HD      PHE  71  -8.961  -0.406  -0.213
  542    HD2  PHE  71           2HD      PHE  71  -6.200   0.955  -3.225
  543    HE1  PHE  71           1HE      PHE  71  -7.672   0.794   1.503
  544    HE2  PHE  71           2HE      PHE  71  -5.011   2.303  -1.523
  545    HZ   PHE  71           HZ       PHE  71  -5.751   2.232   0.847
  546    H    GLU  72           H        GLU  72  -8.629  -3.281  -4.015
  547    HA   GLU  72           HA       GLU  72 -10.742  -3.354  -6.128
  548   1HB   GLU  72          2HB       GLU  72  -7.932  -2.871  -6.422
  549   2HB   GLU  72          3HB       GLU  72  -8.175  -4.554  -6.886
  550   1HG   GLU  72          2HG       GLU  72  -9.732  -2.192  -8.024
  551   2HG   GLU  72          3HG       GLU  72  -8.312  -2.932  -8.774
  552    H    SER  73           H        SER  73 -10.870  -5.672  -6.965
  553    HA   SER  73           HA       SER  73 -10.771  -7.616  -4.683
  554   1HB   SER  73          2HB       SER  73 -12.037  -7.865  -7.446
  555   2HB   SER  73          3HB       SER  73 -12.171  -9.013  -6.098
  556    HG   SER  73           HG       SER  73 -12.981  -6.980  -4.945
  557    H    GLY  74           H        GLY  74  -9.420  -6.772  -7.813
  558   1HA   GLY  74          1HA       GLY  74  -7.861  -9.352  -7.984
  559   2HA   GLY  74          2HA       GLY  74  -8.490  -8.434  -9.361
  560    H    ALA  75           H        ALA  75  -6.988  -7.196  -6.389
  561    HA   ALA  75           HA       ALA  75  -5.141  -5.541  -7.893
  562   1HB   ALA  75          1HB       ALA  75  -4.376  -4.811  -5.762
  563   2HB   ALA  75          2HB       ALA  75  -6.142  -4.813  -5.758
  564   3HB   ALA  75          3HB       ALA  75  -5.262  -6.101  -4.908
  565    H    ARG  76           H        ARG  76  -2.739  -5.765  -6.325
  566    HA   ARG  76           HA       ARG  76  -1.679  -7.903  -8.063
  567   1HB   ARG  76          2HB       ARG  76  -0.941  -5.278  -7.823
  568   2HB   ARG  76          3HB       ARG  76   0.094  -5.984  -6.578
  569   1HG   ARG  76          2HG       ARG  76   1.318  -6.019  -8.607
  570   2HG   ARG  76          3HG       ARG  76   0.843  -7.688  -8.301
  571   1HD   ARG  76          2HD       ARG  76  -0.272  -7.769 -10.331
  572   2HD   ARG  76          3HD       ARG  76  -1.329  -6.478  -9.803
  573    HE   ARG  76           HE       ARG  76  -0.212  -4.948 -11.071
  574   1HH1  ARG  76          2HH2      ARG  76   1.740  -7.865 -10.775
  575   2HH1  ARG  76          1HH2      ARG  76   3.187  -7.004 -11.233
  576   1HH2  ARG  76          2HH1      ARG  76   1.615  -4.056 -12.137
  577   2HH2  ARG  76          1HH1      ARG  76   3.005  -5.076 -12.493
  578    H    GLU  77           H        GLU  77  -2.284  -7.280  -4.825
  579    HA   GLU  77           HA       GLU  77  -0.351  -7.934  -3.316
  580   1HB   GLU  77          2HB       GLU  77  -2.928  -9.282  -2.565
  581   2HB   GLU  77          3HB       GLU  77  -1.795  -8.340  -1.577
  582   1HG   GLU  77          2HG       GLU  77  -3.913  -7.370  -3.513
  583   2HG   GLU  77          3HG       GLU  77  -3.712  -7.000  -1.794
  584    H    LEU  78           H        LEU  78  -2.287 -10.452  -4.772
  585    HA   LEU  78           HA       LEU  78  -1.198 -12.779  -3.774
  586   1HB   LEU  78          2HB       LEU  78  -1.791 -12.496  -6.735
  587   2HB   LEU  78          3HB       LEU  78  -1.883 -13.921  -5.712
  588    HG   LEU  78           HG       LEU  78  -4.070 -13.509  -5.949
  589   1HD1  LEU  78          1HD1      LEU  78  -3.624 -13.347  -3.497
  590   2HD1  LEU  78          2HD1      LEU  78  -3.734 -11.576  -3.627
  591   3HD1  LEU  78          3HD1      LEU  78  -5.124 -12.578  -4.039
  592   1HD2  LEU  78          1HD2      LEU  78  -3.958 -11.652  -7.428
  593   2HD2  LEU  78          2HD2      LEU  78  -5.163 -11.299  -6.181
  594   3HD2  LEU  78          3HD2      LEU  78  -3.576 -10.520  -6.125
  595    H    THR  79           H        THR  79   0.289 -10.727  -6.357
  596    HA   THR  79           HA       THR  79   2.480 -12.560  -6.819
  597    HB   THR  79           HB       THR  79   2.339  -9.584  -7.453
  598    HG1  THR  79           1HG      THR  79   2.288 -11.032  -9.554
  599   1HG2  THR  79          1HG2      THR  79   4.122 -10.233  -9.113
  600   2HG2  THR  79          2HG2      THR  79   4.654 -10.539  -7.458
  601   3HG2  THR  79          3HG2      THR  79   4.110 -11.880  -8.469
  602    H    GLU  80           H        GLU  80   3.630 -13.043  -5.087
  603    HA   GLU  80           HA       GLU  80   4.208 -11.469  -2.847
  604   1HB   GLU  80          2HB       GLU  80   6.032 -13.588  -4.049
  605   2HB   GLU  80          3HB       GLU  80   6.199 -12.772  -2.481
  606   1HG   GLU  80          2HG       GLU  80   4.002 -13.671  -1.764
  607   2HG   GLU  80          3HG       GLU  80   3.906 -14.599  -3.272
  608    H    SER  81           H        SER  81   6.059 -11.627  -5.915
  609    HA   SER  81           HA       SER  81   8.316 -10.144  -5.160
  610   1HB   SER  81          2HB       SER  81   8.045 -11.352  -7.324
  611   2HB   SER  81          3HB       SER  81   6.878 -10.130  -7.852
  612    HG   SER  81           HG       SER  81   8.731  -9.576  -8.685
  613    H    GLU  82           H        GLU  82   5.281  -8.895  -6.616
  614    HA   GLU  82           HA       GLU  82   5.997  -6.144  -6.526
  615   1HB   GLU  82          2HB       GLU  82   3.243  -7.455  -6.534
  616   2HB   GLU  82          3HB       GLU  82   3.595  -5.805  -7.035
  617   1HG   GLU  82          2HG       GLU  82   4.841  -8.218  -8.461
  618   2HG   GLU  82          3HG       GLU  82   3.254  -7.584  -8.869
  619    H    THR  83           H        THR  83   4.006  -8.231  -4.393
  620    HA   THR  83           HA       THR  83   3.428  -6.349  -2.430
  621    HB   THR  83           HB       THR  83   3.445  -9.286  -2.649
  622    HG1  THR  83           1HG      THR  83   1.777  -8.184  -0.898
  623   1HG2  THR  83          1HG2      THR  83   4.838  -9.368  -0.675
  624   2HG2  THR  83          2HG2      THR  83   3.847  -8.146   0.140
  625   3HG2  THR  83          3HG2      THR  83   3.180  -9.748  -0.236
  626    H    LYS  84           H        LYS  84   6.394  -8.309  -2.810
  627    HA   LYS  84           HA       LYS  84   7.554  -7.386  -0.336
  628   1HB   LYS  84          2HB       LYS  84   8.567  -9.120  -2.596
  629   2HB   LYS  84          3HB       LYS  84   9.613  -8.595  -1.264
  630   1HG   LYS  84          2HG       LYS  84   8.180  -9.570   0.415
  631   2HG   LYS  84          3HG       LYS  84   6.935  -9.935  -0.776
  632   1HD   LYS  84          2HD       LYS  84   8.289 -11.608  -1.847
  633   2HD   LYS  84          3HD       LYS  84   9.684 -11.220  -0.807
  634   1HE   LYS  84          2HE       LYS  84   8.518 -11.924   1.194
  635   2HE   LYS  84          3HE       LYS  84   6.968 -12.041   0.347
  636   1HZ   LYS  84          1HZ       LYS  84   9.233 -13.825  -0.219
  637   2HZ   LYS  84          2HZ       LYS  84   7.972 -14.154   0.789
  638   3HZ   LYS  84          3HZ       LYS  84   7.680 -13.953  -0.782
  639    H    SER  85           H        SER  85   7.693  -6.323  -3.704
  640    HA   SER  85           HA       SER  85   9.806  -4.427  -3.403
  641   1HB   SER  85          2HB       SER  85   7.328  -4.228  -5.182
  642   2HB   SER  85          3HB       SER  85   8.839  -3.337  -5.353
  643    HG   SER  85           HG       SER  85   8.522  -6.174  -5.512
  644    H    LEU  86           H        LEU  86   6.261  -4.208  -2.836
  645    HA   LEU  86           HA       LEU  86   6.282  -1.547  -1.754
  646   1HB   LEU  86          2HB       LEU  86   4.299  -2.625  -2.566
  647   2HB   LEU  86          3HB       LEU  86   4.370  -3.867  -1.332
  648    HG   LEU  86           HG       LEU  86   2.679  -2.102  -1.002
  649   1HD1  LEU  86          1HD1      LEU  86   4.560  -2.011   1.365
  650   2HD1  LEU  86          2HD1      LEU  86   2.788  -2.050   1.285
  651   3HD1  LEU  86          3HD1      LEU  86   3.717  -3.499   0.886
  652   1HD2  LEU  86          1HD2      LEU  86   4.979  -0.239  -0.286
  653   2HD2  LEU  86          2HD2      LEU  86   4.018  -0.146  -1.780
  654   3HD2  LEU  86          3HD2      LEU  86   3.239   0.097  -0.207
  655    H    MET  87           H        MET  87   6.251  -4.704  -0.001
  656    HA   MET  87           HA       MET  87   6.655  -3.814   2.542
  657   1HB   MET  87          2HB       MET  87   6.454  -6.242   1.783
  658   2HB   MET  87          3HB       MET  87   8.167  -6.164   1.362
  659   1HG   MET  87          2HG       MET  87   8.450  -5.374   3.897
  660   2HG   MET  87          3HG       MET  87   6.866  -6.135   4.066
  661   1HE   MET  87          1HE       MET  87  10.678  -6.527   3.460
  662   2HE   MET  87          2HE       MET  87  10.845  -8.262   3.105
  663   3HE   MET  87          3HE       MET  87  10.104  -7.184   1.905
  664    H    ALA  88           H        ALA  88   9.246  -4.481   0.191
  665    HA   ALA  88           HA       ALA  88  11.501  -4.200   1.710
  666   1HB   ALA  88          1HB       ALA  88  11.011  -3.480  -1.216
  667   2HB   ALA  88          2HB       ALA  88  12.625  -3.590  -0.476
  668   3HB   ALA  88          3HB       ALA  88  11.583  -5.020  -0.564
  669    H    ALA  89           H        ALA  89   9.876  -1.545  -0.086
  670    HA   ALA  89           HA       ALA  89  11.738   0.453   1.000
  671   1HB   ALA  89          1HB       ALA  89   9.200   0.627  -0.622
  672   2HB   ALA  89          2HB       ALA  89  10.163   2.044  -0.157
  673   3HB   ALA  89          3HB       ALA  89  10.892   0.803  -1.190
  674    H    ALA  90           H        ALA  90   8.346  -0.582   1.614
  675    HA   ALA  90           HA       ALA  90   7.611   1.487   3.422
  676   1HB   ALA  90          1HB       ALA  90   6.800  -1.442   3.418
  677   2HB   ALA  90          2HB       ALA  90   5.923  -0.096   4.180
  678   3HB   ALA  90          3HB       ALA  90   6.068  -0.178   2.407
  679    H    ASP  91           H        ASP  91   9.382  -1.564   3.963
  680    HA   ASP  91           HA       ASP  91   9.408  -1.220   6.815
  681   1HB   ASP  91          2HB       ASP  91   9.423  -3.448   5.608
  682   2HB   ASP  91          3HB       ASP  91  11.116  -3.147   5.179
  683    H    ASN  92           H        ASN  92  10.334   0.915   6.975
  684    HA   ASN  92           HA       ASN  92  13.127   1.318   6.186
  685   1HB   ASN  92          2HB       ASN  92  12.952   3.487   7.182
  686   2HB   ASN  92          3HB       ASN  92  11.537   3.173   6.170
  687   1HD2  ASN  92          1HD2      ASN  92  11.251   5.261   7.928
  688   2HD2  ASN  92          2HD2      ASN  92  10.251   4.752   9.265
  689    H    ASP  93           H        ASP  93  12.996  -0.993   7.649
  690    HA   ASP  93           HA       ASP  93  14.675  -0.379  10.047
  691   1HB   ASP  93          2HB       ASP  93  12.566  -2.574   9.763
  692   2HB   ASP  93          3HB       ASP  93  13.877  -2.623  10.934
  693    H    GLY  94           H        GLY  94  13.508  -2.976   7.843
  694   1HA   GLY  94          1HA       GLY  94  14.856  -4.536   6.645
  695   2HA   GLY  94          2HA       GLY  94  16.261  -4.127   7.643
  696    H    ASP  95           H        ASP  95  12.823  -4.726   8.512
  697    HA   ASP  95           HA       ASP  95  13.607  -7.238   9.898
  698   1HB   ASP  95          2HB       ASP  95  12.248  -6.874  11.777
  699   2HB   ASP  95          3HB       ASP  95  13.411  -5.555  11.657
  700    H    GLY  96           H        GLY  96  10.843  -5.311   8.698
  701   1HA   GLY  96          1HA       GLY  96   9.842  -6.191   6.606
  702   2HA   GLY  96          2HA       GLY  96   9.855  -7.814   7.300
  703    H    LYS  97           H        LYS  97   9.101  -6.782   9.974
  704    HA   LYS  97           HA       LYS  97   6.195  -6.588   9.679
  705   1HB   LYS  97          2HB       LYS  97   6.185  -6.322  12.120
  706   2HB   LYS  97          3HB       LYS  97   7.025  -7.771  11.569
  707   1HG   LYS  97          2HG       LYS  97   9.221  -6.653  11.946
  708   2HG   LYS  97          3HG       LYS  97   8.363  -5.212  12.522
  709   1HD   LYS  97          2HD       LYS  97   7.359  -6.582  14.353
  710   2HD   LYS  97          3HD       LYS  97   8.200  -8.003  13.738
  711   1HE   LYS  97          2HE       LYS  97   9.375  -7.003  15.684
  712   2HE   LYS  97          3HE       LYS  97  10.383  -7.044  14.226
  713   1HZ   LYS  97          1HZ       LYS  97  10.052  -4.791  13.881
  714   2HZ   LYS  97          2HZ       LYS  97   8.919  -4.630  15.091
  715   3HZ   LYS  97          3HZ       LYS  97  10.511  -4.945  15.430
  716    H    ILE  98           H        ILE  98   5.299  -4.728   8.944
  717    HA   ILE  98           HA       ILE  98   6.827  -2.194   9.151
  718    HB   ILE  98           HB       ILE  98   4.605  -3.102   7.338
  719   1HG1  ILE  98          2HG1      ILE  98   7.357  -2.215   6.465
  720   2HG1  ILE  98          3HG1      ILE  98   7.234  -3.812   7.172
  721   1HG2  ILE  98          1HG2      ILE  98   6.196  -0.490   7.325
  722   2HG2  ILE  98          2HG2      ILE  98   5.007  -0.987   6.124
  723   3HG2  ILE  98          3HG2      ILE  98   4.485  -0.626   7.773
  724   1HD1  ILE  98          1HD1      ILE  98   5.507  -2.873   4.849
  725   2HD1  ILE  98          2HD1      ILE  98   7.017  -3.799   4.732
  726   3HD1  ILE  98          3HD1      ILE  98   5.599  -4.513   5.534
  727    H    GLY  99           H        GLY  99   6.279  -0.925  10.858
  728   1HA   GLY  99          1HA       GLY  99   3.656  -0.934  12.099
  729   2HA   GLY  99          2HA       GLY  99   4.953   0.245  12.346
  730    H    ALA 100           H        ALA 100   2.234   0.974  12.220
  731    HA   ALA 100           HA       ALA 100   1.405   2.081   9.721
  732   1HB   ALA 100          1HB       ALA 100   0.093   3.639  11.144
  733   2HB   ALA 100          2HB       ALA 100  -0.102   1.948  11.648
  734   3HB   ALA 100          3HB       ALA 100   0.947   3.044  12.580
  735    H    GLU 101           H        GLU 101   3.557   3.212  12.309
  736    HA   GLU 101           HA       GLU 101   4.053   5.800  11.385
  737   1HB   GLU 101          2HB       GLU 101   4.941   4.157  13.503
  738   2HB   GLU 101          3HB       GLU 101   6.424   4.515  12.616
  739   1HG   GLU 101          2HG       GLU 101   6.049   6.900  12.860
  740   2HG   GLU 101          3HG       GLU 101   4.417   6.632  13.508
  741    H    GLU 102           H        GLU 102   5.921   2.800  10.755
  742    HA   GLU 102           HA       GLU 102   7.822   3.753   8.954
  743   1HB   GLU 102          2HB       GLU 102   6.372   1.080   8.823
  744   2HB   GLU 102          3HB       GLU 102   7.961   1.472   8.157
  745   1HG   GLU 102          2HG       GLU 102   8.749   1.878  10.535
  746   2HG   GLU 102          3HG       GLU 102   7.194   1.265  11.110
  747    H    PHE 103           H        PHE 103   4.536   2.437   8.249
  748    HA   PHE 103           HA       PHE 103   4.703   2.963   5.445
  749   1HB   PHE 103          2HB       PHE 103   2.441   2.385   7.351
  750   2HB   PHE 103          3HB       PHE 103   2.076   3.104   5.797
  751    HD1  PHE 103           1HD      PHE 103   3.240   2.173   3.669
  752    HD2  PHE 103           2HD      PHE 103   2.204  -0.013   7.240
  753    HE1  PHE 103           1HE      PHE 103   3.038   0.093   2.338
  754    HE2  PHE 103           2HE      PHE 103   2.116  -2.108   5.894
  755    HZ   PHE 103           HZ       PHE 103   2.490  -2.065   3.483
  756    H    GLN 104           H        GLN 104   3.510   5.060   8.106
  757    HA   GLN 104           HA       GLN 104   2.501   7.204   6.464
  758   1HB   GLN 104          2HB       GLN 104   2.251   6.843   9.037
  759   2HB   GLN 104          3HB       GLN 104   3.839   7.609   9.161
  760   1HG   GLN 104          2HG       GLN 104   2.929   9.533   7.797
  761   2HG   GLN 104          3HG       GLN 104   1.337   8.760   7.837
  762   1HE2  GLN 104          1HE2      GLN 104   2.861  11.257   9.167
  763   2HE2  GLN 104          2HE2      GLN 104   2.186  11.227  10.785
  764    H    GLU 105           H        GLU 105   5.775   6.673   7.945
  765    HA   GLU 105           HA       GLU 105   7.153   8.848   6.836
  766   1HB   GLU 105          2HB       GLU 105   7.866   6.027   7.629
  767   2HB   GLU 105          3HB       GLU 105   9.031   6.896   6.643
  768   1HG   GLU 105          2HG       GLU 105   7.887   8.257   9.094
  769   2HG   GLU 105          3HG       GLU 105   9.156   7.034   9.257
  770    H    MET 106           H        MET 106   6.804   5.577   5.329
  771    HA   MET 106           HA       MET 106   8.195   6.438   3.025
  772   1HB   MET 106          2HB       MET 106   7.163   3.970   3.955
  773   2HB   MET 106          3HB       MET 106   6.362   4.230   2.401
  774   1HG   MET 106          2HG       MET 106   9.341   4.349   2.995
  775   2HG   MET 106          3HG       MET 106   8.524   3.062   2.110
  776   1HE   MET 106          1HE       MET 106  11.008   3.865   0.879
  777   2HE   MET 106          2HE       MET 106  11.054   5.295  -0.182
  778   3HE   MET 106          3HE       MET 106  11.032   5.496   1.581
  779    H    VAL 107           H        VAL 107   4.703   6.272   3.664
  780    HA   VAL 107           HA       VAL 107   3.882   7.166   1.064
  781    HB   VAL 107           HB       VAL 107   2.544   7.230   3.798
  782   1HG1  VAL 107          1HG1      VAL 107   1.520   9.016   2.525
  783   2HG1  VAL 107          2HG1      VAL 107   1.507   8.012   1.056
  784   3HG1  VAL 107          3HG1      VAL 107   0.442   7.616   2.419
  785   1HG2  VAL 107          1HG2      VAL 107   2.929   4.966   2.700
  786   2HG2  VAL 107          2HG2      VAL 107   1.212   5.385   2.854
  787   3HG2  VAL 107          3HG2      VAL 107   2.024   5.567   1.297
  788    H    HIS 108           H        HIS 108   4.944   8.929   3.997
  789    HA   HIS 108           HA       HIS 108   3.800  11.429   3.281
  790   1HB   HIS 108          2HB       HIS 108   4.285  10.898   5.568
  791   2HB   HIS 108          3HB       HIS 108   5.996  10.622   5.214
  792    HD1  HIS 108           1HD      HIS 108   3.485  13.532   5.501
  793    HD2  HIS 108           2HD      HIS 108   7.602  12.668   5.451
  794    HE1  HIS 108           1HE      HIS 108   4.692  15.660   6.247
  795    H    SER 109           H        SER 109   6.650   9.682   2.358
  796    HA   SER 109           HA       SER 109   8.283  11.823   1.532
  797   1HB   SER 109          2HB       SER 109   9.082   9.469   1.880
  798   2HB   SER 109          3HB       SER 109   8.183   9.002   0.414
  799    HG   SER 109           HG       SER 109   9.413  10.822  -0.569
  Start of MODEL    3
    1   1H    MET   1           H1       MET   1 -17.546   8.006   4.884
    2   2H    MET   1           H2       MET   1 -18.794   8.290   3.807
    3   3H    MET   1           H3       MET   1 -18.349   6.745   4.230
    4    HA   MET   1           HA       MET   1 -17.531   7.260   2.057
    5   1HB   MET   1          2HB       MET   1 -15.763   9.302   3.498
    6   2HB   MET   1          3HB       MET   1 -15.839   8.948   1.766
    7   1HG   MET   1          2HG       MET   1 -17.972  10.325   3.420
    8   2HG   MET   1          3HG       MET   1 -17.005  11.011   2.116
    9   1HE   MET   1          1HE       MET   1 -19.493  11.929   1.373
   10   2HE   MET   1          2HE       MET   1 -20.790  10.832   0.839
   11   3HE   MET   1          3HE       MET   1 -20.349  10.908   2.562
   12    H    SER   2           H        SER   2 -15.261   6.635   1.421
   13    HA   SER   2           HA       SER   2 -13.442   5.583   3.348
   14   1HB   SER   2          2HB       SER   2 -15.149   3.634   1.706
   15   2HB   SER   2          3HB       SER   2 -13.654   3.191   2.552
   16    HG   SER   2           HG       SER   2 -15.413   4.471   4.191
   17    H    ILE   3           H        ILE   3 -11.674   4.482   1.927
   18    HA   ILE   3           HA       ILE   3 -10.712   6.306   0.173
   19    HB   ILE   3           HB       ILE   3  -8.989   4.809  -0.356
   20   1HG1  ILE   3          2HG1      ILE   3  -9.410   2.274   0.413
   21   2HG1  ILE   3          3HG1      ILE   3 -11.044   2.618  -0.118
   22   1HG2  ILE   3          1HG2      ILE   3  -9.365   5.421   2.046
   23   2HG2  ILE   3          2HG2      ILE   3  -9.920   3.753   2.310
   24   3HG2  ILE   3          3HG2      ILE   3  -8.285   4.049   1.712
   25   1HD1  ILE   3          1HD1      ILE   3 -10.059   3.328  -2.373
   26   2HD1  ILE   3          2HD1      ILE   3  -8.459   2.896  -1.741
   27   3HD1  ILE   3          3HD1      ILE   3  -9.703   1.651  -1.945
   28    H    THR   4           H        THR   4 -12.919   3.627  -0.774
   29    HA   THR   4           HA       THR   4 -12.598   3.722  -3.506
   30    HB   THR   4           HB       THR   4 -13.294   1.818  -2.022
   31    HG1  THR   4           1HG      THR   4 -14.829   2.904  -3.996
   32   1HG2  THR   4          1HG2      THR   4 -15.502   1.706  -1.073
   33   2HG2  THR   4          2HG2      THR   4 -14.863   3.258  -0.509
   34   3HG2  THR   4          3HG2      THR   4 -16.013   3.211  -1.849
   35    H    ASP   5           H        ASP   5 -14.037   6.034  -1.434
   36    HA   ASP   5           HA       ASP   5 -15.512   7.297  -3.607
   37   1HB   ASP   5          2HB       ASP   5 -17.105   5.644  -2.509
   38   2HB   ASP   5          3HB       ASP   5 -16.908   6.543  -0.994
   39    H    VAL   6           H        VAL   6 -13.126   7.915  -2.367
   40    HA   VAL   6           HA       VAL   6 -13.743  10.545  -1.090
   41    HB   VAL   6           HB       VAL   6 -11.635   8.450  -0.418
   42   1HG1  VAL   6          1HG1      VAL   6 -10.582  10.169   1.078
   43   2HG1  VAL   6          2HG1      VAL   6 -10.259  10.388  -0.637
   44   3HG1  VAL   6          3HG1      VAL   6 -11.460  11.424   0.172
   45   1HG2  VAL   6          1HG2      VAL   6 -13.854   8.585   0.738
   46   2HG2  VAL   6          2HG2      VAL   6 -12.457   8.754   1.822
   47   3HG2  VAL   6          3HG2      VAL   6 -13.405  10.185   1.342
   48    H    LEU   7           H        LEU   7 -11.206   8.705  -2.785
   49    HA   LEU   7           HA       LEU   7 -10.908  10.496  -4.978
   50   1HB   LEU   7          2HB       LEU   7  -9.978  12.156  -3.704
   51   2HB   LEU   7          3HB       LEU   7  -9.270  11.076  -2.518
   52    HG   LEU   7           HG       LEU   7  -8.030  10.898  -5.224
   53   1HD1  LEU   7          1HD1      LEU   7  -6.685  12.933  -4.863
   54   2HD1  LEU   7          2HD1      LEU   7  -8.395  13.310  -5.154
   55   3HD1  LEU   7          3HD1      LEU   7  -7.732  13.390  -3.503
   56   1HD2  LEU   7          1HD2      LEU   7  -7.153   9.737  -3.139
   57   2HD2  LEU   7          2HD2      LEU   7  -5.989  10.863  -3.858
   58   3HD2  LEU   7          3HD2      LEU   7  -6.879  11.327  -2.411
   59    H    SER   8           H        SER   8  -9.162   8.331  -2.694
   60    HA   SER   8           HA       SER   8  -7.352   7.232  -4.251
   61   1HB   SER   8          2HB       SER   8  -8.958   5.562  -2.376
   62   2HB   SER   8          3HB       SER   8  -7.225   5.452  -2.733
   63    HG   SER   8           HG       SER   8  -7.031   7.601  -1.859
   64    H    ALA   9           H        ALA   9 -10.793   6.323  -4.502
   65    HA   ALA   9           HA       ALA   9 -10.519   4.011  -6.048
   66   1HB   ALA   9          1HB       ALA   9 -12.542   6.209  -6.682
   67   2HB   ALA   9          2HB       ALA   9 -12.764   4.447  -6.798
   68   3HB   ALA   9          3HB       ALA   9 -12.650   5.237  -5.213
   69    H    ASP  10           H        ASP  10 -10.125   7.404  -7.151
   70    HA   ASP  10           HA       ASP  10  -9.870   6.581  -9.956
   71   1HB   ASP  10          2HB       ASP  10 -10.801   8.799  -9.187
   72   2HB   ASP  10          3HB       ASP  10  -9.164   9.244  -8.667
   73    H    ASP  11           H        ASP  11  -7.815   7.329  -7.174
   74    HA   ASP  11           HA       ASP  11  -5.284   7.573  -8.417
   75   1HB   ASP  11          2HB       ASP  11  -5.915   6.319  -5.686
   76   2HB   ASP  11          3HB       ASP  11  -4.376   6.872  -6.234
   77    H    ILE  12           H        ILE  12  -6.952   4.744  -6.944
   78    HA   ILE  12           HA       ILE  12  -4.948   2.940  -7.571
   79    HB   ILE  12           HB       ILE  12  -6.489   1.216  -7.111
   80   1HG1  ILE  12          2HG1      ILE  12  -8.646   3.259  -6.882
   81   2HG1  ILE  12          3HG1      ILE  12  -8.557   1.961  -8.079
   82   1HG2  ILE  12          1HG2      ILE  12  -5.297   2.452  -5.305
   83   2HG2  ILE  12          2HG2      ILE  12  -6.762   3.406  -5.029
   84   3HG2  ILE  12          3HG2      ILE  12  -6.778   1.660  -4.764
   85   1HD1  ILE  12          1HD1      ILE  12  -8.677   0.303  -6.184
   86   2HD1  ILE  12          2HD1      ILE  12  -9.031   1.671  -5.092
   87   3HD1  ILE  12          3HD1      ILE  12 -10.131   1.289  -6.423
   88    H    ALA  13           H        ALA  13  -7.842   3.959  -9.400
   89    HA   ALA  13           HA       ALA  13  -7.670   2.137 -11.527
   90   1HB   ALA  13          1HB       ALA  13  -9.474   3.887 -11.120
   91   2HB   ALA  13          2HB       ALA  13  -8.397   5.063 -11.901
   92   3HB   ALA  13          3HB       ALA  13  -8.966   3.653 -12.802
   93    H    ALA  14           H        ALA  14  -5.881   5.246 -11.084
   94    HA   ALA  14           HA       ALA  14  -4.384   5.010 -13.533
   95   1HB   ALA  14          1HB       ALA  14  -4.483   7.133 -12.333
   96   2HB   ALA  14          2HB       ALA  14  -3.602   6.439 -10.957
   97   3HB   ALA  14          3HB       ALA  14  -2.799   6.584 -12.532
   98    H    ALA  15           H        ALA  15  -3.367   4.254 -10.145
   99    HA   ALA  15           HA       ALA  15  -0.894   3.187 -10.655
  100   1HB   ALA  15          1HB       ALA  15  -2.038   3.631  -8.399
  101   2HB   ALA  15          2HB       ALA  15  -2.839   2.062  -8.593
  102   3HB   ALA  15          3HB       ALA  15  -1.065   2.157  -8.522
  103    H    LEU  16           H        LEU  16  -3.968   1.493 -10.705
  104    HA   LEU  16           HA       LEU  16  -3.169  -1.102 -11.125
  105   1HB   LEU  16          2HB       LEU  16  -5.451  -0.368 -10.637
  106   2HB   LEU  16          3HB       LEU  16  -5.597   0.385 -12.222
  107    HG   LEU  16           HG       LEU  16  -6.861  -1.672 -11.936
  108   1HD1  LEU  16          1HD1      LEU  16  -4.779  -2.263 -14.051
  109   2HD1  LEU  16          2HD1      LEU  16  -6.495  -2.657 -14.022
  110   3HD1  LEU  16          3HD1      LEU  16  -5.992  -0.969 -14.210
  111   1HD2  LEU  16          1HD2      LEU  16  -5.834  -3.866 -11.799
  112   2HD2  LEU  16          2HD2      LEU  16  -4.210  -3.153 -11.756
  113   3HD2  LEU  16          3HD2      LEU  16  -5.346  -2.874 -10.414
  114    H    GLN  17           H        GLN  17  -3.449   1.603 -13.470
  115    HA   GLN  17           HA       GLN  17  -2.768  -0.229 -15.695
  116   1HB   GLN  17          2HB       GLN  17  -3.807   2.599 -15.559
  117   2HB   GLN  17          3HB       GLN  17  -2.862   2.070 -16.957
  118   1HG   GLN  17          2HG       GLN  17  -4.420   0.031 -17.111
  119   2HG   GLN  17          3HG       GLN  17  -5.492   0.902 -16.005
  120   1HE2  GLN  17          1HE2      GLN  17  -6.204   3.126 -16.777
  121   2HE2  GLN  17          2HE2      GLN  17  -6.315   3.393 -18.510
  122    H    GLU  18           H        GLU  18  -1.186   2.256 -13.666
  123    HA   GLU  18           HA       GLU  18   1.023   2.397 -15.551
  124   1HB   GLU  18          2HB       GLU  18   1.893   4.034 -14.351
  125   2HB   GLU  18          3HB       GLU  18   0.215   4.181 -13.930
  126   1HG   GLU  18          2HG       GLU  18   0.726   4.167 -11.821
  127   2HG   GLU  18          3HG       GLU  18   1.275   2.494 -11.899
  128    H    CYS  19           H        CYS  19   0.229   0.273 -12.870
  129    HA   CYS  19           HA       CYS  19   2.718  -1.315 -13.401
  130   1HB   CYS  19          2HB       CYS  19   1.235  -0.849 -10.781
  131   2HB   CYS  19          3HB       CYS  19   2.567  -1.999 -11.016
  132    HG   CYS  19           HG       CYS  19   4.353  -0.298 -11.739
  133    H    ARG  20           H        ARG  20   0.437  -1.772 -15.018
  134    HA   ARG  20           HA       ARG  20  -1.047  -3.994 -13.770
  135   1HB   ARG  20          2HB       ARG  20  -2.067  -4.480 -15.776
  136   2HB   ARG  20          3HB       ARG  20  -2.199  -2.751 -15.556
  137   1HG   ARG  20          2HG       ARG  20  -0.136  -4.014 -17.453
  138   2HG   ARG  20          3HG       ARG  20  -1.809  -3.713 -17.890
  139   1HD   ARG  20          2HD       ARG  20  -1.581  -1.353 -17.292
  140   2HD   ARG  20          3HD       ARG  20   0.169  -1.588 -17.016
  141    HE   ARG  20           HE       ARG  20  -0.002  -2.528 -19.483
  142   1HH1  ARG  20          2HH2      ARG  20  -0.745   0.517 -17.981
  143   2HH1  ARG  20          1HH2      ARG  20  -1.170   1.389 -19.431
  144   1HH2  ARG  20          2HH1      ARG  20  -0.563  -1.450 -21.521
  145   2HH2  ARG  20          1HH1      ARG  20  -0.942   0.245 -21.518
  146    H    ASP  21           H        ASP  21   1.690  -3.474 -15.957
  147    HA   ASP  21           HA       ASP  21   2.061  -6.040 -16.832
  148   1HB   ASP  21          2HB       ASP  21   4.166  -3.885 -16.377
  149   2HB   ASP  21          3HB       ASP  21   4.248  -5.199 -17.557
  150    HA   PRO  22           HA       PRO  22   3.256  -8.048 -13.121
  151   1HB   PRO  22          2HB       PRO  22   4.751 -10.206 -14.018
  152   2HB   PRO  22          3HB       PRO  22   2.971 -10.091 -14.197
  153   1HG   PRO  22          2HG       PRO  22   5.084  -9.351 -16.229
  154   2HG   PRO  22          3HG       PRO  22   3.640 -10.378 -16.481
  155   1HD   PRO  22          2HD       PRO  22   3.631  -7.758 -17.162
  156   2HD   PRO  22          3HD       PRO  22   2.186  -8.470 -16.378
  157    H    ASP  23           H        ASP  23   4.975  -8.041 -11.597
  158    HA   ASP  23           HA       ASP  23   6.871  -7.569 -10.702
  159   1HB   ASP  23          2HB       ASP  23   8.348  -8.276 -13.181
  160   2HB   ASP  23          3HB       ASP  23   8.731  -8.593 -11.477
  161    H    THR  24           H        THR  24   5.485  -5.392 -12.295
  162    HA   THR  24           HA       THR  24   7.739  -3.449 -12.510
  163    HB   THR  24           HB       THR  24   4.944  -2.956 -13.552
  164    HG1  THR  24           1HG      THR  24   5.270  -4.834 -14.453
  165   1HG2  THR  24          1HG2      THR  24   6.173  -1.807 -15.366
  166   2HG2  THR  24          2HG2      THR  24   6.587  -1.110 -13.793
  167   3HG2  THR  24          3HG2      THR  24   7.718  -2.222 -14.597
  168    H    PHE  25           H        PHE  25   5.922  -4.349 -10.028
  169    HA   PHE  25           HA       PHE  25   4.692  -1.739  -9.365
  170   1HB   PHE  25          2HB       PHE  25   3.759  -4.089  -8.833
  171   2HB   PHE  25          3HB       PHE  25   4.909  -4.074  -7.485
  172    HD1  PHE  25           1HD      PHE  25   1.589  -3.424  -8.364
  173    HD2  PHE  25           2HD      PHE  25   4.825  -1.761  -6.026
  174    HE1  PHE  25           1HE      PHE  25  -0.037  -2.521  -6.732
  175    HE2  PHE  25           2HE      PHE  25   3.160  -0.674  -4.551
  176    HZ   PHE  25           HZ       PHE  25   0.757  -1.226  -4.770
  177    H    GLU  26           H        GLU  26   6.073  -0.187  -8.647
  178    HA   GLU  26           HA       GLU  26   8.361  -0.948  -6.895
  179   1HB   GLU  26          2HB       GLU  26   8.059   1.091  -9.058
  180   2HB   GLU  26          3HB       GLU  26   8.972   1.584  -7.618
  181   1HG   GLU  26          2HG       GLU  26  10.465  -0.350  -7.889
  182   2HG   GLU  26          3HG       GLU  26   9.550  -0.859  -9.325
  183    HA   PRO  27           HA       PRO  27   6.208   0.861  -3.606
  184   1HB   PRO  27          2HB       PRO  27   8.261   1.913  -2.050
  185   2HB   PRO  27          3HB       PRO  27   7.811   0.199  -2.141
  186   1HG   PRO  27          2HG       PRO  27  10.064   1.643  -3.544
  187   2HG   PRO  27          3HG       PRO  27  10.055  -0.003  -2.856
  188   1HD   PRO  27          2HD       PRO  27   9.779   0.475  -5.525
  189   2HD   PRO  27          3HD       PRO  27   8.994  -0.894  -4.689
  190    H    GLN  28           H        GLN  28   8.882   3.294  -3.893
  191    HA   GLN  28           HA       GLN  28   7.450   5.502  -3.335
  192   1HB   GLN  28          2HB       GLN  28  10.084   4.885  -4.140
  193   2HB   GLN  28          3HB       GLN  28   9.501   5.966  -5.410
  194   1HG   GLN  28          2HG       GLN  28   8.673   7.457  -3.540
  195   2HG   GLN  28          3HG       GLN  28   9.558   6.439  -2.398
  196   1HE2  GLN  28          1HE2      GLN  28  10.986   8.211  -1.755
  197   2HE2  GLN  28          2HE2      GLN  28  12.221   8.770  -2.864
  198    H    LYS  29           H        LYS  29   7.964   4.004  -6.465
  199    HA   LYS  29           HA       LYS  29   6.743   5.756  -8.238
  200   1HB   LYS  29          2HB       LYS  29   8.134   3.764  -8.747
  201   2HB   LYS  29          3HB       LYS  29   6.822   2.730  -8.180
  202   1HG   LYS  29          2HG       LYS  29   6.977   2.688 -10.550
  203   2HG   LYS  29          3HG       LYS  29   5.429   3.345 -10.071
  204   1HD   LYS  29          2HD       LYS  29   7.820   5.123 -10.792
  205   2HD   LYS  29          3HD       LYS  29   6.794   4.377 -12.020
  206   1HE   LYS  29          2HE       LYS  29   4.896   5.551 -10.340
  207   2HE   LYS  29          3HE       LYS  29   6.217   6.727 -10.297
  208   1HZ   LYS  29          1HZ       LYS  29   4.769   5.641 -12.605
  209   2HZ   LYS  29          2HZ       LYS  29   4.721   7.175 -12.079
  210   3HZ   LYS  29          3HZ       LYS  29   6.108   6.605 -12.786
  211    H    PHE  30           H        PHE  30   5.155   2.809  -6.796
  212    HA   PHE  30           HA       PHE  30   2.547   3.444  -7.649
  213   1HB   PHE  30          2HB       PHE  30   3.217   1.237  -6.893
  214   2HB   PHE  30          3HB       PHE  30   3.539   1.838  -5.271
  215    HD1  PHE  30           1HD      PHE  30   1.699   2.320  -3.695
  216    HD2  PHE  30           2HD      PHE  30   0.921   0.875  -7.685
  217    HE1  PHE  30           1HE      PHE  30  -0.619   1.743  -3.036
  218    HE2  PHE  30           2HE      PHE  30  -1.380   0.247  -7.000
  219    HZ   PHE  30           HZ       PHE  30  -2.164   0.701  -4.686
  220    H    PHE  31           H        PHE  31   4.253   4.182  -4.642
  221    HA   PHE  31           HA       PHE  31   2.217   5.349  -3.109
  222   1HB   PHE  31          2HB       PHE  31   4.191   4.878  -2.042
  223   2HB   PHE  31          3HB       PHE  31   5.203   5.529  -3.320
  224    HD1  PHE  31           1HD      PHE  31   2.551   6.801  -1.058
  225    HD2  PHE  31           2HD      PHE  31   6.387   7.512  -2.880
  226    HE1  PHE  31           1HE      PHE  31   2.713   8.997   0.053
  227    HE2  PHE  31           2HE      PHE  31   6.675   9.542  -1.482
  228    HZ   PHE  31           HZ       PHE  31   4.880  10.168   0.142
  229    H    GLN  32           H        GLN  32   4.415   7.024  -5.427
  230    HA   GLN  32           HA       GLN  32   3.007   9.554  -5.143
  231   1HB   GLN  32          2HB       GLN  32   5.266   8.523  -6.867
  232   2HB   GLN  32          3HB       GLN  32   4.408  10.005  -7.319
  233   1HG   GLN  32          2HG       GLN  32   4.856  11.015  -5.139
  234   2HG   GLN  32          3HG       GLN  32   5.648   9.535  -4.579
  235   1HE2  GLN  32          1HE2      GLN  32   5.826  11.759  -7.448
  236   2HE2  GLN  32          2HE2      GLN  32   7.582  11.834  -7.439
  237    H    THR  33           H        THR  33   2.843   6.756  -7.474
  238    HA   THR  33           HA       THR  33   1.356   8.216  -9.302
  239    HB   THR  33           HB       THR  33   2.462   5.791  -9.546
  240    HG1  THR  33           1HG      THR  33   0.132   6.901 -10.523
  241   1HG2  THR  33          1HG2      THR  33   0.952   3.970  -9.578
  242   2HG2  THR  33          2HG2      THR  33   0.667   4.643  -7.996
  243   3HG2  THR  33          3HG2      THR  33  -0.456   5.017  -9.299
  244    H    SER  34           H        SER  34   0.358   6.285  -6.490
  245    HA   SER  34           HA       SER  34  -2.440   6.544  -6.969
  246   1HB   SER  34          2HB       SER  34  -2.594   6.185  -4.442
  247   2HB   SER  34          3HB       SER  34  -1.812   4.907  -5.390
  248    HG   SER  34           HG       SER  34   0.189   5.623  -4.724
  249    H    GLY  35           H        GLY  35  -0.019   8.392  -5.072
  250   1HA   GLY  35          1HA       GLY  35   0.078  10.776  -5.008
  251   2HA   GLY  35          2HA       GLY  35  -1.664  10.895  -5.298
  252    H    LEU  36           H        LEU  36  -0.523   8.380  -3.123
  253    HA   LEU  36           HA       LEU  36  -1.741   9.510  -0.798
  254   1HB   LEU  36          2HB       LEU  36   0.461   7.462  -1.062
  255   2HB   LEU  36          3HB       LEU  36  -0.465   7.800   0.414
  256    HG   LEU  36           HG       LEU  36  -1.819   6.839  -2.127
  257   1HD1  LEU  36          1HD1      LEU  36  -0.694   5.173   0.164
  258   2HD1  LEU  36          2HD1      LEU  36  -1.706   4.569  -1.168
  259   3HD1  LEU  36          3HD1      LEU  36  -0.087   5.202  -1.506
  260   1HD2  LEU  36          1HD2      LEU  36  -2.606   6.756   0.821
  261   2HD2  LEU  36          2HD2      LEU  36  -3.299   7.832  -0.412
  262   3HD2  LEU  36          3HD2      LEU  36  -3.546   6.085  -0.527
  263    H    SER  37           H        SER  37   1.336  10.054  -2.412
  264    HA   SER  37           HA       SER  37   2.788  11.304  -0.243
  265   1HB   SER  37          2HB       SER  37   3.746  10.546  -2.517
  266   2HB   SER  37          3HB       SER  37   2.896  11.907  -3.232
  267    HG   SER  37           HG       SER  37   5.033  12.078  -1.315
  268    H    LYS  38           H        LYS  38  -0.015  12.293  -2.071
  269    HA   LYS  38           HA       LYS  38   0.426  15.113  -1.341
  270   1HB   LYS  38          2HB       LYS  38  -0.581  13.946  -3.724
  271   2HB   LYS  38          3HB       LYS  38  -2.010  14.505  -2.865
  272   1HG   LYS  38          2HG       LYS  38  -1.307  16.308  -4.248
  273   2HG   LYS  38          3HG       LYS  38  -0.888  16.749  -2.584
  274   1HD   LYS  38          2HD       LYS  38   1.475  15.964  -3.014
  275   2HD   LYS  38          3HD       LYS  38   1.041  15.581  -4.671
  276   1HE   LYS  38          2HE       LYS  38   0.436  18.386  -3.717
  277   2HE   LYS  38          3HE       LYS  38   2.143  17.950  -3.799
  278   1HZ   LYS  38          1HZ       LYS  38   1.378  18.929  -5.831
  279   2HZ   LYS  38          2HZ       LYS  38   1.884  17.389  -6.086
  280   3HZ   LYS  38          3HZ       LYS  38   0.272  17.732  -6.058
  281    H    MET  39           H        MET  39  -1.318  12.185  -0.518
  282    HA   MET  39           HA       MET  39  -3.427  13.582   0.866
  283   1HB   MET  39          2HB       MET  39  -2.364  10.758   0.978
  284   2HB   MET  39          3HB       MET  39  -3.611  11.320   2.059
  285   1HG   MET  39          2HG       MET  39  -3.903  11.464  -0.971
  286   2HG   MET  39          3HG       MET  39  -4.418  10.123   0.040
  287   1HE   MET  39          1HE       MET  39  -5.299  14.262   0.254
  288   2HE   MET  39          2HE       MET  39  -5.292  13.530  -1.375
  289   3HE   MET  39          3HE       MET  39  -6.818  13.940  -0.567
  290    H    SER  40           H        SER  40  -3.693  13.991   3.036
  291    HA   SER  40           HA       SER  40  -1.241  14.800   4.379
  292   1HB   SER  40          2HB       SER  40  -3.464  16.075   4.417
  293   2HB   SER  40          3HB       SER  40  -4.066  14.813   5.512
  294    HG   SER  40           HG       SER  40  -1.972  16.673   5.904
  295    H    ALA  41           H        ALA  41  -0.657  14.093   6.510
  296    HA   ALA  41           HA       ALA  41  -0.330  11.390   6.978
  297   1HB   ALA  41          1HB       ALA  41   0.918  13.066   8.203
  298   2HB   ALA  41          2HB       ALA  41  -0.561  13.667   8.990
  299   3HB   ALA  41          3HB       ALA  41   0.042  12.042   9.362
  300    H    ASN  42           H        ASN  42  -3.014  13.457   8.070
  301    HA   ASN  42           HA       ASN  42  -4.462  11.631   9.680
  302   1HB   ASN  42          2HB       ASN  42  -5.031  14.149   8.199
  303   2HB   ASN  42          3HB       ASN  42  -6.417  13.067   8.257
  304   1HD2  ASN  42          1HD2      ASN  42  -3.823  13.967  10.643
  305   2HD2  ASN  42          2HD2      ASN  42  -4.989  14.331  11.906
  306    H    GLN  43           H        GLN  43  -4.952  12.282   6.187
  307    HA   GLN  43           HA       GLN  43  -6.831  10.185   5.793
  308   1HB   GLN  43          2HB       GLN  43  -5.426  12.167   4.157
  309   2HB   GLN  43          3HB       GLN  43  -5.454  10.613   3.336
  310   1HG   GLN  43          2HG       GLN  43  -7.959  11.838   4.557
  311   2HG   GLN  43          3HG       GLN  43  -7.417  12.207   2.919
  312   1HE2  GLN  43          1HE2      GLN  43  -9.680  10.334   4.384
  313   2HE2  GLN  43          2HE2      GLN  43  -9.666   8.989   3.263
  314    H    VAL  44           H        VAL  44  -3.229  10.269   5.396
  315    HA   VAL  44           HA       VAL  44  -3.006   7.651   4.346
  316    HB   VAL  44           HB       VAL  44  -1.119   9.399   5.967
  317   1HG1  VAL  44          1HG1      VAL  44  -0.557   6.840   4.432
  318   2HG1  VAL  44          2HG1      VAL  44   0.681   7.997   4.982
  319   3HG1  VAL  44          3HG1      VAL  44  -0.297   7.118   6.169
  320   1HG2  VAL  44          1HG2      VAL  44  -1.246   8.810   2.971
  321   2HG2  VAL  44          2HG2      VAL  44  -1.881  10.282   3.708
  322   3HG2  VAL  44          3HG2      VAL  44  -0.156   9.949   3.791
  323    H    LYS  45           H        LYS  45  -3.225   8.823   7.744
  324    HA   LYS  45           HA       LYS  45  -2.726   6.256   8.898
  325   1HB   LYS  45          2HB       LYS  45  -2.826   8.758   9.926
  326   2HB   LYS  45          3HB       LYS  45  -4.430   8.203  10.371
  327   1HG   LYS  45          2HG       LYS  45  -3.211   7.526  12.173
  328   2HG   LYS  45          3HG       LYS  45  -3.144   6.037  11.240
  329   1HD   LYS  45          2HD       LYS  45  -0.887   6.555  10.443
  330   2HD   LYS  45          3HD       LYS  45  -1.003   8.214  11.050
  331   1HE   LYS  45          2HE       LYS  45  -1.042   7.436  13.371
  332   2HE   LYS  45          3HE       LYS  45  -0.925   5.751  12.846
  333   1HZ   LYS  45          1HZ       LYS  45   1.240   6.194  11.984
  334   2HZ   LYS  45          2HZ       LYS  45   1.088   7.803  12.149
  335   3HZ   LYS  45          3HZ       LYS  45   1.215   6.850  13.494
  336    H    ASP  46           H        ASP  46  -5.739   8.054   8.085
  337    HA   ASP  46           HA       ASP  46  -7.596   6.139   9.048
  338   1HB   ASP  46          2HB       ASP  46  -7.752   8.186   6.794
  339   2HB   ASP  46          3HB       ASP  46  -9.104   7.135   7.217
  340    H    VAL  47           H        VAL  47  -6.270   6.502   5.712
  341    HA   VAL  47           HA       VAL  47  -7.497   4.116   4.772
  342    HB   VAL  47           HB       VAL  47  -6.083   4.173   2.876
  343   1HG1  VAL  47          1HG1      VAL  47  -6.807   6.157   1.962
  344   2HG1  VAL  47          2HG1      VAL  47  -7.813   6.133   3.431
  345   3HG1  VAL  47          3HG1      VAL  47  -6.355   7.121   3.361
  346   1HG2  VAL  47          1HG2      VAL  47  -4.338   6.068   4.325
  347   2HG2  VAL  47          2HG2      VAL  47  -3.882   4.451   3.749
  348   3HG2  VAL  47          3HG2      VAL  47  -4.223   5.748   2.584
  349    H    PHE  48           H        PHE  48  -4.298   4.638   6.388
  350    HA   PHE  48           HA       PHE  48  -3.296   2.013   6.260
  351   1HB   PHE  48          2HB       PHE  48  -1.908   3.671   7.067
  352   2HB   PHE  48          3HB       PHE  48  -3.038   4.189   8.291
  353    HD1  PHE  48           1HD      PHE  48  -0.457   1.728   7.491
  354    HD2  PHE  48           2HD      PHE  48  -3.495   2.875  10.332
  355    HE1  PHE  48           1HE      PHE  48   0.491   0.173   9.149
  356    HE2  PHE  48           2HE      PHE  48  -2.768   1.047  11.837
  357    HZ   PHE  48           HZ       PHE  48  -0.771  -0.315  11.260
  358    H    ARG  49           H        ARG  49  -5.645   3.360   8.678
  359    HA   ARG  49           HA       ARG  49  -5.927   0.894  10.093
  360   1HB   ARG  49          2HB       ARG  49  -7.821   3.248   9.759
  361   2HB   ARG  49          3HB       ARG  49  -8.230   1.802  10.686
  362   1HG   ARG  49          2HG       ARG  49  -6.137   2.135  12.068
  363   2HG   ARG  49          3HG       ARG  49  -5.880   3.666  11.209
  364   1HD   ARG  49          2HD       ARG  49  -7.014   4.105  13.322
  365   2HD   ARG  49          3HD       ARG  49  -8.102   4.447  11.956
  366    HE   ARG  49           HE       ARG  49  -8.347   1.717  13.022
  367   1HH1  ARG  49          2HH2      ARG  49  -9.430   5.044  13.491
  368   2HH1  ARG  49          1HH2      ARG  49 -10.920   4.611  14.269
  369   1HH2  ARG  49          2HH1      ARG  49 -10.220   1.108  14.045
  370   2HH2  ARG  49          1HH1      ARG  49 -11.418   2.271  14.572
  371    H    PHE  50           H        PHE  50  -7.506   1.976   7.078
  372    HA   PHE  50           HA       PHE  50  -9.403  -0.247   7.033
  373   1HB   PHE  50          2HB       PHE  50  -8.449   1.763   4.998
  374   2HB   PHE  50          3HB       PHE  50  -9.151   0.262   4.443
  375    HD1  PHE  50           1HD      PHE  50  -9.887   3.083   6.834
  376    HD2  PHE  50           2HD      PHE  50 -11.472   0.066   4.182
  377    HE1  PHE  50           1HE      PHE  50 -12.175   3.988   7.154
  378    HE2  PHE  50           2HE      PHE  50 -13.751   0.983   4.509
  379    HZ   PHE  50           HZ       PHE  50 -14.108   2.926   6.002
  380    H    ILE  51           H        ILE  51  -5.996   0.213   6.114
  381    HA   ILE  51           HA       ILE  51  -5.885  -2.289   4.664
  382    HB   ILE  51           HB       ILE  51  -3.513  -0.776   5.781
  383   1HG1  ILE  51          2HG1      ILE  51  -4.324   0.935   4.496
  384   2HG1  ILE  51          3HG1      ILE  51  -3.365   0.074   3.329
  385   1HG2  ILE  51          1HG2      ILE  51  -3.046  -3.059   4.970
  386   2HG2  ILE  51          2HG2      ILE  51  -3.896  -2.726   3.474
  387   3HG2  ILE  51          3HG2      ILE  51  -2.373  -1.888   3.838
  388   1HD1  ILE  51          1HD1      ILE  51  -5.519  -1.061   2.530
  389   2HD1  ILE  51          2HD1      ILE  51  -6.403   0.102   3.541
  390   3HD1  ILE  51          3HD1      ILE  51  -5.357   0.690   2.260
  391    H    ASP  52           H        ASP  52  -4.867  -1.280   7.988
  392    HA   ASP  52           HA       ASP  52  -4.102  -4.001   8.683
  393   1HB   ASP  52          2HB       ASP  52  -3.227  -1.834   9.807
  394   2HB   ASP  52          3HB       ASP  52  -4.731  -1.802  10.703
  395    H    ASN  53           H        ASN  53  -6.196  -4.727   7.687
  396    HA   ASN  53           HA       ASN  53  -8.741  -4.148   8.640
  397   1HB   ASN  53          2HB       ASN  53  -8.199  -5.288   6.559
  398   2HB   ASN  53          3HB       ASN  53  -7.686  -6.743   7.424
  399   1HD2  ASN  53          1HD2      ASN  53  -9.319  -8.172   8.263
  400   2HD2  ASN  53          2HD2      ASN  53 -11.011  -7.942   7.880
  401    H    ASP  54           H        ASP  54  -6.404  -6.509   9.883
  402    HA   ASP  54           HA       ASP  54  -8.218  -7.802  11.751
  403   1HB   ASP  54          2HB       ASP  54  -6.129  -8.871  12.491
  404   2HB   ASP  54          3HB       ASP  54  -6.251  -8.926  10.722
  405    H    GLN  55           H        GLN  55  -6.404  -4.829  11.682
  406    HA   GLN  55           HA       GLN  55  -5.699  -3.347  13.169
  407   1HB   GLN  55          2HB       GLN  55  -8.356  -4.173  14.243
  408   2HB   GLN  55          3HB       GLN  55  -7.360  -3.090  15.230
  409   1HG   GLN  55          2HG       GLN  55  -7.076  -1.529  13.355
  410   2HG   GLN  55          3HG       GLN  55  -8.082  -2.552  12.320
  411   1HE2  GLN  55          1HE2      GLN  55 -10.126  -3.200  14.251
  412   2HE2  GLN  55          2HE2      GLN  55 -11.027  -1.735  14.559
  413    H    SER  56           H        SER  56  -3.820  -4.606  13.416
  414    HA   SER  56           HA       SER  56  -3.468  -5.766  16.175
  415   1HB   SER  56          2HB       SER  56  -1.509  -6.908  15.397
  416   2HB   SER  56          3HB       SER  56  -2.928  -7.447  14.515
  417    HG   SER  56           HG       SER  56  -0.681  -6.639  13.498
  418    H    GLY  57           H        GLY  57  -2.421  -3.275  13.854
  419   1HA   GLY  57          1HA       GLY  57  -1.061  -1.441  14.334
  420   2HA   GLY  57          2HA       GLY  57  -0.560  -2.138  15.878
  421    H    TYR  58           H        TYR  58  -0.423  -4.493  13.382
  422    HA   TYR  58           HA       TYR  58   2.124  -3.565  12.253
  423   1HB   TYR  58          2HB       TYR  58   1.807  -6.209  13.683
  424   2HB   TYR  58          3HB       TYR  58   2.829  -6.069  12.262
  425    HD1  TYR  58           HD1      TYR  58   4.700  -4.375  12.162
  426    HD2  TYR  58           HD2      TYR  58   2.794  -5.603  15.825
  427    HE1  TYR  58           HE1      TYR  58   6.672  -3.613  13.424
  428    HE2  TYR  58           HE2      TYR  58   4.824  -4.924  17.088
  429    HH   TYR  58           HH       TYR  58   7.645  -3.408  15.512
  430    H    LEU  59           H        LEU  59   2.145  -3.775  10.194
  431    HA   LEU  59           HA       LEU  59   0.198  -5.433   8.689
  432   1HB   LEU  59          2HB       LEU  59   1.945  -3.070   7.932
  433   2HB   LEU  59          3HB       LEU  59   1.323  -4.197   6.722
  434    HG   LEU  59           HG       LEU  59  -0.028  -2.161   6.940
  435   1HD1  LEU  59          1HD1      LEU  59  -1.097  -4.230   6.097
  436   2HD1  LEU  59          2HD1      LEU  59  -1.588  -4.666   7.749
  437   3HD1  LEU  59          3HD1      LEU  59  -2.225  -3.202   7.015
  438   1HD2  LEU  59          1HD2      LEU  59  -1.336  -1.666   8.808
  439   2HD2  LEU  59          2HD2      LEU  59  -0.997  -3.205   9.618
  440   3HD2  LEU  59          3HD2      LEU  59   0.287  -1.992   9.473
  441    H    ASP  60           H        ASP  60   1.299  -7.206   9.677
  442    HA   ASP  60           HA       ASP  60   3.931  -7.965   8.935
  443   1HB   ASP  60          2HB       ASP  60   1.468  -9.694   9.411
  444   2HB   ASP  60          3HB       ASP  60   3.159 -10.221   9.503
  445    H    GLU  61           H        GLU  61   4.593  -9.413   7.253
  446    HA   GLU  61           HA       GLU  61   4.055  -8.553   4.715
  447   1HB   GLU  61          2HB       GLU  61   5.074 -11.285   5.625
  448   2HB   GLU  61          3HB       GLU  61   5.201 -10.667   3.972
  449   1HG   GLU  61          2HG       GLU  61   6.583  -8.807   4.701
  450   2HG   GLU  61          3HG       GLU  61   6.424  -9.260   6.401
  451    H    GLU  62           H        GLU  62   2.598 -11.401   6.282
  452    HA   GLU  62           HA       GLU  62   1.256 -12.393   4.004
  453   1HB   GLU  62          2HB       GLU  62   1.768 -13.536   6.235
  454   2HB   GLU  62          3HB       GLU  62   0.342 -12.729   6.903
  455   1HG   GLU  62          2HG       GLU  62   0.252 -14.516   4.422
  456   2HG   GLU  62          3HG       GLU  62   0.100 -15.143   6.070
  457    H    GLU  63           H        GLU  63   0.149 -10.125   6.554
  458    HA   GLU  63           HA       GLU  63  -2.501  -9.760   5.569
  459   1HB   GLU  63          2HB       GLU  63  -0.668  -7.794   6.990
  460   2HB   GLU  63          3HB       GLU  63  -2.426  -7.685   6.871
  461   1HG   GLU  63          2HG       GLU  63  -2.691  -9.750   8.182
  462   2HG   GLU  63          3HG       GLU  63  -0.932  -9.974   8.285
  463    H    LEU  64           H        LEU  64   0.609  -8.112   4.875
  464    HA   LEU  64           HA       LEU  64  -0.441  -6.239   3.028
  465   1HB   LEU  64          2HB       LEU  64   1.983  -6.647   4.133
  466   2HB   LEU  64          3HB       LEU  64   2.332  -7.275   2.525
  467    HG   LEU  64           HG       LEU  64   1.036  -4.548   3.040
  468   1HD1  LEU  64          1HD1      LEU  64   3.995  -5.202   2.810
  469   2HD1  LEU  64          2HD1      LEU  64   3.291  -3.568   2.818
  470   3HD1  LEU  64          3HD1      LEU  64   3.129  -4.606   4.245
  471   1HD2  LEU  64          1HD2      LEU  64   1.872  -3.935   0.845
  472   2HD2  LEU  64          2HD2      LEU  64   2.684  -5.495   0.653
  473   3HD2  LEU  64          3HD2      LEU  64   0.909  -5.404   0.671
  474    H    LYS  65           H        LYS  65   0.587  -9.619   2.577
  475    HA   LYS  65           HA       LYS  65   0.232  -9.808  -0.227
  476   1HB   LYS  65          2HB       LYS  65   1.152 -11.511   1.565
  477   2HB   LYS  65          3HB       LYS  65  -0.534 -12.073   1.593
  478   1HG   LYS  65          2HG       LYS  65  -0.331 -12.245  -0.983
  479   2HG   LYS  65          3HG       LYS  65   1.405 -12.077  -0.735
  480   1HD   LYS  65          2HD       LYS  65  -0.481 -14.225   0.342
  481   2HD   LYS  65          3HD       LYS  65   0.809 -14.428  -0.860
  482   1HE   LYS  65          2HE       LYS  65   2.478 -13.774   0.971
  483   2HE   LYS  65          3HE       LYS  65   1.128 -13.798   2.124
  484   1HZ   LYS  65          1HZ       LYS  65   0.781 -16.095   1.616
  485   2HZ   LYS  65          2HZ       LYS  65   2.057 -16.102   0.565
  486   3HZ   LYS  65          3HZ       LYS  65   2.306 -15.836   2.169
  487    H    PHE  66           H        PHE  66  -2.199  -9.170   2.165
  488    HA   PHE  66           HA       PHE  66  -4.310  -9.665   0.113
  489   1HB   PHE  66          2HB       PHE  66  -4.227 -11.136   2.294
  490   2HB   PHE  66          3HB       PHE  66  -4.819  -9.694   3.094
  491    HD1  PHE  66           1HD      PHE  66  -7.176  -9.016   2.788
  492    HD2  PHE  66           2HD      PHE  66  -5.520 -12.289   0.521
  493    HE1  PHE  66           1HE      PHE  66  -9.445  -9.603   1.972
  494    HE2  PHE  66           2HE      PHE  66  -7.795 -12.886  -0.271
  495    HZ   PHE  66           HZ       PHE  66  -9.756 -11.528   0.430
  496    H    PHE  67           H        PHE  67  -2.515  -7.285   0.659
  497    HA   PHE  67           HA       PHE  67  -4.054  -5.277   1.968
  498   1HB   PHE  67          2HB       PHE  67  -1.760  -4.877   1.711
  499   2HB   PHE  67          3HB       PHE  67  -1.787  -5.245  -0.011
  500    HD1  PHE  67           1HD      PHE  67  -0.416  -3.295  -0.444
  501    HD2  PHE  67           2HD      PHE  67  -4.348  -2.861   1.296
  502    HE1  PHE  67           1HE      PHE  67  -0.496  -0.923  -1.162
  503    HE2  PHE  67           2HE      PHE  67  -4.468  -0.574   0.436
  504    HZ   PHE  67           HZ       PHE  67  -2.528   0.441  -0.733
  505    H    LEU  68           H        LEU  68  -3.462  -5.385  -1.618
  506    HA   LEU  68           HA       LEU  68  -5.390  -3.355  -1.905
  507   1HB   LEU  68          2HB       LEU  68  -3.261  -4.210  -3.305
  508   2HB   LEU  68          3HB       LEU  68  -4.543  -4.903  -4.283
  509    HG   LEU  68           HG       LEU  68  -4.569  -1.977  -3.482
  510   1HD1  LEU  68          1HD1      LEU  68  -2.975  -3.206  -5.763
  511   2HD1  LEU  68          2HD1      LEU  68  -3.313  -1.471  -5.584
  512   3HD1  LEU  68          3HD1      LEU  68  -2.336  -2.314  -4.366
  513   1HD2  LEU  68          1HD2      LEU  68  -5.386  -3.088  -6.185
  514   2HD2  LEU  68          2HD2      LEU  68  -6.508  -3.183  -4.833
  515   3HD2  LEU  68          3HD2      LEU  68  -5.914  -1.608  -5.386
  516    H    GLN  69           H        GLN  69  -5.770  -6.808  -1.959
  517    HA   GLN  69           HA       GLN  69  -8.279  -7.243  -3.007
  518   1HB   GLN  69          2HB       GLN  69  -7.197  -8.226  -0.343
  519   2HB   GLN  69          3HB       GLN  69  -8.572  -8.930  -1.187
  520   1HG   GLN  69          2HG       GLN  69  -5.718  -8.861  -2.248
  521   2HG   GLN  69          3HG       GLN  69  -6.470 -10.217  -1.441
  522   1HE2  GLN  69          1HE2      GLN  69  -5.370 -10.048  -4.253
  523   2HE2  GLN  69          2HE2      GLN  69  -6.656 -10.637  -5.206
  524    H    LYS  70           H        LYS  70  -7.519  -5.169  -0.262
  525    HA   LYS  70           HA       LYS  70 -10.264  -5.061   0.744
  526   1HB   LYS  70          2HB       LYS  70  -7.919  -3.200   1.246
  527   2HB   LYS  70          3HB       LYS  70  -9.372  -3.324   2.229
  528   1HG   LYS  70          2HG       LYS  70  -7.907  -5.924   1.969
  529   2HG   LYS  70          3HG       LYS  70  -6.930  -4.626   2.625
  530   1HD   LYS  70          2HD       LYS  70  -7.942  -5.878   4.378
  531   2HD   LYS  70          3HD       LYS  70  -8.508  -4.205   4.408
  532   1HE   LYS  70          2HE       LYS  70 -10.314  -5.866   2.785
  533   2HE   LYS  70          3HE       LYS  70 -10.051  -6.651   4.334
  534   1HZ   LYS  70          1HZ       LYS  70 -11.921  -5.084   4.275
  535   2HZ   LYS  70          2HZ       LYS  70 -10.837  -4.794   5.465
  536   3HZ   LYS  70          3HZ       LYS  70 -10.862  -3.830   4.115
  537    H    PHE  71           H        PHE  71  -8.427  -3.495  -1.750
  538    HA   PHE  71           HA       PHE  71 -10.278  -1.170  -1.980
  539   1HB   PHE  71          2HB       PHE  71  -7.686  -1.874  -3.414
  540   2HB   PHE  71          3HB       PHE  71  -8.657  -0.440  -3.692
  541    HD1  PHE  71           1HD      PHE  71  -8.834  -0.620  -0.223
  542    HD2  PHE  71           2HD      PHE  71  -5.951   0.014  -3.373
  543    HE1  PHE  71           1HE      PHE  71  -7.589   0.943   1.217
  544    HE2  PHE  71           2HE      PHE  71  -4.777   1.669  -1.960
  545    HZ   PHE  71           HZ       PHE  71  -5.635   2.193   0.315
  546    H    GLU  72           H        GLU  72  -8.753  -3.684  -4.023
  547    HA   GLU  72           HA       GLU  72 -11.034  -3.579  -5.940
  548   1HB   GLU  72          2HB       GLU  72  -8.381  -3.071  -6.492
  549   2HB   GLU  72          3HB       GLU  72  -8.403  -4.822  -6.694
  550   1HG   GLU  72          2HG       GLU  72  -8.840  -3.864  -8.835
  551   2HG   GLU  72          3HG       GLU  72 -10.434  -4.402  -8.295
  552    H    SER  73           H        SER  73 -10.915  -5.941  -7.121
  553    HA   SER  73           HA       SER  73 -10.688  -8.039  -4.987
  554   1HB   SER  73          2HB       SER  73 -12.845  -7.879  -7.146
  555   2HB   SER  73          3HB       SER  73 -12.714  -9.091  -5.862
  556    HG   SER  73           HG       SER  73 -13.006  -6.306  -5.375
  557    H    GLY  74           H        GLY  74  -8.556  -7.502  -6.571
  558   1HA   GLY  74          1HA       GLY  74  -7.642  -9.884  -7.466
  559   2HA   GLY  74          2HA       GLY  74  -8.576  -9.339  -8.875
  560    H    ALA  75           H        ALA  75  -6.230  -7.859  -6.489
  561    HA   ALA  75           HA       ALA  75  -5.051  -6.349  -8.767
  562   1HB   ALA  75          1HB       ALA  75  -5.749  -5.420  -6.374
  563   2HB   ALA  75          2HB       ALA  75  -4.141  -6.026  -5.949
  564   3HB   ALA  75          3HB       ALA  75  -4.298  -4.843  -7.246
  565    H    ARG  76           H        ARG  76  -2.517  -6.416  -7.004
  566    HA   ARG  76           HA       ARG  76  -1.505  -9.068  -7.932
  567   1HB   ARG  76          2HB       ARG  76  -0.979  -7.101  -9.381
  568   2HB   ARG  76          3HB       ARG  76  -0.101  -6.365  -8.032
  569   1HG   ARG  76          2HG       ARG  76   1.666  -7.731  -8.261
  570   2HG   ARG  76          3HG       ARG  76   0.698  -9.176  -8.495
  571   1HD   ARG  76          2HD       ARG  76   0.158  -8.538 -10.852
  572   2HD   ARG  76          3HD       ARG  76   1.129  -7.078 -10.663
  573    HE   ARG  76           HE       ARG  76   3.114  -8.364 -10.367
  574   1HH1  ARG  76          2HH2      ARG  76   0.496 -10.412 -11.541
  575   2HH1  ARG  76          1HH2      ARG  76   1.572 -11.669 -12.080
  576   1HH2  ARG  76          2HH1      ARG  76   4.511  -9.926 -10.992
  577   2HH2  ARG  76          1HH1      ARG  76   3.991 -11.317 -11.858
  578    H    GLU  77           H        GLU  77  -2.537  -8.727  -5.406
  579    HA   GLU  77           HA       GLU  77  -0.464  -8.156  -3.475
  580   1HB   GLU  77          2HB       GLU  77  -2.972  -9.646  -2.795
  581   2HB   GLU  77          3HB       GLU  77  -2.025  -8.479  -1.870
  582   1HG   GLU  77          2HG       GLU  77  -3.927  -7.315  -2.388
  583   2HG   GLU  77          3HG       GLU  77  -2.819  -6.721  -3.637
  584    H    LEU  78           H        LEU  78  -2.044 -10.864  -4.988
  585    HA   LEU  78           HA       LEU  78  -1.000 -13.054  -3.672
  586   1HB   LEU  78          2HB       LEU  78  -1.244 -13.042  -6.702
  587   2HB   LEU  78          3HB       LEU  78  -1.446 -14.370  -5.568
  588    HG   LEU  78           HG       LEU  78  -3.595 -14.000  -6.123
  589   1HD1  LEU  78          1HD1      LEU  78  -4.855 -13.001  -4.397
  590   2HD1  LEU  78          2HD1      LEU  78  -3.400 -13.678  -3.651
  591   3HD1  LEU  78          3HD1      LEU  78  -3.549 -11.924  -3.908
  592   1HD2  LEU  78          1HD2      LEU  78  -3.478 -12.328  -7.709
  593   2HD2  LEU  78          2HD2      LEU  78  -4.604 -11.681  -6.509
  594   3HD2  LEU  78          3HD2      LEU  78  -2.937 -11.077  -6.595
  595    H    THR  79           H        THR  79   0.600 -11.173  -6.324
  596    HA   THR  79           HA       THR  79   2.857 -12.915  -6.418
  597    HB   THR  79           HB       THR  79   2.851  -9.998  -7.255
  598    HG1  THR  79           1HG      THR  79   2.662 -11.378  -9.288
  599   1HG2  THR  79          1HG2      THR  79   4.661 -10.792  -8.745
  600   2HG2  THR  79          2HG2      THR  79   5.060 -11.242  -7.090
  601   3HG2  THR  79          3HG2      THR  79   4.422 -12.460  -8.199
  602    H    GLU  80           H        GLU  80   4.172 -13.227  -4.831
  603    HA   GLU  80           HA       GLU  80   4.514 -11.577  -2.566
  604   1HB   GLU  80          2HB       GLU  80   6.387 -12.995  -1.988
  605   2HB   GLU  80          3HB       GLU  80   4.958 -13.903  -2.484
  606   1HG   GLU  80          2HG       GLU  80   6.046 -14.161  -4.807
  607   2HG   GLU  80          3HG       GLU  80   7.514 -13.469  -4.095
  608    H    SER  81           H        SER  81   6.540 -11.759  -5.599
  609    HA   SER  81           HA       SER  81   8.486  -9.949  -5.000
  610   1HB   SER  81          2HB       SER  81   6.934 -10.177  -7.612
  611   2HB   SER  81          3HB       SER  81   8.558  -9.522  -7.414
  612    HG   SER  81           HG       SER  81   8.455 -11.763  -8.048
  613    H    GLU  82           H        GLU  82   5.394  -8.948  -6.578
  614    HA   GLU  82           HA       GLU  82   5.887  -6.237  -6.290
  615   1HB   GLU  82          2HB       GLU  82   3.331  -7.808  -6.729
  616   2HB   GLU  82          3HB       GLU  82   3.342  -6.049  -6.651
  617   1HG   GLU  82          2HG       GLU  82   3.463  -6.655  -8.978
  618   2HG   GLU  82          3HG       GLU  82   5.001  -5.937  -8.502
  619    H    THR  83           H        THR  83   4.020  -8.408  -4.117
  620    HA   THR  83           HA       THR  83   3.185  -6.439  -2.343
  621    HB   THR  83           HB       THR  83   3.826  -9.373  -2.115
  622    HG1  THR  83           1HG      THR  83   1.695  -7.955  -1.020
  623   1HG2  THR  83          1HG2      THR  83   3.410  -7.650   0.367
  624   2HG2  THR  83          2HG2      THR  83   3.193  -9.407   0.300
  625   3HG2  THR  83          3HG2      THR  83   4.795  -8.713   0.039
  626    H    LYS  84           H        LYS  84   6.242  -8.245  -2.620
  627    HA   LYS  84           HA       LYS  84   7.459  -7.153  -0.322
  628   1HB   LYS  84          2HB       LYS  84   8.010  -9.328  -1.042
  629   2HB   LYS  84          3HB       LYS  84   8.616  -8.761  -2.610
  630   1HG   LYS  84          2HG       LYS  84  10.520  -7.842  -1.727
  631   2HG   LYS  84          3HG       LYS  84   9.816  -7.628  -0.100
  632   1HD   LYS  84          2HD       LYS  84  10.006  -9.923   0.456
  633   2HD   LYS  84          3HD       LYS  84  10.236 -10.414  -1.225
  634   1HE   LYS  84          2HE       LYS  84  12.345 -10.533   0.090
  635   2HE   LYS  84          3HE       LYS  84  12.453  -9.473  -1.323
  636   1HZ   LYS  84          1HZ       LYS  84  12.047  -8.582   1.457
  637   2HZ   LYS  84          2HZ       LYS  84  13.450  -8.470   0.603
  638   3HZ   LYS  84          3HZ       LYS  84  12.139  -7.593   0.143
  639    H    SER  85           H        SER  85   7.480  -6.098  -3.754
  640    HA   SER  85           HA       SER  85   9.420  -4.095  -3.560
  641   1HB   SER  85          2HB       SER  85   6.724  -3.912  -4.980
  642   2HB   SER  85          3HB       SER  85   8.131  -2.888  -5.245
  643    HG   SER  85           HG       SER  85   8.069  -4.486  -6.762
  644    H    LEU  86           H        LEU  86   5.950  -3.978  -2.510
  645    HA   LEU  86           HA       LEU  86   6.196  -1.313  -1.400
  646   1HB   LEU  86          2HB       LEU  86   4.195  -3.539  -1.157
  647   2HB   LEU  86          3HB       LEU  86   4.232  -2.350   0.143
  648    HG   LEU  86           HG       LEU  86   4.076  -1.555  -2.764
  649   1HD1  LEU  86          1HD1      LEU  86   1.799  -2.009  -0.785
  650   2HD1  LEU  86          2HD1      LEU  86   1.622  -1.289  -2.398
  651   3HD1  LEU  86          3HD1      LEU  86   2.129  -2.980  -2.239
  652   1HD2  LEU  86          1HD2      LEU  86   4.736   0.290  -1.212
  653   2HD2  LEU  86          2HD2      LEU  86   3.095   0.547  -1.805
  654   3HD2  LEU  86          3HD2      LEU  86   3.354  -0.092  -0.172
  655    H    MET  87           H        MET  87   6.193  -4.554   0.174
  656    HA   MET  87           HA       MET  87   6.822  -3.760   2.696
  657   1HB   MET  87          2HB       MET  87   6.477  -6.150   1.851
  658   2HB   MET  87          3HB       MET  87   8.186  -6.125   1.386
  659   1HG   MET  87          2HG       MET  87   8.233  -5.328   4.081
  660   2HG   MET  87          3HG       MET  87   6.975  -6.552   4.004
  661   1HE   MET  87          1HE       MET  87  10.679  -5.612   3.707
  662   2HE   MET  87          2HE       MET  87  11.469  -7.105   3.165
  663   3HE   MET  87          3HE       MET  87  10.455  -6.176   2.032
  664    H    ALA  88           H        ALA  88   9.162  -4.128   0.078
  665    HA   ALA  88           HA       ALA  88  11.572  -4.036   1.472
  666   1HB   ALA  88          1HB       ALA  88  10.863  -3.110  -1.349
  667   2HB   ALA  88          2HB       ALA  88  12.521  -3.332  -0.744
  668   3HB   ALA  88          3HB       ALA  88  11.417  -4.716  -0.865
  669    H    ALA  89           H        ALA  89   9.661  -1.300   0.156
  670    HA   ALA  89           HA       ALA  89  11.641   0.654   1.208
  671   1HB   ALA  89          1HB       ALA  89   8.969   1.017  -0.159
  672   2HB   ALA  89          2HB       ALA  89  10.095   2.325   0.268
  673   3HB   ALA  89          3HB       ALA  89  10.581   1.116  -0.935
  674    H    ALA  90           H        ALA  90   8.277  -0.445   1.797
  675    HA   ALA  90           HA       ALA  90   7.563   1.489   3.736
  676   1HB   ALA  90          1HB       ALA  90   6.708  -1.427   3.523
  677   2HB   ALA  90          2HB       ALA  90   5.845  -0.135   4.383
  678   3HB   ALA  90          3HB       ALA  90   5.992  -0.076   2.605
  679    H    ASP  91           H        ASP  91   9.163  -1.722   4.135
  680    HA   ASP  91           HA       ASP  91   9.304  -1.387   6.984
  681   1HB   ASP  91          2HB       ASP  91   9.235  -3.638   5.981
  682   2HB   ASP  91          3HB       ASP  91  10.827  -3.358   5.251
  683    H    ASN  92           H        ASN  92  10.230   0.803   6.876
  684    HA   ASN  92           HA       ASN  92  12.977   1.155   5.970
  685   1HB   ASN  92          2HB       ASN  92  12.809   3.394   6.977
  686   2HB   ASN  92          3HB       ASN  92  11.489   3.000   5.880
  687   1HD2  ASN  92          1HD2      ASN  92  12.200   2.733   9.440
  688   2HD2  ASN  92          2HD2      ASN  92  10.600   3.291   9.921
  689    H    ASP  93           H        ASP  93  13.094  -1.061   7.507
  690    HA   ASP  93           HA       ASP  93  14.688  -0.263   9.915
  691   1HB   ASP  93          2HB       ASP  93  12.561  -2.441   9.731
  692   2HB   ASP  93          3HB       ASP  93  13.740  -2.311  11.035
  693    H    GLY  94           H        GLY  94  13.580  -3.058   7.933
  694   1HA   GLY  94          1HA       GLY  94  15.049  -4.598   6.813
  695   2HA   GLY  94          2HA       GLY  94  16.336  -4.232   7.974
  696    H    ASP  95           H        ASP  95  12.827  -4.849   8.394
  697    HA   ASP  95           HA       ASP  95  13.415  -7.404   9.783
  698   1HB   ASP  95          2HB       ASP  95  11.719  -7.074  11.446
  699   2HB   ASP  95          3HB       ASP  95  12.997  -5.865  11.589
  700    H    GLY  96           H        GLY  96  10.554  -5.509   8.606
  701   1HA   GLY  96          1HA       GLY  96   9.759  -6.321   6.336
  702   2HA   GLY  96          2HA       GLY  96   9.692  -7.938   7.052
  703    H    LYS  97           H        LYS  97   8.940  -6.394   9.688
  704    HA   LYS  97           HA       LYS  97   6.012  -6.612   9.314
  705   1HB   LYS  97          2HB       LYS  97   7.698  -6.094  11.797
  706   2HB   LYS  97          3HB       LYS  97   5.960  -6.422  11.734
  707   1HG   LYS  97          2HG       LYS  97   6.421  -8.706  10.850
  708   2HG   LYS  97          3HG       LYS  97   8.157  -8.356  10.861
  709   1HD   LYS  97          2HD       LYS  97   7.906  -9.523  12.844
  710   2HD   LYS  97          3HD       LYS  97   7.877  -7.832  13.381
  711   1HE   LYS  97          2HE       LYS  97   5.275  -8.011  13.218
  712   2HE   LYS  97          3HE       LYS  97   5.531  -9.744  12.949
  713   1HZ   LYS  97          1HZ       LYS  97   6.332  -8.260  15.349
  714   2HZ   LYS  97          2HZ       LYS  97   5.038  -9.267  15.193
  715   3HZ   LYS  97          3HZ       LYS  97   6.563  -9.877  15.086
  716    H    ILE  98           H        ILE  98   5.069  -4.747   8.600
  717    HA   ILE  98           HA       ILE  98   6.458  -2.136   8.990
  718    HB   ILE  98           HB       ILE  98   4.189  -3.114   7.251
  719   1HG1  ILE  98          2HG1      ILE  98   6.691  -1.998   6.063
  720   2HG1  ILE  98          3HG1      ILE  98   6.939  -3.485   6.959
  721   1HG2  ILE  98          1HG2      ILE  98   3.771  -0.744   7.726
  722   2HG2  ILE  98          2HG2      ILE  98   5.438  -0.344   7.239
  723   3HG2  ILE  98          3HG2      ILE  98   4.285  -0.984   6.055
  724   1HD1  ILE  98          1HD1      ILE  98   5.007  -3.098   4.667
  725   2HD1  ILE  98          2HD1      ILE  98   6.472  -4.106   4.754
  726   3HD1  ILE  98          3HD1      ILE  98   5.059  -4.559   5.701
  727    H    GLY  99           H        GLY  99   5.205  -0.340   9.904
  728   1HA   GLY  99          1HA       GLY  99   2.730  -1.076  11.405
  729   2HA   GLY  99          2HA       GLY  99   4.075  -0.250  12.222
  730    H    ALA 100           H        ALA 100   1.918   1.241  12.353
  731    HA   ALA 100           HA       ALA 100   1.203   2.659   9.959
  732   1HB   ALA 100          1HB       ALA 100  -0.181   2.438  12.116
  733   2HB   ALA 100          2HB       ALA 100   0.846   3.728  12.764
  734   3HB   ALA 100          3HB       ALA 100  -0.138   4.005  11.294
  735    H    GLU 101           H        GLU 101   3.601   3.240  12.533
  736    HA   GLU 101           HA       GLU 101   4.332   5.828  11.605
  737   1HB   GLU 101          2HB       GLU 101   5.763   3.735  13.281
  738   2HB   GLU 101          3HB       GLU 101   6.598   5.187  12.708
  739   1HG   GLU 101          2HG       GLU 101   4.869   6.634  13.704
  740   2HG   GLU 101          3HG       GLU 101   4.030   5.205  14.351
  741    H    GLU 102           H        GLU 102   5.939   2.638  10.962
  742    HA   GLU 102           HA       GLU 102   7.732   3.552   9.069
  743   1HB   GLU 102          2HB       GLU 102   6.285   0.887   8.912
  744   2HB   GLU 102          3HB       GLU 102   7.859   1.289   8.245
  745   1HG   GLU 102          2HG       GLU 102   8.789   1.571  10.503
  746   2HG   GLU 102          3HG       GLU 102   7.238   1.133  11.237
  747    H    PHE 103           H        PHE 103   4.354   2.463   8.525
  748    HA   PHE 103           HA       PHE 103   4.417   2.729   5.690
  749   1HB   PHE 103          2HB       PHE 103   2.742   1.428   7.007
  750   2HB   PHE 103          3HB       PHE 103   2.013   2.936   7.542
  751    HD1  PHE 103           1HD      PHE 103   2.857   0.891   4.514
  752    HD2  PHE 103           2HD      PHE 103   0.432   4.093   6.091
  753    HE1  PHE 103           1HE      PHE 103   1.456   0.840   2.472
  754    HE2  PHE 103           2HE      PHE 103  -1.007   3.990   4.074
  755    HZ   PHE 103           HZ       PHE 103  -0.495   2.365   2.259
  756    H    GLN 104           H        GLN 104   3.160   4.983   8.223
  757    HA   GLN 104           HA       GLN 104   2.409   7.124   6.474
  758   1HB   GLN 104          2HB       GLN 104   1.754   6.855   8.862
  759   2HB   GLN 104          3HB       GLN 104   3.423   7.252   9.334
  760   1HG   GLN 104          2HG       GLN 104   3.131   9.442   8.056
  761   2HG   GLN 104          3HG       GLN 104   1.426   9.015   7.849
  762   1HE2  GLN 104          1HE2      GLN 104   2.613  11.304   9.320
  763   2HE2  GLN 104          2HE2      GLN 104   2.070  11.150  10.979
  764    H    GLU 105           H        GLU 105   5.572   6.455   8.141
  765    HA   GLU 105           HA       GLU 105   6.962   8.736   7.272
  766   1HB   GLU 105          2HB       GLU 105   7.742   5.888   7.977
  767   2HB   GLU 105          3HB       GLU 105   8.946   6.919   7.217
  768   1HG   GLU 105          2HG       GLU 105   7.412   7.830   9.676
  769   2HG   GLU 105          3HG       GLU 105   8.949   6.945   9.745
  770    H    MET 106           H        MET 106   6.831   5.504   5.677
  771    HA   MET 106           HA       MET 106   8.286   6.319   3.384
  772   1HB   MET 106          2HB       MET 106   7.933   4.005   3.983
  773   2HB   MET 106          3HB       MET 106   6.183   4.130   3.741
  774   1HG   MET 106          2HG       MET 106   7.967   4.920   1.454
  775   2HG   MET 106          3HG       MET 106   7.879   3.206   1.861
  776   1HE   MET 106          1HE       MET 106   6.862   4.906  -0.960
  777   2HE   MET 106          2HE       MET 106   7.423   3.255  -0.614
  778   3HE   MET 106          3HE       MET 106   5.833   3.501  -1.371
  779    H    VAL 107           H        VAL 107   4.796   6.258   4.041
  780    HA   VAL 107           HA       VAL 107   4.103   7.331   1.506
  781    HB   VAL 107           HB       VAL 107   2.483   6.805   4.004
  782   1HG1  VAL 107          1HG1      VAL 107   0.516   6.841   2.443
  783   2HG1  VAL 107          2HG1      VAL 107   1.230   8.440   2.689
  784   3HG1  VAL 107          3HG1      VAL 107   1.578   7.521   1.208
  785   1HG2  VAL 107          1HG2      VAL 107   2.695   5.333   1.326
  786   2HG2  VAL 107          2HG2      VAL 107   3.474   4.784   2.816
  787   3HG2  VAL 107          3HG2      VAL 107   1.714   4.843   2.717
  788    H    HIS 108           H        HIS 108   5.362   8.919   4.255
  789    HA   HIS 108           HA       HIS 108   4.080  11.482   3.668
  790   1HB   HIS 108          2HB       HIS 108   4.521  10.915   5.955
  791   2HB   HIS 108          3HB       HIS 108   6.221  10.579   5.619
  792    HD1  HIS 108           1HD      HIS 108   4.501  13.835   4.490
  793    HD2  HIS 108           2HD      HIS 108   7.294  12.311   7.241
  794    HE1  HIS 108           1HE      HIS 108   5.556  15.851   5.658
  795    H    SER 109           H        SER 109   6.635   9.634   2.394
  796    HA   SER 109           HA       SER 109   8.612  11.632   1.952
  797   1HB   SER 109          2HB       SER 109   9.021   9.173   2.010
  798   2HB   SER 109          3HB       SER 109   8.142   9.024   0.473
  799    HG   SER 109           HG       SER 109   9.704  10.749  -0.214
  Start of MODEL    4
    1   1H    MET   1           H1       MET   1 -14.830   0.482   2.199
    2   2H    MET   1           H2       MET   1 -15.836   0.465   0.887
    3   3H    MET   1           H3       MET   1 -14.529   1.476   0.928
    4    HA   MET   1           HA       MET   1 -16.504   2.737   1.390
    5   1HB   MET   1          2HB       MET   1 -17.742   0.763   2.135
    6   2HB   MET   1          3HB       MET   1 -16.851   0.727   3.659
    7   1HG   MET   1          2HG       MET   1 -17.777   2.982   4.218
    8   2HG   MET   1          3HG       MET   1 -18.685   2.964   2.693
    9   1HE   MET   1          1HE       MET   1 -20.053   3.552   5.474
   10   2HE   MET   1          2HE       MET   1 -20.962   3.453   3.943
   11   3HE   MET   1          3HE       MET   1 -21.508   2.534   5.365
   12    H    SER   2           H        SER   2 -14.900   4.311   1.698
   13    HA   SER   2           HA       SER   2 -14.069   5.502   3.909
   14   1HB   SER   2          2HB       SER   2 -13.082   3.603   5.024
   15   2HB   SER   2          3HB       SER   2 -12.295   3.051   3.533
   16    HG   SER   2           HG       SER   2 -11.640   5.248   5.190
   17    H    ILE   3           H        ILE   3 -11.979   3.820   1.558
   18    HA   ILE   3           HA       ILE   3 -10.854   6.420   0.746
   19    HB   ILE   3           HB       ILE   3  -9.005   5.185  -0.041
   20   1HG1  ILE   3          2HG1      ILE   3  -9.314   2.505   0.381
   21   2HG1  ILE   3          3HG1      ILE   3 -10.911   2.868  -0.228
   22   1HG2  ILE   3          1HG2      ILE   3  -9.350   5.375   2.435
   23   2HG2  ILE   3          2HG2      ILE   3  -9.947   3.699   2.433
   24   3HG2  ILE   3          3HG2      ILE   3  -8.296   4.045   1.899
   25   1HD1  ILE   3          1HD1      ILE   3  -9.429   2.243  -2.072
   26   2HD1  ILE   3          2HD1      ILE   3  -9.788   3.965  -2.250
   27   3HD1  ILE   3          3HD1      ILE   3  -8.230   3.448  -1.572
   28    H    THR   4           H        THR   4 -12.979   3.965  -0.600
   29    HA   THR   4           HA       THR   4 -12.461   4.171  -3.257
   30    HB   THR   4           HB       THR   4 -13.515   2.300  -2.015
   31    HG1  THR   4           1HG      THR   4 -14.665   3.702  -4.015
   32   1HG2  THR   4          1HG2      THR   4 -14.970   3.651  -0.407
   33   2HG2  THR   4          2HG2      THR   4 -15.975   4.120  -1.788
   34   3HG2  THR   4          3HG2      THR   4 -15.869   2.421  -1.324
   35    H    ASP   5           H        ASP   5 -13.988   6.450  -1.126
   36    HA   ASP   5           HA       ASP   5 -15.090   7.942  -3.451
   37   1HB   ASP   5          2HB       ASP   5 -16.910   6.679  -2.264
   38   2HB   ASP   5          3HB       ASP   5 -16.493   7.545  -0.769
   39    H    VAL   6           H        VAL   6 -12.598   8.237  -2.393
   40    HA   VAL   6           HA       VAL   6 -12.722  10.926  -1.043
   41    HB   VAL   6           HB       VAL   6 -10.815   8.580  -0.744
   42   1HG1  VAL   6          1HG1      VAL   6  -9.324  10.511  -1.036
   43   2HG1  VAL   6          2HG1      VAL   6 -10.244  11.424   0.178
   44   3HG1  VAL   6          3HG1      VAL   6  -9.346   9.951   0.623
   45   1HG2  VAL   6          1HG2      VAL   6 -12.849   8.826   0.730
   46   2HG2  VAL   6          2HG2      VAL   6 -11.309   8.851   1.622
   47   3HG2  VAL   6          3HG2      VAL   6 -12.193  10.362   1.312
   48    H    LEU   7           H        LEU   7 -10.580   8.931  -3.046
   49    HA   LEU   7           HA       LEU   7 -10.341  10.769  -5.230
   50   1HB   LEU   7          2HB       LEU   7  -9.055  12.212  -3.839
   51   2HB   LEU   7          3HB       LEU   7  -8.305  10.869  -2.976
   52    HG   LEU   7           HG       LEU   7  -6.880  10.334  -4.859
   53   1HD1  LEU   7          1HD1      LEU   7  -8.308  11.069  -6.752
   54   2HD1  LEU   7          2HD1      LEU   7  -8.119  12.762  -6.235
   55   3HD1  LEU   7          3HD1      LEU   7  -6.712  11.830  -6.800
   56   1HD2  LEU   7          1HD2      LEU   7  -6.123  11.923  -3.154
   57   2HD2  LEU   7          2HD2      LEU   7  -5.440  12.289  -4.747
   58   3HD2  LEU   7          3HD2      LEU   7  -6.770  13.273  -4.106
   59    H    SER   8           H        SER   8  -8.382   8.658  -3.197
   60    HA   SER   8           HA       SER   8  -6.733   7.345  -4.656
   61   1HB   SER   8          2HB       SER   8  -7.627   5.277  -3.075
   62   2HB   SER   8          3HB       SER   8  -6.511   6.559  -2.634
   63    HG   SER   8           HG       SER   8  -9.346   6.561  -2.195
   64    H    ALA   9           H        ALA   9 -10.184   6.525  -4.900
   65    HA   ALA   9           HA       ALA   9  -9.958   3.978  -6.103
   66   1HB   ALA   9          1HB       ALA   9 -11.973   6.215  -6.622
   67   2HB   ALA   9          2HB       ALA   9 -12.225   4.493  -6.995
   68   3HB   ALA   9          3HB       ALA   9 -12.083   5.026  -5.308
   69    H    ASP  10           H        ASP  10  -9.695   7.244  -7.566
   70    HA   ASP  10           HA       ASP  10  -9.632   6.225 -10.304
   71   1HB   ASP  10          2HB       ASP  10 -10.265   8.570  -9.530
   72   2HB   ASP  10          3HB       ASP  10  -8.546   8.863  -9.228
   73    H    ASP  11           H        ASP  11  -7.315   7.171  -7.777
   74    HA   ASP  11           HA       ASP  11  -4.975   7.165  -9.310
   75   1HB   ASP  11          2HB       ASP  11  -5.229   6.621  -6.318
   76   2HB   ASP  11          3HB       ASP  11  -3.887   7.358  -7.185
   77    H    ILE  12           H        ILE  12  -6.402   4.645  -7.180
   78    HA   ILE  12           HA       ILE  12  -4.432   2.703  -7.601
   79    HB   ILE  12           HB       ILE  12  -5.999   1.126  -6.837
   80   1HG1  ILE  12          2HG1      ILE  12  -8.067   3.265  -6.906
   81   2HG1  ILE  12          3HG1      ILE  12  -8.062   1.773  -7.845
   82   1HG2  ILE  12          1HG2      ILE  12  -6.205   1.977  -4.554
   83   2HG2  ILE  12          2HG2      ILE  12  -4.681   2.491  -5.273
   84   3HG2  ILE  12          3HG2      ILE  12  -6.020   3.639  -5.131
   85   1HD1  ILE  12          1HD1      ILE  12  -9.612   1.465  -6.074
   86   2HD1  ILE  12          2HD1      ILE  12  -8.180   0.483  -5.707
   87   3HD1  ILE  12          3HD1      ILE  12  -8.457   2.039  -4.861
   88    H    ALA  13           H        ALA  13  -7.352   3.529  -9.493
   89    HA   ALA  13           HA       ALA  13  -7.281   1.237 -11.191
   90   1HB   ALA  13          1HB       ALA  13  -8.688   2.474 -12.700
   91   2HB   ALA  13          2HB       ALA  13  -9.207   2.805 -11.036
   92   3HB   ALA  13          3HB       ALA  13  -8.275   4.016 -11.943
   93    H    ALA  14           H        ALA  14  -5.701   4.469 -11.478
   94    HA   ALA  14           HA       ALA  14  -4.267   3.871 -13.889
   95   1HB   ALA  14          1HB       ALA  14  -3.409   5.677 -11.588
   96   2HB   ALA  14          2HB       ALA  14  -2.707   5.629 -13.214
   97   3HB   ALA  14          3HB       ALA  14  -4.395   6.151 -12.988
   98    H    ALA  15           H        ALA  15  -3.229   3.580 -10.452
   99    HA   ALA  15           HA       ALA  15  -0.727   2.563 -10.738
  100   1HB   ALA  15          1HB       ALA  15  -2.018   3.148  -8.593
  101   2HB   ALA  15          2HB       ALA  15  -2.630   1.488  -8.637
  102   3HB   ALA  15          3HB       ALA  15  -0.885   1.790  -8.536
  103    H    LEU  16           H        LEU  16  -3.761   0.758 -10.706
  104    HA   LEU  16           HA       LEU  16  -2.812  -1.834 -10.781
  105   1HB   LEU  16          2HB       LEU  16  -5.162  -1.064 -10.397
  106   2HB   LEU  16          3HB       LEU  16  -5.336  -0.735 -12.117
  107    HG   LEU  16           HG       LEU  16  -6.434  -2.771 -11.306
  108   1HD1  LEU  16          1HD1      LEU  16  -5.633  -2.561 -13.710
  109   2HD1  LEU  16          2HD1      LEU  16  -4.314  -3.671 -13.268
  110   3HD1  LEU  16          3HD1      LEU  16  -5.989  -4.190 -13.107
  111   1HD2  LEU  16          1HD2      LEU  16  -5.236  -4.750 -10.642
  112   2HD2  LEU  16          2HD2      LEU  16  -3.666  -3.967 -10.895
  113   3HD2  LEU  16          3HD2      LEU  16  -4.743  -3.400  -9.599
  114    H    GLN  17           H        GLN  17  -3.266   0.523 -13.433
  115    HA   GLN  17           HA       GLN  17  -2.807  -1.539 -15.464
  116   1HB   GLN  17          2HB       GLN  17  -4.270   0.751 -15.549
  117   2HB   GLN  17          3HB       GLN  17  -2.755   1.329 -16.263
  118   1HG   GLN  17          2HG       GLN  17  -2.832  -0.667 -17.829
  119   2HG   GLN  17          3HG       GLN  17  -4.393  -1.106 -17.113
  120   1HE2  GLN  17          1HE2      GLN  17  -6.012  -0.614 -18.571
  121   2HE2  GLN  17          2HE2      GLN  17  -6.051   0.863 -19.514
  122    H    GLU  18           H        GLU  18  -1.118   1.347 -14.133
  123    HA   GLU  18           HA       GLU  18   1.095   1.167 -15.871
  124   1HB   GLU  18          2HB       GLU  18   2.018   2.921 -14.686
  125   2HB   GLU  18          3HB       GLU  18   0.304   3.102 -14.327
  126   1HG   GLU  18          2HG       GLU  18   0.710   1.878 -12.169
  127   2HG   GLU  18          3HG       GLU  18   2.426   1.868 -12.538
  128    H    CYS  19           H        CYS  19   0.465  -0.480 -12.795
  129    HA   CYS  19           HA       CYS  19   3.024  -2.012 -13.031
  130   1HB   CYS  19          2HB       CYS  19   1.081  -1.700 -10.700
  131   2HB   CYS  19          3HB       CYS  19   2.595  -2.630 -10.697
  132    HG   CYS  19           HG       CYS  19   4.134  -0.657 -11.322
  133    H    ARG  20           H        ARG  20   0.823  -2.573 -14.894
  134    HA   ARG  20           HA       ARG  20  -0.537  -4.926 -13.820
  135   1HB   ARG  20          2HB       ARG  20  -1.555  -3.417 -15.460
  136   2HB   ARG  20          3HB       ARG  20  -0.388  -3.924 -16.692
  137   1HG   ARG  20          2HG       ARG  20  -1.283  -6.151 -16.725
  138   2HG   ARG  20          3HG       ARG  20  -2.118  -5.922 -15.177
  139   1HD   ARG  20          2HD       ARG  20  -3.607  -4.238 -16.171
  140   2HD   ARG  20          3HD       ARG  20  -2.875  -4.466 -17.754
  141    HE   ARG  20           HE       ARG  20  -4.784  -6.163 -16.314
  142   1HH1  ARG  20          2HH2      ARG  20  -2.338  -6.189 -18.845
  143   2HH1  ARG  20          1HH2      ARG  20  -2.988  -7.549 -19.706
  144   1HH2  ARG  20          2HH1      ARG  20  -5.648  -8.026 -17.368
  145   2HH2  ARG  20          1HH1      ARG  20  -4.913  -8.640 -18.812
  146    H    ASP  21           H        ASP  21   2.342  -4.189 -15.677
  147    HA   ASP  21           HA       ASP  21   2.910  -6.902 -16.475
  148   1HB   ASP  21          2HB       ASP  21   4.332  -4.222 -16.509
  149   2HB   ASP  21          3HB       ASP  21   5.218  -5.706 -16.875
  150    HA   PRO  22           HA       PRO  22   4.477  -8.408 -12.653
  151   1HB   PRO  22          2HB       PRO  22   6.294 -10.290 -13.409
  152   2HB   PRO  22          3HB       PRO  22   4.537 -10.481 -13.659
  153   1HG   PRO  22          2HG       PRO  22   6.589  -9.477 -15.650
  154   2HG   PRO  22          3HG       PRO  22   5.359 -10.752 -15.907
  155   1HD   PRO  22          2HD       PRO  22   4.932  -8.197 -16.717
  156   2HD   PRO  22          3HD       PRO  22   3.600  -9.138 -15.981
  157    H    ASP  23           H        ASP  23   6.010  -8.000 -11.116
  158    HA   ASP  23           HA       ASP  23   7.608  -6.988 -10.121
  159   1HB   ASP  23          2HB       ASP  23   9.318  -7.662 -12.553
  160   2HB   ASP  23          3HB       ASP  23   9.903  -7.327 -10.924
  161    H    THR  24           H        THR  24   6.125  -5.331 -12.441
  162    HA   THR  24           HA       THR  24   7.984  -3.101 -12.847
  163    HB   THR  24           HB       THR  24   5.112  -3.514 -13.734
  164    HG1  THR  24           1HG      THR  24   6.070  -4.331 -15.547
  165   1HG2  THR  24          1HG2      THR  24   5.879  -2.043 -15.671
  166   2HG2  THR  24          2HG2      THR  24   5.631  -1.188 -14.161
  167   3HG2  THR  24          3HG2      THR  24   7.286  -1.598 -14.684
  168    H    PHE  25           H        PHE  25   6.708  -3.877 -10.138
  169    HA   PHE  25           HA       PHE  25   5.200  -1.395  -9.481
  170   1HB   PHE  25          2HB       PHE  25   4.267  -3.711  -9.063
  171   2HB   PHE  25          3HB       PHE  25   5.534  -3.914  -7.856
  172    HD1  PHE  25           1HD      PHE  25   2.167  -3.186  -8.286
  173    HD2  PHE  25           2HD      PHE  25   5.614  -1.846  -6.051
  174    HE1  PHE  25           1HE      PHE  25   0.711  -2.570  -6.385
  175    HE2  PHE  25           2HE      PHE  25   4.132  -1.136  -4.216
  176    HZ   PHE  25           HZ       PHE  25   1.681  -1.576  -4.345
  177    H    GLU  26           H        GLU  26   6.633   0.134  -8.914
  178    HA   GLU  26           HA       GLU  26   8.834  -0.569  -7.040
  179   1HB   GLU  26          2HB       GLU  26   8.467   2.005  -8.618
  180   2HB   GLU  26          3HB       GLU  26   9.774   1.648  -7.505
  181   1HG   GLU  26          2HG       GLU  26  10.804   1.112  -9.471
  182   2HG   GLU  26          3HG       GLU  26  10.105  -0.478  -9.125
  183    HA   PRO  27           HA       PRO  27   6.346   0.943  -3.787
  184   1HB   PRO  27          2HB       PRO  27   8.216   2.167  -2.116
  185   2HB   PRO  27          3HB       PRO  27   7.928   0.416  -2.243
  186   1HG   PRO  27          2HG       PRO  27  10.132   2.002  -3.536
  187   2HG   PRO  27          3HG       PRO  27  10.188   0.356  -2.838
  188   1HD   PRO  27          2HD       PRO  27  10.046   0.748  -5.488
  189   2HD   PRO  27          3HD       PRO  27   9.242  -0.623  -4.682
  190    H    GLN  28           H        GLN  28   8.877   3.448  -4.342
  191    HA   GLN  28           HA       GLN  28   7.297   5.584  -3.496
  192   1HB   GLN  28          2HB       GLN  28   9.723   5.516  -5.309
  193   2HB   GLN  28          3HB       GLN  28   8.998   7.013  -4.690
  194   1HG   GLN  28          2HG       GLN  28   9.333   6.298  -2.374
  195   2HG   GLN  28          3HG       GLN  28   9.950   4.729  -2.897
  196   1HE2  GLN  28          1HE2      GLN  28  10.674   8.244  -2.873
  197   2HE2  GLN  28          2HE2      GLN  28  12.398   8.017  -3.094
  198    H    LYS  29           H        LYS  29   7.757   4.269  -6.737
  199    HA   LYS  29           HA       LYS  29   6.196   5.996  -8.330
  200   1HB   LYS  29          2HB       LYS  29   7.657   4.123  -9.076
  201   2HB   LYS  29          3HB       LYS  29   6.506   2.979  -8.400
  202   1HG   LYS  29          2HG       LYS  29   5.042   4.587 -10.276
  203   2HG   LYS  29          3HG       LYS  29   6.613   4.243 -10.999
  204   1HD   LYS  29          2HD       LYS  29   5.878   1.720 -10.012
  205   2HD   LYS  29          3HD       LYS  29   4.325   2.464 -10.379
  206   1HE   LYS  29          2HE       LYS  29   4.680   1.559 -12.429
  207   2HE   LYS  29          3HE       LYS  29   5.618   3.020 -12.703
  208   1HZ   LYS  29          1HZ       LYS  29   6.711   0.341 -11.883
  209   2HZ   LYS  29          2HZ       LYS  29   6.863   1.071 -13.336
  210   3HZ   LYS  29          3HZ       LYS  29   7.598   1.688 -12.007
  211    H    PHE  30           H        PHE  30   5.104   2.848  -6.904
  212    HA   PHE  30           HA       PHE  30   2.395   3.181  -7.450
  213   1HB   PHE  30          2HB       PHE  30   3.456   1.060  -6.817
  214   2HB   PHE  30          3HB       PHE  30   3.734   1.655  -5.184
  215    HD1  PHE  30           1HD      PHE  30   1.173   0.554  -7.628
  216    HD2  PHE  30           2HD      PHE  30   1.897   1.779  -3.553
  217    HE1  PHE  30           1HE      PHE  30  -1.150  -0.073  -7.017
  218    HE2  PHE  30           2HE      PHE  30  -0.443   1.213  -2.973
  219    HZ   PHE  30           HZ       PHE  30  -1.994   0.398  -4.745
  220    H    PHE  31           H        PHE  31   4.183   4.120  -4.587
  221    HA   PHE  31           HA       PHE  31   2.207   4.936  -2.774
  222   1HB   PHE  31          2HB       PHE  31   4.397   4.796  -1.944
  223   2HB   PHE  31          3HB       PHE  31   5.078   5.570  -3.360
  224    HD1  PHE  31           1HD      PHE  31   6.331   7.461  -2.759
  225    HD2  PHE  31           2HD      PHE  31   2.472   6.746  -0.984
  226    HE1  PHE  31           1HE      PHE  31   6.499   9.600  -1.515
  227    HE2  PHE  31           2HE      PHE  31   2.479   9.049  -0.114
  228    HZ   PHE  31           HZ       PHE  31   4.580  10.389  -0.159
  229    H    GLN  32           H        GLN  32   4.009   6.919  -5.200
  230    HA   GLN  32           HA       GLN  32   2.519   9.294  -4.593
  231   1HB   GLN  32          2HB       GLN  32   4.786   9.325  -5.561
  232   2HB   GLN  32          3HB       GLN  32   4.204   8.525  -7.020
  233   1HG   GLN  32          2HG       GLN  32   2.552  10.884  -6.557
  234   2HG   GLN  32          3HG       GLN  32   4.239  11.340  -6.355
  235   1HE2  GLN  32          1HE2      GLN  32   2.403   9.145  -8.638
  236   2HE2  GLN  32          2HE2      GLN  32   3.120   9.855 -10.061
  237    H    THR  33           H        THR  33   2.377   6.764  -7.196
  238    HA   THR  33           HA       THR  33   0.475   8.072  -8.697
  239    HB   THR  33           HB       THR  33   2.151   5.833  -8.936
  240    HG1  THR  33           1HG      THR  33   0.439   5.846 -10.711
  241   1HG2  THR  33          1HG2      THR  33   0.324   4.324  -7.892
  242   2HG2  THR  33          2HG2      THR  33  -0.658   4.784  -9.302
  243   3HG2  THR  33          3HG2      THR  33   0.885   3.933  -9.501
  244    H    SER  34           H        SER  34   0.086   5.782  -6.028
  245    HA   SER  34           HA       SER  34  -2.754   5.513  -6.433
  246   1HB   SER  34          2HB       SER  34  -1.009   4.803  -4.055
  247   2HB   SER  34          3HB       SER  34  -2.709   4.323  -4.294
  248    HG   SER  34           HG       SER  34  -0.391   3.621  -5.757
  249    H    GLY  35           H        GLY  35  -0.932   8.137  -5.525
  250   1HA   GLY  35          1HA       GLY  35  -1.787  10.247  -5.078
  251   2HA   GLY  35          2HA       GLY  35  -3.385   9.548  -4.759
  252    H    LEU  36           H        LEU  36  -0.886   7.948  -3.058
  253    HA   LEU  36           HA       LEU  36  -2.143   8.726  -0.574
  254   1HB   LEU  36          2HB       LEU  36   0.340   7.071  -1.040
  255   2HB   LEU  36          3HB       LEU  36  -0.726   7.109   0.372
  256    HG   LEU  36           HG       LEU  36  -1.468   6.046  -2.350
  257   1HD1  LEU  36          1HD1      LEU  36  -0.960   4.622   0.295
  258   2HD1  LEU  36          2HD1      LEU  36  -1.461   3.853  -1.226
  259   3HD1  LEU  36          3HD1      LEU  36   0.132   4.623  -1.106
  260   1HD2  LEU  36          1HD2      LEU  36  -3.067   6.087   0.237
  261   2HD2  LEU  36          2HD2      LEU  36  -3.461   6.966  -1.263
  262   3HD2  LEU  36          3HD2      LEU  36  -3.515   5.202  -1.236
  263    H    SER  37           H        SER  37   0.651   9.811  -2.421
  264    HA   SER  37           HA       SER  37   1.950  11.344  -0.323
  265   1HB   SER  37          2HB       SER  37   2.862  12.547  -2.350
  266   2HB   SER  37          3HB       SER  37   3.111  10.796  -2.411
  267    HG   SER  37           HG       SER  37   2.261  11.542  -4.379
  268    H    LYS  38           H        LYS  38  -1.034  11.670  -2.131
  269    HA   LYS  38           HA       LYS  38  -1.120  14.616  -1.848
  270   1HB   LYS  38          2HB       LYS  38  -2.191  12.696  -3.758
  271   2HB   LYS  38          3HB       LYS  38  -3.535  13.463  -2.917
  272   1HG   LYS  38          2HG       LYS  38  -3.061  14.725  -4.870
  273   2HG   LYS  38          3HG       LYS  38  -2.567  15.702  -3.477
  274   1HD   LYS  38          2HD       LYS  38  -0.191  15.033  -3.859
  275   2HD   LYS  38          3HD       LYS  38  -0.703  13.978  -5.189
  276   1HE   LYS  38          2HE       LYS  38  -1.564  15.945  -6.439
  277   2HE   LYS  38          3HE       LYS  38  -1.111  17.013  -5.099
  278   1HZ   LYS  38          1HZ       LYS  38   1.181  16.425  -5.483
  279   2HZ   LYS  38          2HZ       LYS  38   0.764  15.417  -6.718
  280   3HZ   LYS  38          3HZ       LYS  38   0.511  17.035  -6.853
  281    H    MET  39           H        MET  39  -2.499  11.549  -0.668
  282    HA   MET  39           HA       MET  39  -4.707  12.494   0.665
  283   1HB   MET  39          2HB       MET  39  -2.734  10.309   1.332
  284   2HB   MET  39          3HB       MET  39  -4.045  10.694   2.440
  285   1HG   MET  39          2HG       MET  39  -5.704  10.426   0.658
  286   2HG   MET  39          3HG       MET  39  -4.422   9.956  -0.468
  287   1HE   MET  39          1HE       MET  39  -7.185   8.329   0.369
  288   2HE   MET  39          2HE       MET  39  -6.044   8.027  -0.959
  289   3HE   MET  39          3HE       MET  39  -6.478   6.708   0.159
  290    H    SER  40           H        SER  40  -1.671  12.177   2.545
  291    HA   SER  40           HA       SER  40  -0.778  13.988   3.904
  292   1HB   SER  40          2HB       SER  40  -2.733  15.528   3.852
  293   2HB   SER  40          3HB       SER  40  -3.679  14.351   4.797
  294    HG   SER  40           HG       SER  40  -1.444  15.831   5.650
  295    H    ALA  41           H        ALA  41   0.041  13.279   5.876
  296    HA   ALA  41           HA       ALA  41  -0.036  10.757   6.869
  297   1HB   ALA  41          1HB       ALA  41   0.169  13.371   8.406
  298   2HB   ALA  41          2HB       ALA  41   0.538  11.776   9.085
  299   3HB   ALA  41          3HB       ALA  41   1.487  12.391   7.725
  300    H    ASN  42           H        ASN  42  -2.413  13.285   7.520
  301    HA   ASN  42           HA       ASN  42  -3.765  12.098   9.755
  302   1HB   ASN  42          2HB       ASN  42  -4.948  13.891   7.569
  303   2HB   ASN  42          3HB       ASN  42  -5.646  13.551   9.152
  304   1HD2  ASN  42          1HD2      ASN  42  -3.395  15.545   7.349
  305   2HD2  ASN  42          2HD2      ASN  42  -2.953  16.522   8.738
  306    H    GLN  43           H        GLN  43  -4.606  12.145   6.254
  307    HA   GLN  43           HA       GLN  43  -6.803  10.308   6.609
  308   1HB   GLN  43          2HB       GLN  43  -6.952  12.061   4.992
  309   2HB   GLN  43          3HB       GLN  43  -5.480  11.525   4.152
  310   1HG   GLN  43          2HG       GLN  43  -6.488   9.563   3.374
  311   2HG   GLN  43          3HG       GLN  43  -7.769   9.607   4.599
  312   1HE2  GLN  43          1HE2      GLN  43  -9.761  10.277   3.927
  313   2HE2  GLN  43          2HE2      GLN  43 -10.036  11.267   2.507
  314    H    VAL  44           H        VAL  44  -3.325  10.081   5.638
  315    HA   VAL  44           HA       VAL  44  -3.442   7.472   4.549
  316    HB   VAL  44           HB       VAL  44  -1.353   9.228   5.910
  317   1HG1  VAL  44          1HG1      VAL  44   0.383   7.830   4.933
  318   2HG1  VAL  44          2HG1      VAL  44  -0.548   6.987   6.180
  319   3HG1  VAL  44          3HG1      VAL  44  -0.858   6.646   4.442
  320   1HG2  VAL  44          1HG2      VAL  44  -0.562   9.695   3.690
  321   2HG2  VAL  44          2HG2      VAL  44  -1.611   8.442   2.976
  322   3HG2  VAL  44          3HG2      VAL  44  -2.309   9.916   3.641
  323    H    LYS  45           H        LYS  45  -2.777   8.656   7.924
  324    HA   LYS  45           HA       LYS  45  -2.613   6.077   9.105
  325   1HB   LYS  45          2HB       LYS  45  -2.025   8.234  10.233
  326   2HB   LYS  45          3HB       LYS  45  -3.739   8.677  10.262
  327   1HG   LYS  45          2HG       LYS  45  -4.201   6.651  11.682
  328   2HG   LYS  45          3HG       LYS  45  -2.461   6.299  11.682
  329   1HD   LYS  45          2HD       LYS  45  -2.044   8.543  12.708
  330   2HD   LYS  45          3HD       LYS  45  -3.794   8.855  12.702
  331   1HE   LYS  45          2HE       LYS  45  -4.146   6.873  14.189
  332   2HE   LYS  45          3HE       LYS  45  -2.399   6.575  14.202
  333   1HZ   LYS  45          1HZ       LYS  45  -3.103   7.758  16.148
  334   2HZ   LYS  45          2HZ       LYS  45  -2.108   8.714  15.260
  335   3HZ   LYS  45          3HZ       LYS  45  -3.732   8.985  15.255
  336    H    ASP  46           H        ASP  46  -5.512   8.159   8.484
  337    HA   ASP  46           HA       ASP  46  -7.355   6.402   9.680
  338   1HB   ASP  46          2HB       ASP  46  -7.900   8.709   8.938
  339   2HB   ASP  46          3HB       ASP  46  -7.857   8.168   7.252
  340    H    VAL  47           H        VAL  47  -6.407   6.535   6.185
  341    HA   VAL  47           HA       VAL  47  -7.912   4.325   5.410
  342    HB   VAL  47           HB       VAL  47  -6.788   4.125   3.464
  343   1HG1  VAL  47          1HG1      VAL  47  -6.959   6.177   2.476
  344   2HG1  VAL  47          2HG1      VAL  47  -7.849   6.460   3.986
  345   3HG1  VAL  47          3HG1      VAL  47  -6.171   7.025   3.795
  346   1HG2  VAL  47          1HG2      VAL  47  -4.517   3.732   4.011
  347   2HG2  VAL  47          2HG2      VAL  47  -4.681   4.936   2.733
  348   3HG2  VAL  47          3HG2      VAL  47  -4.281   5.456   4.364
  349    H    PHE  48           H        PHE  48  -4.564   4.343   6.761
  350    HA   PHE  48           HA       PHE  48  -4.058   1.605   6.567
  351   1HB   PHE  48          2HB       PHE  48  -3.378   3.350   8.932
  352   2HB   PHE  48          3HB       PHE  48  -2.671   1.788   8.542
  353    HD1  PHE  48           1HD      PHE  48  -2.737   2.855   5.327
  354    HD2  PHE  48           2HD      PHE  48  -0.962   4.036   9.086
  355    HE1  PHE  48           1HE      PHE  48  -0.876   3.910   4.121
  356    HE2  PHE  48           2HE      PHE  48   0.907   5.059   7.864
  357    HZ   PHE  48           HZ       PHE  48   1.015   4.918   5.373
  358    H    ARG  49           H        ARG  49  -6.268   3.193   8.920
  359    HA   ARG  49           HA       ARG  49  -6.526   0.863  10.571
  360   1HB   ARG  49          2HB       ARG  49  -8.677   2.965  10.045
  361   2HB   ARG  49          3HB       ARG  49  -8.556   1.872  11.428
  362   1HG   ARG  49          2HG       ARG  49  -6.342   3.038  12.016
  363   2HG   ARG  49          3HG       ARG  49  -6.716   4.191  10.727
  364   1HD   ARG  49          2HD       ARG  49  -7.473   5.205  12.724
  365   2HD   ARG  49          3HD       ARG  49  -8.902   4.683  11.807
  366    HE   ARG  49           HE       ARG  49  -8.001   2.652  13.672
  367   1HH1  ARG  49          2HH2      ARG  49  -9.829   5.651  13.489
  368   2HH1  ARG  49          1HH2      ARG  49 -10.689   5.425  14.982
  369   1HH2  ARG  49          2HH1      ARG  49  -9.110   2.296  15.669
  370   2HH2  ARG  49          1HH1      ARG  49 -10.263   3.449  16.252
  371    H    PHE  50           H        PHE  50  -7.881   1.686   7.449
  372    HA   PHE  50           HA       PHE  50 -10.038  -0.245   7.526
  373   1HB   PHE  50          2HB       PHE  50  -9.844   1.891   6.109
  374   2HB   PHE  50          3HB       PHE  50  -8.752   0.991   5.072
  375    HD1  PHE  50           1HD      PHE  50  -9.706  -0.201   3.236
  376    HD2  PHE  50           2HD      PHE  50 -12.191   0.891   6.584
  377    HE1  PHE  50           1HE      PHE  50 -11.675  -1.197   2.101
  378    HE2  PHE  50           2HE      PHE  50 -14.155  -0.094   5.450
  379    HZ   PHE  50           HZ       PHE  50 -13.864  -1.292   3.281
  380    H    ILE  51           H        ILE  51  -6.561  -0.419   6.950
  381    HA   ILE  51           HA       ILE  51  -6.860  -3.213   5.968
  382    HB   ILE  51           HB       ILE  51  -4.721  -1.313   5.013
  383   1HG1  ILE  51          2HG1      ILE  51  -6.116  -1.973   2.748
  384   2HG1  ILE  51          3HG1      ILE  51  -7.438  -1.955   3.915
  385   1HG2  ILE  51          1HG2      ILE  51  -4.431  -3.217   3.384
  386   2HG2  ILE  51          2HG2      ILE  51  -4.049  -3.689   5.043
  387   3HG2  ILE  51          3HG2      ILE  51  -5.589  -4.171   4.300
  388   1HD1  ILE  51          1HD1      ILE  51  -7.321   0.228   3.047
  389   2HD1  ILE  51          2HD1      ILE  51  -6.493   0.358   4.602
  390   3HD1  ILE  51          3HD1      ILE  51  -5.539   0.273   3.114
  391    H    ASP  52           H        ASP  52  -6.501  -4.196   7.806
  392    HA   ASP  52           HA       ASP  52  -3.729  -4.636   8.477
  393   1HB   ASP  52          2HB       ASP  52  -4.296  -2.809  10.070
  394   2HB   ASP  52          3HB       ASP  52  -5.645  -3.755  10.693
  395    H    ASN  53           H        ASN  53  -7.058  -5.053   9.525
  396    HA   ASN  53           HA       ASN  53  -8.512  -6.828   9.121
  397   1HB   ASN  53          2HB       ASN  53  -6.871  -8.180   7.752
  398   2HB   ASN  53          3HB       ASN  53  -6.212  -8.815   9.273
  399   1HD2  ASN  53          1HD2      ASN  53  -9.051  -8.807   7.124
  400   2HD2  ASN  53          2HD2      ASN  53  -9.849 -10.130   7.953
  401    H    ASP  54           H        ASP  54  -5.665  -7.460  11.213
  402    HA   ASP  54           HA       ASP  54  -7.029  -8.200  13.577
  403   1HB   ASP  54          2HB       ASP  54  -4.585  -6.380  13.419
  404   2HB   ASP  54          3HB       ASP  54  -5.085  -7.398  14.778
  405    H    GLN  55           H        GLN  55  -6.154  -5.104  12.259
  406    HA   GLN  55           HA       GLN  55  -6.283  -2.971  12.888
  407   1HB   GLN  55          2HB       GLN  55  -8.719  -3.660  14.587
  408   2HB   GLN  55          3HB       GLN  55  -8.060  -2.050  14.280
  409   1HG   GLN  55          2HG       GLN  55  -8.292  -2.613  11.760
  410   2HG   GLN  55          3HG       GLN  55  -9.328  -3.952  12.283
  411   1HE2  GLN  55          1HE2      GLN  55  -9.578  -0.970  10.986
  412   2HE2  GLN  55          2HE2      GLN  55 -11.031  -0.415  11.808
  413    H    SER  56           H        SER  56  -4.301  -3.956  13.612
  414    HA   SER  56           HA       SER  56  -3.849  -3.965  16.555
  415   1HB   SER  56          2HB       SER  56  -1.811  -5.186  16.037
  416   2HB   SER  56          3HB       SER  56  -3.197  -6.026  15.342
  417    HG   SER  56           HG       SER  56  -2.591  -4.781  13.327
  418    H    GLY  57           H        GLY  57  -2.720  -2.702  13.408
  419   1HA   GLY  57          1HA       GLY  57  -1.775  -0.436  13.217
  420   2HA   GLY  57          2HA       GLY  57  -0.997  -0.651  14.789
  421    H    TYR  58           H        TYR  58  -0.729  -3.676  13.611
  422    HA   TYR  58           HA       TYR  58   1.901  -3.229  12.252
  423   1HB   TYR  58          2HB       TYR  58   0.753  -5.606  13.739
  424   2HB   TYR  58          3HB       TYR  58   2.254  -5.608  12.824
  425    HD1  TYR  58           HD1      TYR  58   0.762  -4.846  16.029
  426    HD2  TYR  58           HD2      TYR  58   4.098  -3.927  13.456
  427    HE1  TYR  58           HE1      TYR  58   2.019  -3.946  17.971
  428    HE2  TYR  58           HE2      TYR  58   5.340  -3.013  15.389
  429    HH   TYR  58           HH       TYR  58   5.306  -2.581  17.654
  430    H    LEU  59           H        LEU  59   1.827  -3.268  10.193
  431    HA   LEU  59           HA       LEU  59  -0.073  -4.943   8.651
  432   1HB   LEU  59          2HB       LEU  59   1.728  -2.594   8.052
  433   2HB   LEU  59          3HB       LEU  59   1.374  -3.744   6.768
  434    HG   LEU  59           HG       LEU  59  -0.119  -1.742   6.852
  435   1HD1  LEU  59          1HD1      LEU  59  -0.688  -3.859   5.670
  436   2HD1  LEU  59          2HD1      LEU  59  -1.568  -4.416   7.107
  437   3HD1  LEU  59          3HD1      LEU  59  -2.100  -2.967   6.239
  438   1HD2  LEU  59          1HD2      LEU  59  -1.910  -1.573   8.454
  439   2HD2  LEU  59          2HD2      LEU  59  -1.448  -3.084   9.249
  440   3HD2  LEU  59          3HD2      LEU  59  -0.391  -1.655   9.356
  441    H    ASP  60           H        ASP  60   0.772  -6.773   9.604
  442    HA   ASP  60           HA       ASP  60   3.473  -7.670   9.325
  443   1HB   ASP  60          2HB       ASP  60   0.977  -9.403   9.376
  444   2HB   ASP  60          3HB       ASP  60   2.614  -9.813   9.924
  445    H    GLU  61           H        GLU  61   4.467  -8.885   7.621
  446    HA   GLU  61           HA       GLU  61   4.226  -8.102   5.169
  447   1HB   GLU  61          2HB       GLU  61   5.745 -10.072   6.432
  448   2HB   GLU  61          3HB       GLU  61   4.867 -11.015   5.225
  449   1HG   GLU  61          2HG       GLU  61   5.573  -9.079   3.617
  450   2HG   GLU  61          3HG       GLU  61   6.788  -8.713   4.850
  451    H    GLU  62           H        GLU  62   2.477 -11.073   6.205
  452    HA   GLU  62           HA       GLU  62   1.475 -11.493   3.544
  453   1HB   GLU  62          2HB       GLU  62   1.888 -13.243   5.425
  454   2HB   GLU  62          3HB       GLU  62   0.321 -12.749   6.095
  455   1HG   GLU  62          2HG       GLU  62  -0.772 -13.358   3.968
  456   2HG   GLU  62          3HG       GLU  62   0.828 -13.657   3.250
  457    H    GLU  63           H        GLU  63   0.310  -9.432   6.128
  458    HA   GLU  63           HA       GLU  63  -2.409  -9.223   5.053
  459   1HB   GLU  63          2HB       GLU  63  -0.754  -7.357   6.788
  460   2HB   GLU  63          3HB       GLU  63  -2.463  -7.141   6.409
  461   1HG   GLU  63          2HG       GLU  63  -3.121  -9.123   7.549
  462   2HG   GLU  63          3HG       GLU  63  -1.468  -9.742   7.670
  463    H    LEU  64           H        LEU  64   0.793  -7.731   4.598
  464    HA   LEU  64           HA       LEU  64   0.080  -5.724   2.788
  465   1HB   LEU  64          2HB       LEU  64   2.461  -6.622   3.813
  466   2HB   LEU  64          3HB       LEU  64   2.593  -7.142   2.134
  467    HG   LEU  64           HG       LEU  64   3.617  -5.036   2.319
  468   1HD1  LEU  64          1HD1      LEU  64   2.093  -5.278   0.318
  469   2HD1  LEU  64          2HD1      LEU  64   0.880  -4.320   1.184
  470   3HD1  LEU  64          3HD1      LEU  64   2.455  -3.618   0.803
  471   1HD2  LEU  64          1HD2      LEU  64   1.132  -3.921   3.688
  472   2HD2  LEU  64          2HD2      LEU  64   2.664  -4.343   4.480
  473   3HD2  LEU  64          3HD2      LEU  64   2.613  -3.035   3.287
  474    H    LYS  65           H        LYS  65   0.852  -9.165   2.222
  475    HA   LYS  65           HA       LYS  65   0.427  -9.335  -0.532
  476   1HB   LYS  65          2HB       LYS  65   1.336 -11.078   1.055
  477   2HB   LYS  65          3HB       LYS  65  -0.347 -11.492   1.426
  478   1HG   LYS  65          2HG       LYS  65  -0.737 -12.131  -0.937
  479   2HG   LYS  65          3HG       LYS  65   0.891 -11.577  -1.344
  480   1HD   LYS  65          2HD       LYS  65   1.029 -13.940  -1.173
  481   2HD   LYS  65          3HD       LYS  65   1.806 -13.277   0.273
  482   1HE   LYS  65          2HE       LYS  65  -0.516 -13.650   1.440
  483   2HE   LYS  65          3HE       LYS  65  -0.951 -14.601   0.030
  484   1HZ   LYS  65          1HZ       LYS  65   0.781 -16.141   0.578
  485   2HZ   LYS  65          2HZ       LYS  65   1.420 -15.124   1.710
  486   3HZ   LYS  65          3HZ       LYS  65   0.009 -15.803   2.007
  487    H    PHE  66           H        PHE  66  -2.086  -8.585   1.769
  488    HA   PHE  66           HA       PHE  66  -4.095  -9.009  -0.420
  489   1HB   PHE  66          2HB       PHE  66  -4.563  -9.271   2.557
  490   2HB   PHE  66          3HB       PHE  66  -5.781  -9.410   1.296
  491    HD1  PHE  66           1HD      PHE  66  -5.437 -11.276  -0.522
  492    HD2  PHE  66           2HD      PHE  66  -3.401 -11.231   3.281
  493    HE1  PHE  66           1HE      PHE  66  -5.041 -13.709  -0.703
  494    HE2  PHE  66           2HE      PHE  66  -2.995 -13.663   3.088
  495    HZ   PHE  66           HZ       PHE  66  -3.824 -14.915   1.104
  496    H    PHE  67           H        PHE  67  -2.309  -6.672   0.827
  497    HA   PHE  67           HA       PHE  67  -3.818  -4.920   2.225
  498   1HB   PHE  67          2HB       PHE  67  -1.492  -4.626   1.923
  499   2HB   PHE  67          3HB       PHE  67  -1.616  -4.442   0.189
  500    HD1  PHE  67           1HD      PHE  67  -1.577  -2.276  -0.726
  501    HD2  PHE  67           2HD      PHE  67  -2.214  -2.781   3.479
  502    HE1  PHE  67           1HE      PHE  67  -1.787   0.183  -0.467
  503    HE2  PHE  67           2HE      PHE  67  -2.556  -0.342   3.738
  504    HZ   PHE  67           HZ       PHE  67  -2.361   1.155   1.749
  505    H    LEU  68           H        LEU  68  -3.335  -4.515  -1.287
  506    HA   LEU  68           HA       LEU  68  -5.334  -2.556  -1.616
  507   1HB   LEU  68          2HB       LEU  68  -4.217  -4.498  -3.653
  508   2HB   LEU  68          3HB       LEU  68  -5.031  -2.953  -4.017
  509    HG   LEU  68           HG       LEU  68  -2.360  -3.295  -2.611
  510   1HD1  LEU  68          1HD1      LEU  68  -2.278  -3.899  -5.007
  511   2HD1  LEU  68          2HD1      LEU  68  -2.994  -2.328  -5.427
  512   3HD1  LEU  68          3HD1      LEU  68  -1.386  -2.410  -4.672
  513   1HD2  LEU  68          1HD2      LEU  68  -3.685  -0.759  -3.627
  514   2HD2  LEU  68          2HD2      LEU  68  -3.596  -1.232  -1.913
  515   3HD2  LEU  68          3HD2      LEU  68  -2.113  -0.900  -2.806
  516    H    GLN  69           H        GLN  69  -5.957  -5.918  -1.040
  517    HA   GLN  69           HA       GLN  69  -8.152  -6.263  -2.895
  518   1HB   GLN  69          2HB       GLN  69  -7.765  -7.580  -0.200
  519   2HB   GLN  69          3HB       GLN  69  -8.819  -8.124  -1.506
  520   1HG   GLN  69          2HG       GLN  69  -5.780  -7.952  -1.735
  521   2HG   GLN  69          3HG       GLN  69  -6.696  -9.400  -1.295
  522   1HE2  GLN  69          1HE2      GLN  69  -6.120  -7.045  -3.894
  523   2HE2  GLN  69          2HE2      GLN  69  -6.424  -8.201  -5.184
  524    H    LYS  70           H        LYS  70  -7.800  -4.672   0.247
  525    HA   LYS  70           HA       LYS  70 -10.603  -4.320   0.804
  526   1HB   LYS  70          2HB       LYS  70  -8.018  -3.184   1.765
  527   2HB   LYS  70          3HB       LYS  70  -9.339  -2.032   1.756
  528   1HG   LYS  70          2HG       LYS  70  -9.399  -2.986   3.872
  529   2HG   LYS  70          3HG       LYS  70 -10.771  -3.670   3.014
  530   1HD   LYS  70          2HD       LYS  70  -9.486  -5.739   2.545
  531   2HD   LYS  70          3HD       LYS  70  -8.059  -5.073   3.342
  532   1HE   LYS  70          2HE       LYS  70 -10.777  -5.557   4.682
  533   2HE   LYS  70          3HE       LYS  70  -9.397  -6.662   4.773
  534   1HZ   LYS  70          1HZ       LYS  70  -9.562  -5.224   6.700
  535   2HZ   LYS  70          2HZ       LYS  70  -8.154  -4.983   5.886
  536   3HZ   LYS  70          3HZ       LYS  70  -9.355  -3.873   5.797
  537    H    PHE  71           H        PHE  71  -8.432  -2.787  -1.502
  538    HA   PHE  71           HA       PHE  71 -10.266  -0.515  -1.958
  539   1HB   PHE  71          2HB       PHE  71  -7.745  -1.259  -3.469
  540   2HB   PHE  71          3HB       PHE  71  -8.628   0.261  -3.464
  541    HD1  PHE  71           1HD      PHE  71  -8.854   0.173  -0.212
  542    HD2  PHE  71           2HD      PHE  71  -5.728   0.074  -3.170
  543    HE1  PHE  71           1HE      PHE  71  -7.377   1.490   1.276
  544    HE2  PHE  71           2HE      PHE  71  -4.206   1.252  -1.603
  545    HZ   PHE  71           HZ       PHE  71  -5.029   1.940   0.639
  546    H    GLU  72           H        GLU  72  -8.847  -3.307  -3.746
  547    HA   GLU  72           HA       GLU  72 -11.237  -3.427  -5.465
  548   1HB   GLU  72          2HB       GLU  72  -9.207  -1.930  -6.377
  549   2HB   GLU  72          3HB       GLU  72  -8.554  -3.506  -6.843
  550   1HG   GLU  72          2HG       GLU  72 -11.334  -2.480  -7.605
  551   2HG   GLU  72          3HG       GLU  72  -9.889  -2.302  -8.604
  552    H    SER  73           H        SER  73 -11.761  -5.440  -5.801
  553    HA   SER  73           HA       SER  73 -10.789  -7.717  -4.405
  554   1HB   SER  73          2HB       SER  73 -12.341  -8.906  -5.934
  555   2HB   SER  73          3HB       SER  73 -13.088  -7.468  -5.220
  556    HG   SER  73           HG       SER  73 -12.197  -6.483  -7.400
  557    H    GLY  74           H        GLY  74 -10.104  -6.343  -7.533
  558   1HA   GLY  74          1HA       GLY  74  -8.445  -8.669  -8.424
  559   2HA   GLY  74          2HA       GLY  74  -9.206  -7.443  -9.447
  560    H    ALA  75           H        ALA  75  -7.553  -6.399  -6.508
  561    HA   ALA  75           HA       ALA  75  -5.610  -4.911  -8.025
  562   1HB   ALA  75          1HB       ALA  75  -6.540  -4.245  -5.801
  563   2HB   ALA  75          2HB       ALA  75  -5.567  -5.539  -5.073
  564   3HB   ALA  75          3HB       ALA  75  -4.779  -4.182  -5.927
  565    H    ARG  76           H        ARG  76  -3.203  -5.271  -6.563
  566    HA   ARG  76           HA       ARG  76  -2.331  -7.562  -8.185
  567   1HB   ARG  76          2HB       ARG  76  -1.871  -5.255  -8.933
  568   2HB   ARG  76          3HB       ARG  76  -0.915  -4.962  -7.471
  569   1HG   ARG  76          2HG       ARG  76   0.403  -5.494  -9.538
  570   2HG   ARG  76          3HG       ARG  76   0.774  -6.540  -8.165
  571   1HD   ARG  76          2HD       ARG  76  -0.546  -8.377  -9.127
  572   2HD   ARG  76          3HD       ARG  76  -1.268  -7.288 -10.315
  573    HE   ARG  76           HE       ARG  76   1.636  -8.100 -10.112
  574   1HH1  ARG  76          2HH2      ARG  76  -1.127  -7.354 -12.250
  575   2HH1  ARG  76          1HH2      ARG  76  -0.119  -7.532 -13.672
  576   1HH2  ARG  76          2HH1      ARG  76   2.725  -8.435 -11.831
  577   2HH2  ARG  76          1HH1      ARG  76   2.100  -8.234 -13.489
  578    H    GLU  77           H        GLU  77  -2.323  -6.806  -4.867
  579    HA   GLU  77           HA       GLU  77   0.253  -7.552  -4.064
  580   1HB   GLU  77          2HB       GLU  77  -2.400  -7.989  -2.644
  581   2HB   GLU  77          3HB       GLU  77  -0.803  -7.983  -1.894
  582   1HG   GLU  77          2HG       GLU  77  -1.897  -5.537  -3.325
  583   2HG   GLU  77          3HG       GLU  77  -2.139  -5.923  -1.621
  584    H    LEU  78           H        LEU  78  -1.886  -9.606  -5.638
  585    HA   LEU  78           HA       LEU  78  -1.395 -12.112  -4.382
  586   1HB   LEU  78          2HB       LEU  78  -1.801 -11.605  -7.356
  587   2HB   LEU  78          3HB       LEU  78  -2.028 -13.102  -6.462
  588    HG   LEU  78           HG       LEU  78  -4.170 -12.444  -6.793
  589   1HD1  LEU  78          1HD1      LEU  78  -3.651 -11.074  -4.118
  590   2HD1  LEU  78          2HD1      LEU  78  -5.186 -11.719  -4.713
  591   3HD1  LEU  78          3HD1      LEU  78  -3.844 -12.825  -4.360
  592   1HD2  LEU  78          1HD2      LEU  78  -5.118 -10.296  -6.843
  593   2HD2  LEU  78          2HD2      LEU  78  -3.720  -9.531  -6.096
  594   3HD2  LEU  78          3HD2      LEU  78  -3.600 -10.190  -7.745
  595    H    THR  79           H        THR  79   0.555 -10.121  -6.734
  596    HA   THR  79           HA       THR  79   2.443 -12.349  -7.008
  597    HB   THR  79           HB       THR  79   3.140  -9.504  -7.670
  598    HG1  THR  79           1HG      THR  79   2.547  -9.886  -9.681
  599   1HG2  THR  79          1HG2      THR  79   4.548 -10.721  -9.397
  600   2HG2  THR  79          2HG2      THR  79   4.985 -11.113  -7.738
  601   3HG2  THR  79          3HG2      THR  79   4.017 -12.250  -8.694
  602    H    GLU  80           H        GLU  80   4.126 -12.723  -5.768
  603    HA   GLU  80           HA       GLU  80   4.457 -11.293  -3.280
  604   1HB   GLU  80          2HB       GLU  80   6.340 -12.756  -2.832
  605   2HB   GLU  80          3HB       GLU  80   4.846 -13.602  -3.233
  606   1HG   GLU  80          2HG       GLU  80   5.713 -14.057  -5.535
  607   2HG   GLU  80          3HG       GLU  80   7.226 -13.226  -5.109
  608    H    SER  81           H        SER  81   6.462 -11.379  -6.316
  609    HA   SER  81           HA       SER  81   8.359  -9.492  -5.622
  610   1HB   SER  81          2HB       SER  81   6.910  -9.743  -8.297
  611   2HB   SER  81          3HB       SER  81   8.354  -8.782  -7.990
  612    HG   SER  81           HG       SER  81   9.030 -10.640  -8.743
  613    H    GLU  82           H        GLU  82   5.280  -8.526  -7.337
  614    HA   GLU  82           HA       GLU  82   5.618  -5.869  -6.937
  615   1HB   GLU  82          2HB       GLU  82   2.973  -7.385  -7.103
  616   2HB   GLU  82          3HB       GLU  82   3.137  -5.640  -7.129
  617   1HG   GLU  82          2HG       GLU  82   2.988  -6.136  -9.396
  618   2HG   GLU  82          3HG       GLU  82   4.714  -5.885  -9.138
  619    H    THR  83           H        THR  83   4.073  -8.114  -4.551
  620    HA   THR  83           HA       THR  83   3.406  -6.086  -2.719
  621    HB   THR  83           HB       THR  83   4.182  -9.020  -2.362
  622    HG1  THR  83           1HG      THR  83   1.809  -7.544  -1.939
  623   1HG2  THR  83          1HG2      THR  83   4.876  -8.061  -0.231
  624   2HG2  THR  83          2HG2      THR  83   3.399  -7.074  -0.163
  625   3HG2  THR  83          3HG2      THR  83   3.305  -8.839  -0.015
  626    H    LYS  84           H        LYS  84   6.334  -8.030  -3.115
  627    HA   LYS  84           HA       LYS  84   7.722  -7.232  -0.841
  628   1HB   LYS  84          2HB       LYS  84   8.147  -9.258  -2.112
  629   2HB   LYS  84          3HB       LYS  84   8.776  -8.321  -3.473
  630   1HG   LYS  84          2HG       LYS  84  10.799  -8.302  -2.569
  631   2HG   LYS  84          3HG       LYS  84  10.197  -7.512  -1.097
  632   1HD   LYS  84          2HD       LYS  84   9.535  -9.665  -0.143
  633   2HD   LYS  84          3HD       LYS  84  10.076 -10.513  -1.612
  634   1HE   LYS  84          2HE       LYS  84  12.395  -9.816  -1.223
  635   2HE   LYS  84          3HE       LYS  84  11.909  -8.822   0.162
  636   1HZ   LYS  84          1HZ       LYS  84  12.799 -10.938   0.846
  637   2HZ   LYS  84          2HZ       LYS  84  11.221 -10.811   1.296
  638   3HZ   LYS  84          3HZ       LYS  84  11.636 -11.751   0.011
  639    H    SER  85           H        SER  85   7.801  -5.866  -4.184
  640    HA   SER  85           HA       SER  85   9.730  -3.885  -3.839
  641   1HB   SER  85          2HB       SER  85   7.034  -3.705  -5.252
  642   2HB   SER  85          3HB       SER  85   8.405  -2.600  -5.460
  643    HG   SER  85           HG       SER  85   8.476  -4.121  -7.047
  644    H    LEU  86           H        LEU  86   6.277  -3.826  -2.770
  645    HA   LEU  86           HA       LEU  86   6.456  -1.102  -1.770
  646   1HB   LEU  86          2HB       LEU  86   4.362  -2.707  -2.417
  647   2HB   LEU  86          3HB       LEU  86   4.399  -3.003  -0.686
  648    HG   LEU  86           HG       LEU  86   4.190  -0.285  -2.074
  649   1HD1  LEU  86          1HD1      LEU  86   2.133  -1.693  -0.329
  650   2HD1  LEU  86          2HD1      LEU  86   1.919  -0.231  -1.305
  651   3HD1  LEU  86          3HD1      LEU  86   2.143  -1.804  -2.095
  652   1HD2  LEU  86          1HD2      LEU  86   3.694   0.543   0.279
  653   2HD2  LEU  86          2HD2      LEU  86   4.313  -1.023   0.859
  654   3HD2  LEU  86          3HD2      LEU  86   5.380   0.100  -0.012
  655    H    MET  87           H        MET  87   6.291  -4.342  -0.249
  656    HA   MET  87           HA       MET  87   6.769  -3.727   2.356
  657   1HB   MET  87          2HB       MET  87   6.444  -6.027   1.323
  658   2HB   MET  87          3HB       MET  87   8.167  -6.007   0.940
  659   1HG   MET  87          2HG       MET  87   8.129  -5.375   3.676
  660   2HG   MET  87          3HG       MET  87   6.798  -6.505   3.492
  661   1HE   MET  87          1HE       MET  87  11.261  -7.406   2.722
  662   2HE   MET  87          2HE       MET  87  10.365  -6.317   1.641
  663   3HE   MET  87          3HE       MET  87  10.622  -5.871   3.349
  664    H    ALA  88           H        ALA  88   9.255  -4.014  -0.157
  665    HA   ALA  88           HA       ALA  88  11.567  -4.019   1.391
  666   1HB   ALA  88          1HB       ALA  88  11.529  -4.681  -0.954
  667   2HB   ALA  88          2HB       ALA  88  11.082  -3.047  -1.460
  668   3HB   ALA  88          3HB       ALA  88  12.685  -3.351  -0.751
  669    H    ALA  89           H        ALA  89   9.818  -1.205   0.036
  670    HA   ALA  89           HA       ALA  89  11.829   0.670   1.194
  671   1HB   ALA  89          1HB       ALA  89   9.357   1.054  -0.494
  672   2HB   ALA  89          2HB       ALA  89  10.396   2.384   0.072
  673   3HB   ALA  89          3HB       ALA  89  11.070   1.164  -1.021
  674    H    ALA  90           H        ALA  90   8.511  -0.483   1.706
  675    HA   ALA  90           HA       ALA  90   7.697   1.467   3.667
  676   1HB   ALA  90          1HB       ALA  90   6.129  -0.414   4.295
  677   2HB   ALA  90          2HB       ALA  90   6.102   0.012   2.557
  678   3HB   ALA  90          3HB       ALA  90   6.954  -1.440   3.117
  679    H    ASP  91           H        ASP  91   9.311  -1.750   3.974
  680    HA   ASP  91           HA       ASP  91   9.419  -1.539   6.837
  681   1HB   ASP  91          2HB       ASP  91   9.441  -3.721   5.648
  682   2HB   ASP  91          3HB       ASP  91  11.051  -3.336   5.004
  683    H    ASN  92           H        ASN  92  10.763  -0.145   7.900
  684    HA   ASN  92           HA       ASN  92  13.332   0.694   6.525
  685   1HB   ASN  92          2HB       ASN  92  11.404   2.336   8.184
  686   2HB   ASN  92          3HB       ASN  92  13.098   2.790   7.941
  687   1HD2  ASN  92          1HD2      ASN  92  10.188   1.825   6.028
  688   2HD2  ASN  92          2HD2      ASN  92  10.703   2.631   4.568
  689    H    ASP  93           H        ASP  93  12.963  -1.669   7.953
  690    HA   ASP  93           HA       ASP  93  14.907  -1.227  10.196
  691   1HB   ASP  93          2HB       ASP  93  12.822  -3.421   9.807
  692   2HB   ASP  93          3HB       ASP  93  14.108  -3.452  11.019
  693    H    GLY  94           H        GLY  94  13.827  -3.393   7.565
  694   1HA   GLY  94          1HA       GLY  94  15.114  -4.853   6.236
  695   2HA   GLY  94          2HA       GLY  94  16.475  -4.735   7.368
  696    H    ASP  95           H        ASP  95  12.945  -5.121   7.983
  697    HA   ASP  95           HA       ASP  95  13.479  -7.772   9.264
  698   1HB   ASP  95          2HB       ASP  95  12.577  -7.255  11.205
  699   2HB   ASP  95          3HB       ASP  95  12.960  -5.593  10.796
  700    H    GLY  96           H        GLY  96  10.776  -5.684   8.060
  701   1HA   GLY  96          1HA       GLY  96   9.763  -6.497   5.939
  702   2HA   GLY  96          2HA       GLY  96   9.643  -8.102   6.666
  703    H    LYS  97           H        LYS  97   8.950  -7.087   9.384
  704    HA   LYS  97           HA       LYS  97   6.074  -6.873   9.018
  705   1HB   LYS  97          2HB       LYS  97   7.806  -6.492  11.487
  706   2HB   LYS  97          3HB       LYS  97   6.061  -6.752  11.476
  707   1HG   LYS  97          2HG       LYS  97   6.277  -9.020  10.749
  708   2HG   LYS  97          3HG       LYS  97   7.965  -8.799  10.257
  709   1HD   LYS  97          2HD       LYS  97   8.619  -8.347  12.590
  710   2HD   LYS  97          3HD       LYS  97   6.962  -8.748  13.116
  711   1HE   LYS  97          2HE       LYS  97   7.217 -11.029  12.142
  712   2HE   LYS  97          3HE       LYS  97   8.823 -10.599  11.521
  713   1HZ   LYS  97          1HZ       LYS  97   8.982 -11.843  13.538
  714   2HZ   LYS  97          2HZ       LYS  97   9.577 -10.326  13.762
  715   3HZ   LYS  97          3HZ       LYS  97   8.097 -10.729  14.366
  716    H    ILE  98           H        ILE  98   5.013  -4.935   8.640
  717    HA   ILE  98           HA       ILE  98   6.601  -2.420   8.930
  718    HB   ILE  98           HB       ILE  98   4.447  -3.390   7.077
  719   1HG1  ILE  98          2HG1      ILE  98   6.967  -1.892   6.357
  720   2HG1  ILE  98          3HG1      ILE  98   7.143  -3.559   6.898
  721   1HG2  ILE  98          1HG2      ILE  98   4.370  -1.149   6.096
  722   2HG2  ILE  98          2HG2      ILE  98   3.709  -1.139   7.728
  723   3HG2  ILE  98          3HG2      ILE  98   5.343  -0.499   7.434
  724   1HD1  ILE  98          1HD1      ILE  98   6.994  -3.444   4.506
  725   2HD1  ILE  98          2HD1      ILE  98   5.643  -4.380   5.178
  726   3HD1  ILE  98          3HD1      ILE  98   5.364  -2.724   4.584
  727    H    GLY  99           H        GLY  99   6.039  -1.031  10.504
  728   1HA   GLY  99          1HA       GLY  99   3.422  -1.334  11.893
  729   2HA   GLY  99          2HA       GLY  99   4.709  -0.183  12.270
  730    H    ALA 100           H        ALA 100   1.865   0.416  11.981
  731    HA   ALA 100           HA       ALA 100   1.230   1.890   9.662
  732   1HB   ALA 100          1HB       ALA 100  -0.334   1.593  11.535
  733   2HB   ALA 100          2HB       ALA 100   0.726   2.548  12.601
  734   3HB   ALA 100          3HB       ALA 100  -0.077   3.322  11.223
  735    H    GLU 101           H        GLU 101   3.467   2.563  12.327
  736    HA   GLU 101           HA       GLU 101   3.937   5.246  11.754
  737   1HB   GLU 101          2HB       GLU 101   4.485   4.038  13.862
  738   2HB   GLU 101          3HB       GLU 101   5.879   3.283  13.073
  739   1HG   GLU 101          2HG       GLU 101   6.958   5.434  12.817
  740   2HG   GLU 101          3HG       GLU 101   5.476   6.299  13.263
  741    H    GLU 102           H        GLU 102   6.104   2.454  10.966
  742    HA   GLU 102           HA       GLU 102   7.845   3.573   9.128
  743   1HB   GLU 102          2HB       GLU 102   6.454   0.847   9.069
  744   2HB   GLU 102          3HB       GLU 102   7.781   1.304   8.005
  745   1HG   GLU 102          2HG       GLU 102   9.275   1.620   9.920
  746   2HG   GLU 102          3HG       GLU 102   7.979   1.173  11.036
  747    H    PHE 103           H        PHE 103   4.554   2.302   8.510
  748    HA   PHE 103           HA       PHE 103   4.700   2.851   5.725
  749   1HB   PHE 103          2HB       PHE 103   3.070   1.333   7.281
  750   2HB   PHE 103          3HB       PHE 103   2.011   2.705   7.051
  751    HD1  PHE 103           1HD      PHE 103   4.481   0.873   4.871
  752    HD2  PHE 103           2HD      PHE 103   0.350   1.710   5.618
  753    HE1  PHE 103           1HE      PHE 103   3.834  -0.525   2.947
  754    HE2  PHE 103           2HE      PHE 103  -0.259   0.648   3.467
  755    HZ   PHE 103           HZ       PHE 103   1.475  -0.541   2.146
  756    H    GLN 104           H        GLN 104   3.420   4.858   8.389
  757    HA   GLN 104           HA       GLN 104   2.415   7.029   6.724
  758   1HB   GLN 104          2HB       GLN 104   1.997   6.628   9.231
  759   2HB   GLN 104          3HB       GLN 104   3.613   7.302   9.498
  760   1HG   GLN 104          2HG       GLN 104   2.840   9.334   8.111
  761   2HG   GLN 104          3HG       GLN 104   1.217   8.639   8.146
  762   1HE2  GLN 104          1HE2      GLN 104   0.744   7.809  10.650
  763   2HE2  GLN 104          2HE2      GLN 104   1.007   9.110  11.807
  764    H    GLU 105           H        GLU 105   5.704   6.312   8.230
  765    HA   GLU 105           HA       GLU 105   6.928   8.682   7.284
  766   1HB   GLU 105          2HB       GLU 105   8.118   5.891   7.684
  767   2HB   GLU 105          3HB       GLU 105   9.038   7.281   7.127
  768   1HG   GLU 105          2HG       GLU 105   8.197   8.560   9.187
  769   2HG   GLU 105          3HG       GLU 105   7.674   6.987   9.819
  770    H    MET 106           H        MET 106   6.664   5.511   5.596
  771    HA   MET 106           HA       MET 106   8.020   6.398   3.261
  772   1HB   MET 106          2HB       MET 106   6.860   3.993   4.113
  773   2HB   MET 106          3HB       MET 106   5.838   4.442   2.749
  774   1HG   MET 106          2HG       MET 106   8.847   4.041   2.774
  775   2HG   MET 106          3HG       MET 106   7.629   3.035   1.996
  776   1HE   MET 106          1HE       MET 106  10.082   6.103  -0.003
  777   2HE   MET 106          2HE       MET 106   9.836   6.204   1.751
  778   3HE   MET 106          3HE       MET 106  10.468   4.707   1.026
  779    H    VAL 107           H        VAL 107   4.546   6.192   4.013
  780    HA   VAL 107           HA       VAL 107   3.779   7.294   1.511
  781    HB   VAL 107           HB       VAL 107   2.195   6.646   4.012
  782   1HG1  VAL 107          1HG1      VAL 107   1.319   7.367   1.207
  783   2HG1  VAL 107          2HG1      VAL 107   0.257   6.573   2.398
  784   3HG1  VAL 107          3HG1      VAL 107   0.874   8.203   2.703
  785   1HG2  VAL 107          1HG2      VAL 107   2.531   5.170   1.348
  786   2HG2  VAL 107          2HG2      VAL 107   3.316   4.681   2.855
  787   3HG2  VAL 107          3HG2      VAL 107   1.556   4.628   2.729
  788    H    HIS 108           H        HIS 108   4.691   8.916   4.460
  789    HA   HIS 108           HA       HIS 108   3.311  11.374   3.567
  790   1HB   HIS 108          2HB       HIS 108   3.239  10.613   5.945
  791   2HB   HIS 108          3HB       HIS 108   4.967  10.972   6.064
  792    HD1  HIS 108           1HD      HIS 108   2.725  13.376   4.108
  793    HD2  HIS 108           2HD      HIS 108   4.386  12.879   7.942
  794    HE1  HIS 108           1HE      HIS 108   2.295  15.550   5.380
  795    H    SER 109           H        SER 109   6.073   9.829   2.627
  796    HA   SER 109           HA       SER 109   7.955  12.035   2.851
  797   1HB   SER 109          2HB       SER 109   8.660   9.637   2.875
  798   2HB   SER 109          3HB       SER 109   8.069   9.486   1.202
  799    HG   SER 109           HG       SER 109   9.468  11.384   0.819
  Start of MODEL    5
    1   1H    MET   1           H1       MET   1 -18.015   5.211   3.083
    2   2H    MET   1           H2       MET   1 -19.204   5.957   2.167
    3   3H    MET   1           H3       MET   1 -18.895   4.322   2.032
    4    HA   MET   1           HA       MET   1 -17.728   5.111   0.219
    5   1HB   MET   1          2HB       MET   1 -16.711   7.356   2.032
    6   2HB   MET   1          3HB       MET   1 -16.311   7.095   0.342
    7   1HG   MET   1          2HG       MET   1 -17.976   8.775   0.265
    8   2HG   MET   1          3HG       MET   1 -18.775   7.285  -0.220
    9   1HE   MET   1          1HE       MET   1 -21.256   7.674   0.250
   10   2HE   MET   1          2HE       MET   1 -21.829   8.749   1.546
   11   3HE   MET   1          3HE       MET   1 -20.753   9.383   0.277
   12    H    SER   2           H        SER   2 -15.292   5.073  -0.107
   13    HA   SER   2           HA       SER   2 -13.762   3.927   2.108
   14   1HB   SER   2          2HB       SER   2 -14.299   2.421  -0.502
   15   2HB   SER   2          3HB       SER   2 -13.187   1.908   0.786
   16    HG   SER   2           HG       SER   2 -15.231   0.883   0.956
   17    H    ILE   3           H        ILE   3 -11.524   3.488   1.154
   18    HA   ILE   3           HA       ILE   3 -10.431   5.815   0.138
   19    HB   ILE   3           HB       ILE   3  -8.388   4.720  -0.012
   20   1HG1  ILE   3          2HG1      ILE   3  -8.573   2.001   0.362
   21   2HG1  ILE   3          3HG1      ILE   3  -9.884   2.242  -0.781
   22   1HG2  ILE   3          1HG2      ILE   3  -9.499   4.817   2.255
   23   2HG2  ILE   3          2HG2      ILE   3  -9.878   3.094   2.095
   24   3HG2  ILE   3          3HG2      ILE   3  -8.202   3.614   2.108
   25   1HD1  ILE   3          1HD1      ILE   3  -7.631   1.754  -1.806
   26   2HD1  ILE   3          2HD1      ILE   3  -8.288   3.303  -2.356
   27   3HD1  ILE   3          3HD1      ILE   3  -7.006   3.250  -1.118
   28    H    THR   4           H        THR   4 -11.826   3.093  -1.730
   29    HA   THR   4           HA       THR   4 -10.908   4.080  -4.293
   30    HB   THR   4           HB       THR   4 -10.767   1.720  -3.909
   31    HG1  THR   4           1HG      THR   4 -13.102   2.419  -5.200
   32   1HG2  THR   4          1HG2      THR   4 -13.685   1.790  -2.987
   33   2HG2  THR   4          2HG2      THR   4 -12.794   0.328  -3.415
   34   3HG2  THR   4          3HG2      THR   4 -12.285   1.262  -2.017
   35    H    ASP   5           H        ASP   5 -12.226   6.079  -3.142
   36    HA   ASP   5           HA       ASP   5 -14.457   6.634  -4.831
   37   1HB   ASP   5          2HB       ASP   5 -15.788   5.156  -3.430
   38   2HB   ASP   5          3HB       ASP   5 -15.150   5.902  -1.957
   39    H    VAL   6           H        VAL   6 -13.181   7.211  -1.558
   40    HA   VAL   6           HA       VAL   6 -13.747   9.909  -1.252
   41    HB   VAL   6           HB       VAL   6 -11.458   8.170  -0.273
   42   1HG1  VAL   6          1HG1      VAL   6 -11.970  11.062   0.522
   43   2HG1  VAL   6          2HG1      VAL   6 -10.959   9.914   1.426
   44   3HG1  VAL   6          3HG1      VAL   6 -10.487  10.397  -0.200
   45   1HG2  VAL   6          1HG2      VAL   6 -13.815   9.446   1.184
   46   2HG2  VAL   6          2HG2      VAL   6 -13.843   7.803   0.533
   47   3HG2  VAL   6          3HG2      VAL   6 -12.697   8.219   1.819
   48    H    LEU   7           H        LEU   7 -10.901   8.525  -2.852
   49    HA   LEU   7           HA       LEU   7 -10.480  10.836  -4.552
   50   1HB   LEU   7          2HB       LEU   7  -9.472  11.879  -2.661
   51   2HB   LEU   7          3HB       LEU   7  -8.744  10.369  -2.111
   52    HG   LEU   7           HG       LEU   7  -7.107  10.411  -3.941
   53   1HD1  LEU   7          1HD1      LEU   7  -6.903  12.368  -5.429
   54   2HD1  LEU   7          2HD1      LEU   7  -8.414  11.513  -5.730
   55   3HD1  LEU   7          3HD1      LEU   7  -8.429  13.027  -4.800
   56   1HD2  LEU   7          1HD2      LEU   7  -7.267  13.100  -2.529
   57   2HD2  LEU   7          2HD2      LEU   7  -6.625  11.601  -1.823
   58   3HD2  LEU   7          3HD2      LEU   7  -5.817  12.339  -3.217
   59    H    SER   8           H        SER   8  -8.679   8.215  -2.878
   60    HA   SER   8           HA       SER   8  -6.921   7.596  -4.766
   61   1HB   SER   8          2HB       SER   8  -8.203   5.440  -3.111
   62   2HB   SER   8          3HB       SER   8  -6.521   5.580  -3.640
   63    HG   SER   8           HG       SER   8  -6.298   7.382  -2.291
   64    H    ALA   9           H        ALA   9 -10.326   6.734  -4.991
   65    HA   ALA   9           HA       ALA   9 -10.487   4.737  -6.874
   66   1HB   ALA   9          1HB       ALA   9 -12.372   6.162  -7.879
   67   2HB   ALA   9          2HB       ALA   9 -12.496   5.841  -6.151
   68   3HB   ALA   9          3HB       ALA   9 -11.915   7.424  -6.716
   69    H    ASP  10           H        ASP  10  -9.530   8.158  -7.623
   70    HA   ASP  10           HA       ASP  10  -9.402   7.548 -10.484
   71   1HB   ASP  10          2HB       ASP  10  -9.802   9.834  -9.497
   72   2HB   ASP  10          3HB       ASP  10  -8.100   9.862  -8.999
   73    H    ASP  11           H        ASP  11  -7.148   7.777  -7.766
   74    HA   ASP  11           HA       ASP  11  -4.734   7.612  -9.220
   75   1HB   ASP  11          2HB       ASP  11  -5.267   6.864  -6.313
   76   2HB   ASP  11          3HB       ASP  11  -3.739   7.303  -7.077
   77    H    ILE  12           H        ILE  12  -6.765   5.079  -7.651
   78    HA   ILE  12           HA       ILE  12  -5.048   2.920  -8.140
   79    HB   ILE  12           HB       ILE  12  -6.963   1.528  -7.899
   80   1HG1  ILE  12          2HG1      ILE  12  -8.591   3.963  -7.428
   81   2HG1  ILE  12          3HG1      ILE  12  -8.700   2.997  -8.901
   82   1HG2  ILE  12          1HG2      ILE  12  -6.709   3.631  -5.721
   83   2HG2  ILE  12          2HG2      ILE  12  -7.301   1.976  -5.502
   84   3HG2  ILE  12          3HG2      ILE  12  -5.626   2.252  -5.971
   85   1HD1  ILE  12          1HD1      ILE  12  -9.541   1.110  -7.677
   86   2HD1  ILE  12          2HD1      ILE  12  -9.446   2.015  -6.136
   87   3HD1  ILE  12          3HD1      ILE  12 -10.550   2.521  -7.422
   88    H    ALA  13           H        ALA  13  -7.529   4.530 -10.167
   89    HA   ALA  13           HA       ALA  13  -7.527   2.545 -12.230
   90   1HB   ALA  13          1HB       ALA  13  -8.639   4.199 -13.589
   91   2HB   ALA  13          2HB       ALA  13  -9.299   4.267 -11.943
   92   3HB   ALA  13          3HB       ALA  13  -8.162   5.511 -12.503
   93    H    ALA  14           H        ALA  14  -5.600   5.526 -11.683
   94    HA   ALA  14           HA       ALA  14  -3.973   5.262 -14.029
   95   1HB   ALA  14          1HB       ALA  14  -4.024   7.303 -12.658
   96   2HB   ALA  14          2HB       ALA  14  -3.209   6.458 -11.329
   97   3HB   ALA  14          3HB       ALA  14  -2.372   6.693 -12.872
   98    H    ALA  15           H        ALA  15  -3.282   4.224 -10.661
   99    HA   ALA  15           HA       ALA  15  -0.859   2.974 -10.982
  100   1HB   ALA  15          1HB       ALA  15  -3.051   1.978  -9.134
  101   2HB   ALA  15          2HB       ALA  15  -1.293   1.892  -8.913
  102   3HB   ALA  15          3HB       ALA  15  -2.116   3.453  -8.831
  103    H    LEU  16           H        LEU  16  -4.045   1.591 -11.322
  104    HA   LEU  16           HA       LEU  16  -3.555  -1.094 -11.759
  105   1HB   LEU  16          2HB       LEU  16  -5.805  -0.353 -11.490
  106   2HB   LEU  16          3HB       LEU  16  -5.642   0.832 -12.786
  107    HG   LEU  16           HG       LEU  16  -5.591  -0.977 -14.484
  108   1HD1  LEU  16          1HD1      LEU  16  -4.772  -2.854 -13.043
  109   2HD1  LEU  16          2HD1      LEU  16  -6.294  -2.792 -12.130
  110   3HD1  LEU  16          3HD1      LEU  16  -6.300  -3.243 -13.848
  111   1HD2  LEU  16          1HD2      LEU  16  -7.652   0.218 -13.904
  112   2HD2  LEU  16          2HD2      LEU  16  -7.975  -1.467 -14.348
  113   3HD2  LEU  16          3HD2      LEU  16  -8.001  -0.980 -12.639
  114    H    GLN  17           H        GLN  17  -3.278   1.659 -14.052
  115    HA   GLN  17           HA       GLN  17  -2.844  -0.293 -16.257
  116   1HB   GLN  17          2HB       GLN  17  -4.203   2.202 -16.143
  117   2HB   GLN  17          3HB       GLN  17  -2.760   2.453 -17.142
  118   1HG   GLN  17          2HG       GLN  17  -3.361   0.411 -18.467
  119   2HG   GLN  17          3HG       GLN  17  -4.793   0.191 -17.443
  120   1HE2  GLN  17          1HE2      GLN  17  -3.251   2.745 -19.506
  121   2HE2  GLN  17          2HE2      GLN  17  -4.779   3.282 -20.184
  122    H    GLU  18           H        GLU  18  -1.243   2.368 -14.510
  123    HA   GLU  18           HA       GLU  18   1.005   2.417 -16.234
  124   1HB   GLU  18          2HB       GLU  18   1.863   4.050 -14.827
  125   2HB   GLU  18          3HB       GLU  18   0.109   4.206 -14.731
  126   1HG   GLU  18          2HG       GLU  18   0.438   4.349 -12.526
  127   2HG   GLU  18          3HG       GLU  18   0.469   2.582 -12.615
  128    H    CYS  19           H        CYS  19   0.336   0.494 -13.305
  129    HA   CYS  19           HA       CYS  19   2.770  -1.174 -13.922
  130   1HB   CYS  19          2HB       CYS  19   1.614  -0.417 -11.245
  131   2HB   CYS  19          3HB       CYS  19   2.707  -1.795 -11.515
  132    HG   CYS  19           HG       CYS  19   3.208   1.401 -11.910
  133    H    ARG  20           H        ARG  20   0.752  -1.829 -15.463
  134    HA   ARG  20           HA       ARG  20  -1.099  -3.620 -14.067
  135   1HB   ARG  20          2HB       ARG  20  -1.526  -2.182 -16.185
  136   2HB   ARG  20          3HB       ARG  20  -0.763  -3.499 -17.075
  137   1HG   ARG  20          2HG       ARG  20  -2.456  -5.063 -16.344
  138   2HG   ARG  20          3HG       ARG  20  -3.030  -3.964 -15.074
  139   1HD   ARG  20          2HD       ARG  20  -3.842  -2.372 -16.729
  140   2HD   ARG  20          3HD       ARG  20  -3.313  -3.453 -18.050
  141    HE   ARG  20           HE       ARG  20  -4.973  -4.910 -16.263
  142   1HH1  ARG  20          2HH2      ARG  20  -5.258  -2.256 -18.551
  143   2HH1  ARG  20          1HH2      ARG  20  -6.933  -2.518 -18.927
  144   1HH2  ARG  20          2HH1      ARG  20  -7.198  -5.332 -16.742
  145   2HH2  ARG  20          1HH1      ARG  20  -8.056  -4.343 -17.879
  146    H    ASP  21           H        ASP  21   2.051  -3.848 -15.424
  147    HA   ASP  21           HA       ASP  21   1.861  -6.634 -16.194
  148   1HB   ASP  21          2HB       ASP  21   3.961  -4.442 -16.425
  149   2HB   ASP  21          3HB       ASP  21   4.239  -6.084 -16.993
  150    HA   PRO  22           HA       PRO  22   3.405  -8.449 -12.574
  151   1HB   PRO  22          2HB       PRO  22   5.029 -10.503 -13.440
  152   2HB   PRO  22          3HB       PRO  22   3.245 -10.514 -13.563
  153   1HG   PRO  22          2HG       PRO  22   5.239  -9.695 -15.693
  154   2HG   PRO  22          3HG       PRO  22   3.867 -10.830 -15.866
  155   1HD   PRO  22          2HD       PRO  22   3.624  -8.262 -16.637
  156   2HD   PRO  22          3HD       PRO  22   2.280  -9.030 -15.746
  157    H    ASP  23           H        ASP  23   4.781  -7.582 -11.205
  158    HA   ASP  23           HA       ASP  23   6.645  -7.295 -10.071
  159   1HB   ASP  23          2HB       ASP  23   8.258  -8.383 -12.385
  160   2HB   ASP  23          3HB       ASP  23   8.810  -8.120 -10.730
  161    H    THR  24           H        THR  24   5.476  -5.400 -12.164
  162    HA   THR  24           HA       THR  24   7.728  -3.597 -12.722
  163    HB   THR  24           HB       THR  24   4.762  -3.133 -13.236
  164    HG1  THR  24           1HG      THR  24   5.126  -4.974 -14.223
  165   1HG2  THR  24          1HG2      THR  24   7.334  -1.957 -14.335
  166   2HG2  THR  24          2HG2      THR  24   5.868  -2.017 -15.328
  167   3HG2  THR  24          3HG2      THR  24   5.857  -1.127 -13.796
  168    H    PHE  25           H        PHE  25   5.535  -4.042 -10.117
  169    HA   PHE  25           HA       PHE  25   4.855  -1.292  -9.886
  170   1HB   PHE  25          2HB       PHE  25   3.449  -3.359  -9.565
  171   2HB   PHE  25          3HB       PHE  25   4.130  -3.515  -7.952
  172    HD1  PHE  25           1HD      PHE  25   1.637  -3.661  -7.522
  173    HD2  PHE  25           2HD      PHE  25   3.435  -0.003  -8.971
  174    HE1  PHE  25           1HE      PHE  25  -0.558  -2.530  -7.445
  175    HE2  PHE  25           2HE      PHE  25   1.236   1.046  -9.036
  176    HZ   PHE  25           HZ       PHE  25  -0.789  -0.214  -8.281
  177    H    GLU  26           H        GLU  26   6.519   0.022  -9.186
  178    HA   GLU  26           HA       GLU  26   8.303  -0.754  -7.036
  179   1HB   GLU  26          2HB       GLU  26   8.232   1.325  -9.135
  180   2HB   GLU  26          3HB       GLU  26   8.574   2.026  -7.566
  181   1HG   GLU  26          2HG       GLU  26  10.349  -0.023  -7.453
  182   2HG   GLU  26          3HG       GLU  26  10.242   0.188  -9.202
  183    HA   PRO  27           HA       PRO  27   6.037   1.019  -3.765
  184   1HB   PRO  27          2HB       PRO  27   7.967   1.937  -1.999
  185   2HB   PRO  27          3HB       PRO  27   7.604   0.216  -2.280
  186   1HG   PRO  27          2HG       PRO  27   9.899   1.797  -3.395
  187   2HG   PRO  27          3HG       PRO  27   9.848   0.095  -2.862
  188   1HD   PRO  27          2HD       PRO  27   9.703   0.893  -5.491
  189   2HD   PRO  27          3HD       PRO  27   9.039  -0.645  -4.862
  190    H    GLN  28           H        GLN  28   8.816   3.291  -4.239
  191    HA   GLN  28           HA       GLN  28   7.321   5.581  -3.499
  192   1HB   GLN  28          2HB       GLN  28   9.919   5.227  -5.007
  193   2HB   GLN  28          3HB       GLN  28   9.226   6.823  -4.661
  194   1HG   GLN  28          2HG       GLN  28   9.232   6.414  -2.269
  195   2HG   GLN  28          3HG       GLN  28   9.719   4.730  -2.497
  196   1HE2  GLN  28          1HE2      GLN  28  10.871   8.078  -3.319
  197   2HE2  GLN  28          2HE2      GLN  28  12.556   7.683  -3.025
  198    H    LYS  29           H        LYS  29   7.714   3.956  -6.618
  199    HA   LYS  29           HA       LYS  29   6.452   5.941  -8.216
  200   1HB   LYS  29          2HB       LYS  29   7.727   3.960  -9.070
  201   2HB   LYS  29          3HB       LYS  29   6.415   2.908  -8.545
  202   1HG   LYS  29          2HG       LYS  29   6.310   3.280 -10.905
  203   2HG   LYS  29          3HG       LYS  29   4.869   3.960 -10.168
  204   1HD   LYS  29          2HD       LYS  29   7.255   5.783 -10.547
  205   2HD   LYS  29          3HD       LYS  29   6.464   5.238 -12.017
  206   1HE   LYS  29          2HE       LYS  29   4.913   6.560  -9.738
  207   2HE   LYS  29          3HE       LYS  29   5.650   7.477 -11.049
  208   1HZ   LYS  29          1HZ       LYS  29   3.193   6.728 -11.283
  209   2HZ   LYS  29          2HZ       LYS  29   4.200   6.511 -12.580
  210   3HZ   LYS  29          3HZ       LYS  29   3.810   5.269 -11.679
  211    H    PHE  30           H        PHE  30   5.078   2.890  -6.822
  212    HA   PHE  30           HA       PHE  30   2.453   3.393  -7.533
  213   1HB   PHE  30          2HB       PHE  30   3.297   1.211  -6.783
  214   2HB   PHE  30          3HB       PHE  30   3.547   1.842  -5.162
  215    HD1  PHE  30           1HD      PHE  30   0.430   2.617  -7.111
  216    HD2  PHE  30           2HD      PHE  30   2.240  -0.074  -4.290
  217    HE1  PHE  30           1HE      PHE  30  -1.803   1.953  -6.300
  218    HE2  PHE  30           2HE      PHE  30   0.048  -0.747  -3.510
  219    HZ   PHE  30           HZ       PHE  30  -2.015   0.443  -4.365
  220    H    PHE  31           H        PHE  31   4.070   4.124  -4.480
  221    HA   PHE  31           HA       PHE  31   2.296   5.301  -2.796
  222   1HB   PHE  31          2HB       PHE  31   4.546   5.187  -2.135
  223   2HB   PHE  31          3HB       PHE  31   5.104   5.851  -3.660
  224    HD1  PHE  31           1HD      PHE  31   2.795   7.158  -1.023
  225    HD2  PHE  31           2HD      PHE  31   6.348   7.795  -3.383
  226    HE1  PHE  31           1HE      PHE  31   3.025   9.429  -0.098
  227    HE2  PHE  31           2HE      PHE  31   6.672   9.989  -2.295
  228    HZ   PHE  31           HZ       PHE  31   5.044  10.781  -0.596
  229    H    GLN  32           H        GLN  32   4.033   7.194  -5.354
  230    HA   GLN  32           HA       GLN  32   2.384   9.501  -4.872
  231   1HB   GLN  32          2HB       GLN  32   4.717   9.538  -5.855
  232   2HB   GLN  32          3HB       GLN  32   4.028   8.903  -7.362
  233   1HG   GLN  32          2HG       GLN  32   2.412  10.913  -7.311
  234   2HG   GLN  32          3HG       GLN  32   3.379  11.550  -5.977
  235   1HE2  GLN  32          1HE2      GLN  32   5.900  11.552  -6.549
  236   2HE2  GLN  32          2HE2      GLN  32   6.248  12.171  -8.157
  237    H    THR  33           H        THR  33   2.423   6.917  -7.368
  238    HA   THR  33           HA       THR  33   0.410   8.059  -8.978
  239    HB   THR  33           HB       THR  33   2.156   5.762  -9.006
  240    HG1  THR  33           1HG      THR  33   0.310   6.795 -10.803
  241   1HG2  THR  33          1HG2      THR  33  -0.653   4.993  -9.803
  242   2HG2  THR  33          2HG2      THR  33   0.836   4.027  -9.914
  243   3HG2  THR  33          3HG2      THR  33   0.162   4.408  -8.331
  244    H    SER  34           H        SER  34   0.194   6.218  -6.064
  245    HA   SER  34           HA       SER  34  -2.617   5.524  -6.342
  246   1HB   SER  34          2HB       SER  34  -0.989   4.017  -5.317
  247   2HB   SER  34          3HB       SER  34  -0.645   5.179  -4.054
  248    HG   SER  34           HG       SER  34  -3.076   5.055  -3.727
  249    H    GLY  35           H        GLY  35  -0.888   8.320  -5.453
  250   1HA   GLY  35          1HA       GLY  35  -1.853  10.363  -4.885
  251   2HA   GLY  35          2HA       GLY  35  -3.392   9.561  -4.531
  252    H    LEU  36           H        LEU  36  -0.867   7.930  -2.993
  253    HA   LEU  36           HA       LEU  36  -1.888   8.606  -0.395
  254   1HB   LEU  36          2HB       LEU  36   0.584   7.071  -1.256
  255   2HB   LEU  36          3HB       LEU  36  -0.163   7.053   0.337
  256    HG   LEU  36           HG       LEU  36  -1.425   6.007  -2.199
  257   1HD1  LEU  36          1HD1      LEU  36  -1.124   3.807  -1.173
  258   2HD1  LEU  36          2HD1      LEU  36   0.441   4.630  -1.286
  259   3HD1  LEU  36          3HD1      LEU  36  -0.406   4.549   0.273
  260   1HD2  LEU  36          1HD2      LEU  36  -2.505   6.046   0.642
  261   2HD2  LEU  36          2HD2      LEU  36  -3.215   6.824  -0.796
  262   3HD2  LEU  36          3HD2      LEU  36  -3.164   5.065  -0.685
  263    H    SER  37           H        SER  37   0.711   9.777  -2.403
  264    HA   SER  37           HA       SER  37   2.115  11.403  -0.464
  265   1HB   SER  37          2HB       SER  37   2.933  10.754  -2.796
  266   2HB   SER  37          3HB       SER  37   1.687  11.809  -3.471
  267    HG   SER  37           HG       SER  37   3.733  12.659  -1.695
  268    H    LYS  38           H        LYS  38  -1.005  11.722  -2.091
  269    HA   LYS  38           HA       LYS  38  -1.032  14.637  -1.658
  270   1HB   LYS  38          2HB       LYS  38  -2.055  13.042  -3.723
  271   2HB   LYS  38          3HB       LYS  38  -3.469  13.321  -2.717
  272   1HG   LYS  38          2HG       LYS  38  -3.364  15.094  -4.336
  273   2HG   LYS  38          3HG       LYS  38  -2.970  15.778  -2.756
  274   1HD   LYS  38          2HD       LYS  38  -0.480  14.896  -3.884
  275   2HD   LYS  38          3HD       LYS  38  -1.366  15.636  -5.219
  276   1HE   LYS  38          2HE       LYS  38  -1.677  17.712  -3.887
  277   2HE   LYS  38          3HE       LYS  38  -0.873  16.961  -2.496
  278   1HZ   LYS  38          1HZ       LYS  38   1.132  16.815  -3.786
  279   2HZ   LYS  38          2HZ       LYS  38   0.403  17.512  -5.091
  280   3HZ   LYS  38          3HZ       LYS  38   0.612  18.370  -3.703
  281    H    MET  39           H        MET  39  -2.527  11.585  -0.629
  282    HA   MET  39           HA       MET  39  -4.436  12.685   1.133
  283   1HB   MET  39          2HB       MET  39  -2.864  10.089   1.081
  284   2HB   MET  39          3HB       MET  39  -3.929  10.463   2.429
  285   1HG   MET  39          2HG       MET  39  -5.819  10.804   0.926
  286   2HG   MET  39          3HG       MET  39  -4.822  10.382  -0.475
  287   1HE   MET  39          1HE       MET  39  -7.264   8.960  -0.615
  288   2HE   MET  39          2HE       MET  39  -7.582   7.542   0.420
  289   3HE   MET  39          3HE       MET  39  -7.686   9.179   1.099
  290    H    SER  40           H        SER  40  -4.268  13.867   3.015
  291    HA   SER  40           HA       SER  40  -1.809  14.562   4.206
  292   1HB   SER  40          2HB       SER  40  -4.569  14.518   5.507
  293   2HB   SER  40          3HB       SER  40  -3.205  15.580   5.907
  294    HG   SER  40           HG       SER  40  -4.649  16.675   4.547
  295    H    ALA  41           H        ALA  41  -1.054  13.970   6.377
  296    HA   ALA  41           HA       ALA  41  -0.573  11.352   6.949
  297   1HB   ALA  41          1HB       ALA  41   0.499  13.223   8.120
  298   2HB   ALA  41          2HB       ALA  41  -1.017  13.587   8.972
  299   3HB   ALA  41          3HB       ALA  41  -0.164  12.060   9.279
  300    H    ASN  42           H        ASN  42  -3.426  13.213   8.024
  301    HA   ASN  42           HA       ASN  42  -4.632  11.326   9.720
  302   1HB   ASN  42          2HB       ASN  42  -6.056  13.227   7.804
  303   2HB   ASN  42          3HB       ASN  42  -6.723  12.507   9.273
  304   1HD2  ASN  42          1HD2      ASN  42  -6.352  13.617  11.245
  305   2HD2  ASN  42          2HD2      ASN  42  -5.306  15.018  11.357
  306    H    GLN  43           H        GLN  43  -5.141  11.818   6.190
  307    HA   GLN  43           HA       GLN  43  -6.952   9.595   5.925
  308   1HB   GLN  43          2HB       GLN  43  -5.561  11.498   4.060
  309   2HB   GLN  43          3HB       GLN  43  -6.051   9.939   3.397
  310   1HG   GLN  43          2HG       GLN  43  -7.958  11.761   4.905
  311   2HG   GLN  43          3HG       GLN  43  -7.768  11.756   3.143
  312   1HE2  GLN  43          1HE2      GLN  43 -10.304  11.233   4.157
  313   2HE2  GLN  43          2HE2      GLN  43 -10.646   9.523   3.980
  314    H    VAL  44           H        VAL  44  -3.395  10.011   5.319
  315    HA   VAL  44           HA       VAL  44  -2.956   7.430   4.291
  316    HB   VAL  44           HB       VAL  44  -1.218   9.310   5.955
  317   1HG1  VAL  44          1HG1      VAL  44   0.702   8.088   4.947
  318   2HG1  VAL  44          2HG1      VAL  44  -0.213   7.115   6.105
  319   3HG1  VAL  44          3HG1      VAL  44  -0.446   6.861   4.353
  320   1HG2  VAL  44          1HG2      VAL  44  -0.278   9.949   3.774
  321   2HG2  VAL  44          2HG2      VAL  44  -1.340   8.786   2.947
  322   3HG2  VAL  44          3HG2      VAL  44  -2.018  10.201   3.754
  323    H    LYS  45           H        LYS  45  -2.912   8.537   7.738
  324    HA   LYS  45           HA       LYS  45  -2.350   5.853   8.666
  325   1HB   LYS  45          2HB       LYS  45  -1.786   8.162   9.741
  326   2HB   LYS  45          3HB       LYS  45  -3.415   8.073  10.428
  327   1HG   LYS  45          2HG       LYS  45  -2.796   5.875  11.477
  328   2HG   LYS  45          3HG       LYS  45  -1.211   5.960  10.684
  329   1HD   LYS  45          2HD       LYS  45  -0.711   8.075  11.885
  330   2HD   LYS  45          3HD       LYS  45  -2.263   7.947  12.744
  331   1HE   LYS  45          2HE       LYS  45  -1.535   5.776  13.734
  332   2HE   LYS  45          3HE       LYS  45  -0.020   5.853  12.819
  333   1HZ   LYS  45          1HZ       LYS  45   0.575   7.816  14.045
  334   2HZ   LYS  45          2HZ       LYS  45  -0.825   7.763  14.911
  335   3HZ   LYS  45          3HZ       LYS  45   0.288   6.562  15.063
  336    H    ASP  46           H        ASP  46  -5.324   7.623   7.944
  337    HA   ASP  46           HA       ASP  46  -7.107   5.780   9.290
  338   1HB   ASP  46          2HB       ASP  46  -7.836   8.016   8.585
  339   2HB   ASP  46          3HB       ASP  46  -7.568   7.594   6.889
  340    H    VAL  47           H        VAL  47  -6.326   6.142   5.775
  341    HA   VAL  47           HA       VAL  47  -7.360   3.738   4.933
  342    HB   VAL  47           HB       VAL  47  -6.005   3.845   2.963
  343   1HG1  VAL  47          1HG1      VAL  47  -6.849   5.806   2.088
  344   2HG1  VAL  47          2HG1      VAL  47  -7.857   5.643   3.544
  345   3HG1  VAL  47          3HG1      VAL  47  -6.492   6.758   3.527
  346   1HG2  VAL  47          1HG2      VAL  47  -3.786   4.273   3.706
  347   2HG2  VAL  47          2HG2      VAL  47  -4.297   5.494   2.528
  348   3HG2  VAL  47          3HG2      VAL  47  -4.318   5.879   4.253
  349    H    PHE  48           H        PHE  48  -3.921   4.202   6.060
  350    HA   PHE  48           HA       PHE  48  -3.284   1.480   5.791
  351   1HB   PHE  48          2HB       PHE  48  -2.220   3.601   7.662
  352   2HB   PHE  48          3HB       PHE  48  -1.678   1.930   7.784
  353    HD1  PHE  48           1HD      PHE  48  -1.117   0.760   5.410
  354    HD2  PHE  48           2HD      PHE  48  -0.574   4.888   6.483
  355    HE1  PHE  48           1HE      PHE  48   0.483   1.036   3.554
  356    HE2  PHE  48           2HE      PHE  48   1.071   5.134   4.634
  357    HZ   PHE  48           HZ       PHE  48   1.506   3.226   3.101
  358    H    ARG  49           H        ARG  49  -5.017   3.032   8.540
  359    HA   ARG  49           HA       ARG  49  -5.014   0.544  10.055
  360   1HB   ARG  49          2HB       ARG  49  -6.471   3.168  10.339
  361   2HB   ARG  49          3HB       ARG  49  -6.879   1.751  11.322
  362   1HG   ARG  49          2HG       ARG  49  -4.600   1.516  12.127
  363   2HG   ARG  49          3HG       ARG  49  -4.040   2.857  11.115
  364   1HD   ARG  49          2HD       ARG  49  -6.177   3.082  13.273
  365   2HD   ARG  49          3HD       ARG  49  -4.450   3.441  13.528
  366    HE   ARG  49           HE       ARG  49  -5.281   4.902  11.259
  367   1HH1  ARG  49          2HH2      ARG  49  -5.940   4.777  14.711
  368   2HH1  ARG  49          1HH2      ARG  49  -6.310   6.460  14.907
  369   1HH2  ARG  49          2HH1      ARG  49  -5.867   7.150  11.422
  370   2HH2  ARG  49          1HH1      ARG  49  -6.234   7.863  12.962
  371    H    PHE  50           H        PHE  50  -7.192   2.048   7.638
  372    HA   PHE  50           HA       PHE  50  -9.397   0.296   8.128
  373   1HB   PHE  50          2HB       PHE  50  -9.409   2.500   6.896
  374   2HB   PHE  50          3HB       PHE  50  -8.599   1.710   5.553
  375    HD1  PHE  50           1HD      PHE  50 -11.655   1.523   7.717
  376    HD2  PHE  50           2HD      PHE  50  -9.949   0.688   3.843
  377    HE1  PHE  50           1HE      PHE  50 -13.910   1.000   6.834
  378    HE2  PHE  50           2HE      PHE  50 -12.213   0.188   2.961
  379    HZ   PHE  50           HZ       PHE  50 -14.200   0.373   4.445
  380    H    ILE  51           H        ILE  51  -6.552   0.152   5.989
  381    HA   ILE  51           HA       ILE  51  -7.288  -2.472   4.931
  382    HB   ILE  51           HB       ILE  51  -4.896  -0.644   4.546
  383   1HG1  ILE  51          2HG1      ILE  51  -5.905  -1.149   2.075
  384   2HG1  ILE  51          3HG1      ILE  51  -7.380  -1.421   2.994
  385   1HG2  ILE  51          1HG2      ILE  51  -4.002  -2.902   4.459
  386   2HG2  ILE  51          2HG2      ILE  51  -5.361  -3.437   3.431
  387   3HG2  ILE  51          3HG2      ILE  51  -4.191  -2.248   2.831
  388   1HD1  ILE  51          1HD1      ILE  51  -5.724   1.123   3.061
  389   2HD1  ILE  51          2HD1      ILE  51  -7.134   0.845   2.025
  390   3HD1  ILE  51          3HD1      ILE  51  -7.346   0.867   3.777
  391    H    ASP  52           H        ASP  52  -5.182  -1.328   7.588
  392    HA   ASP  52           HA       ASP  52  -4.117  -3.937   8.196
  393   1HB   ASP  52          2HB       ASP  52  -3.116  -1.829   9.070
  394   2HB   ASP  52          3HB       ASP  52  -4.567  -1.579  10.045
  395    H    ASN  53           H        ASN  53  -6.136  -5.057   7.730
  396    HA   ASN  53           HA       ASN  53  -8.349  -5.111   9.515
  397   1HB   ASN  53          2HB       ASN  53  -7.929  -6.468   7.320
  398   2HB   ASN  53          3HB       ASN  53  -7.078  -7.622   8.376
  399   1HD2  ASN  53          1HD2      ASN  53  -9.303  -8.439   6.915
  400   2HD2  ASN  53          2HD2      ASN  53 -10.658  -8.678   8.008
  401    H    ASP  54           H        ASP  54  -8.643  -6.698  11.318
  402    HA   ASP  54           HA       ASP  54  -8.103  -7.446  13.321
  403   1HB   ASP  54          2HB       ASP  54  -6.596  -9.070  13.371
  404   2HB   ASP  54          3HB       ASP  54  -6.065  -8.609  11.761
  405    H    GLN  55           H        GLN  55  -5.652  -5.137  12.200
  406    HA   GLN  55           HA       GLN  55  -4.611  -3.446  13.187
  407   1HB   GLN  55          2HB       GLN  55  -7.248  -3.294  14.628
  408   2HB   GLN  55          3HB       GLN  55  -5.916  -2.288  15.193
  409   1HG   GLN  55          2HG       GLN  55  -6.164  -0.827  13.560
  410   2HG   GLN  55          3HG       GLN  55  -6.022  -2.062  12.321
  411   1HE2  GLN  55          1HE2      GLN  55  -7.845  -2.880  11.322
  412   2HE2  GLN  55          2HE2      GLN  55  -9.469  -2.249  11.617
  413    H    SER  56           H        SER  56  -3.674  -5.881  13.742
  414    HA   SER  56           HA       SER  56  -2.723  -6.252  16.312
  415   1HB   SER  56          2HB       SER  56  -0.642  -7.135  15.153
  416   2HB   SER  56          3HB       SER  56  -2.169  -7.845  14.644
  417    HG   SER  56           HG       SER  56  -0.483  -7.092  12.985
  418    H    GLY  57           H        GLY  57  -2.401  -3.300  14.667
  419   1HA   GLY  57          1HA       GLY  57  -1.126  -1.438  15.088
  420   2HA   GLY  57          2HA       GLY  57  -0.264  -2.286  16.387
  421    H    TYR  58           H        TYR  58  -0.552  -4.026  13.393
  422    HA   TYR  58           HA       TYR  58   1.941  -3.100  12.226
  423   1HB   TYR  58          2HB       TYR  58   1.752  -5.583  13.871
  424   2HB   TYR  58          3HB       TYR  58   2.384  -5.805  12.249
  425    HD1  TYR  58           HD1      TYR  58   3.154  -4.392  15.546
  426    HD2  TYR  58           HD2      TYR  58   4.357  -4.628  11.420
  427    HE1  TYR  58           HE1      TYR  58   5.372  -3.436  16.132
  428    HE2  TYR  58           HE2      TYR  58   6.522  -3.546  11.991
  429    HH   TYR  58           HH       TYR  58   7.753  -2.503  13.657
  430    H    LEU  59           H        LEU  59   2.035  -3.422  10.158
  431    HA   LEU  59           HA       LEU  59  -0.020  -5.068   8.820
  432   1HB   LEU  59          2HB       LEU  59   1.827  -2.906   7.738
  433   2HB   LEU  59          3HB       LEU  59   0.755  -3.956   6.793
  434    HG   LEU  59           HG       LEU  59  -1.039  -3.127   8.651
  435   1HD1  LEU  59          1HD1      LEU  59   0.872  -1.528   9.602
  436   2HD1  LEU  59          2HD1      LEU  59   0.331  -0.488   8.278
  437   3HD1  LEU  59          3HD1      LEU  59  -0.819  -1.023   9.501
  438   1HD2  LEU  59          1HD2      LEU  59  -0.349  -1.571   6.146
  439   2HD2  LEU  59          2HD2      LEU  59  -1.403  -2.999   6.265
  440   3HD2  LEU  59          3HD2      LEU  59  -1.859  -1.489   7.072
  441    H    ASP  60           H        ASP  60   0.881  -6.820   9.831
  442    HA   ASP  60           HA       ASP  60   3.575  -7.759   9.518
  443   1HB   ASP  60          2HB       ASP  60   1.032  -9.399   9.889
  444   2HB   ASP  60          3HB       ASP  60   2.689  -9.829  10.355
  445    H    GLU  61           H        GLU  61   3.976  -9.955   8.122
  446    HA   GLU  61           HA       GLU  61   3.997  -9.131   5.573
  447   1HB   GLU  61          2HB       GLU  61   5.094 -11.273   6.792
  448   2HB   GLU  61          3HB       GLU  61   3.828 -12.142   5.927
  449   1HG   GLU  61          2HG       GLU  61   5.053 -10.243   4.134
  450   2HG   GLU  61          3HG       GLU  61   6.349 -11.104   4.973
  451    H    GLU  62           H        GLU  62   1.702 -11.747   6.576
  452    HA   GLU  62           HA       GLU  62  -0.032 -11.772   4.557
  453   1HB   GLU  62          2HB       GLU  62  -0.356 -11.835   7.599
  454   2HB   GLU  62          3HB       GLU  62  -1.823 -11.913   6.627
  455   1HG   GLU  62          2HG       GLU  62  -0.925 -14.131   7.374
  456   2HG   GLU  62          3HG       GLU  62  -1.242 -13.967   5.649
  457    H    GLU  63           H        GLU  63   0.079  -8.863   6.693
  458    HA   GLU  63           HA       GLU  63  -2.484  -7.883   5.757
  459   1HB   GLU  63          2HB       GLU  63  -0.192  -6.754   7.238
  460   2HB   GLU  63          3HB       GLU  63  -0.790  -5.641   6.018
  461   1HG   GLU  63          2HG       GLU  63  -2.088  -5.077   7.817
  462   2HG   GLU  63          3HG       GLU  63  -3.169  -6.166   6.966
  463    H    LEU  64           H        LEU  64   0.839  -7.797   4.597
  464    HA   LEU  64           HA       LEU  64   0.106  -6.291   2.198
  465   1HB   LEU  64          2HB       LEU  64   2.498  -6.748   3.709
  466   2HB   LEU  64          3HB       LEU  64   2.779  -7.423   2.121
  467    HG   LEU  64           HG       LEU  64   1.767  -4.598   2.702
  468   1HD1  LEU  64          1HD1      LEU  64   4.506  -5.593   1.835
  469   2HD1  LEU  64          2HD1      LEU  64   4.054  -3.893   2.063
  470   3HD1  LEU  64          3HD1      LEU  64   4.099  -4.992   3.456
  471   1HD2  LEU  64          1HD2      LEU  64   1.078  -5.427   0.413
  472   2HD2  LEU  64          2HD2      LEU  64   2.259  -4.117   0.340
  473   3HD2  LEU  64          3HD2      LEU  64   2.773  -5.791   0.071
  474    H    LYS  65           H        LYS  65  -0.867  -9.199   2.995
  475    HA   LYS  65           HA       LYS  65  -0.585 -10.219   0.216
  476   1HB   LYS  65          2HB       LYS  65   0.010 -11.679   2.246
  477   2HB   LYS  65          3HB       LYS  65  -1.732 -11.672   2.608
  478   1HG   LYS  65          2HG       LYS  65  -2.232 -12.871   0.575
  479   2HG   LYS  65          3HG       LYS  65  -0.613 -12.553  -0.071
  480   1HD   LYS  65          2HD       LYS  65  -0.660 -14.845   0.684
  481   2HD   LYS  65          3HD       LYS  65   0.414 -13.898   1.726
  482   1HE   LYS  65          2HE       LYS  65  -1.585 -13.701   3.366
  483   2HE   LYS  65          3HE       LYS  65  -2.401 -14.904   2.360
  484   1HZ   LYS  65          1HZ       LYS  65   0.131 -15.206   3.881
  485   2HZ   LYS  65          2HZ       LYS  65  -1.274 -15.908   4.211
  486   3HZ   LYS  65          3HZ       LYS  65  -0.450 -16.363   2.856
  487    H    PHE  66           H        PHE  66  -2.380  -8.067   2.037
  488    HA   PHE  66           HA       PHE  66  -4.490  -8.305   0.084
  489   1HB   PHE  66          2HB       PHE  66  -6.323  -8.197   1.829
  490   2HB   PHE  66          3HB       PHE  66  -5.500  -9.727   1.648
  491    HD1  PHE  66           1HD      PHE  66  -5.591  -6.633   3.844
  492    HD2  PHE  66           2HD      PHE  66  -4.505 -10.798   3.523
  493    HE1  PHE  66           1HE      PHE  66  -5.404  -6.777   6.292
  494    HE2  PHE  66           2HE      PHE  66  -4.321 -10.925   5.985
  495    HZ   PHE  66           HZ       PHE  66  -4.769  -8.913   7.380
  496    H    PHE  67           H        PHE  67  -2.349  -6.356   0.610
  497    HA   PHE  67           HA       PHE  67  -3.305  -4.137   2.089
  498   1HB   PHE  67          2HB       PHE  67  -0.967  -4.459   1.568
  499   2HB   PHE  67          3HB       PHE  67  -1.257  -4.280  -0.145
  500    HD1  PHE  67           1HD      PHE  67  -2.042  -2.227   2.934
  501    HD2  PHE  67           2HD      PHE  67   0.061  -2.456  -0.788
  502    HE1  PHE  67           1HE      PHE  67  -1.843   0.247   2.914
  503    HE2  PHE  67           2HE      PHE  67   0.487  -0.016  -0.697
  504    HZ   PHE  67           HZ       PHE  67  -0.538   1.359   1.107
  505    H    LEU  68           H        LEU  68  -3.137  -4.470  -1.530
  506    HA   LEU  68           HA       LEU  68  -5.202  -2.463  -1.895
  507   1HB   LEU  68          2HB       LEU  68  -3.681  -4.341  -3.701
  508   2HB   LEU  68          3HB       LEU  68  -4.950  -3.252  -4.279
  509    HG   LEU  68           HG       LEU  68  -3.749  -1.334  -3.966
  510   1HD1  LEU  68          1HD1      LEU  68  -1.834  -0.977  -2.570
  511   2HD1  LEU  68          2HD1      LEU  68  -3.107  -1.628  -1.597
  512   3HD1  LEU  68          3HD1      LEU  68  -1.784  -2.695  -2.139
  513   1HD2  LEU  68          1HD2      LEU  68  -2.785  -3.126  -5.622
  514   2HD2  LEU  68          2HD2      LEU  68  -1.822  -1.703  -5.292
  515   3HD2  LEU  68          3HD2      LEU  68  -1.438  -3.228  -4.474
  516    H    GLN  69           H        GLN  69  -5.446  -5.851  -1.274
  517    HA   GLN  69           HA       GLN  69  -7.852  -6.399  -2.796
  518   1HB   GLN  69          2HB       GLN  69  -6.691  -7.672  -0.307
  519   2HB   GLN  69          3HB       GLN  69  -8.056  -8.346  -1.182
  520   1HG   GLN  69          2HG       GLN  69  -5.437  -7.883  -2.611
  521   2HG   GLN  69          3HG       GLN  69  -5.722  -9.334  -1.629
  522   1HE2  GLN  69          1HE2      GLN  69  -5.778  -8.271  -4.805
  523   2HE2  GLN  69          2HE2      GLN  69  -7.038  -9.337  -5.356
  524    H    LYS  70           H        LYS  70  -7.617  -4.007  -0.589
  525    HA   LYS  70           HA       LYS  70 -10.404  -4.373   0.438
  526   1HB   LYS  70          2HB       LYS  70  -8.018  -2.783   1.382
  527   2HB   LYS  70          3HB       LYS  70  -9.645  -2.140   1.632
  528   1HG   LYS  70          2HG       LYS  70  -9.145  -3.252   3.618
  529   2HG   LYS  70          3HG       LYS  70 -10.319  -4.241   2.785
  530   1HD   LYS  70          2HD       LYS  70  -7.691  -5.170   1.971
  531   2HD   LYS  70          3HD       LYS  70  -7.589  -4.834   3.685
  532   1HE   LYS  70          2HE       LYS  70  -8.194  -7.152   3.394
  533   2HE   LYS  70          3HE       LYS  70  -9.557  -6.292   4.121
  534   1HZ   LYS  70          1HZ       LYS  70 -10.620  -6.254   1.974
  535   2HZ   LYS  70          2HZ       LYS  70  -9.360  -6.926   1.220
  536   3HZ   LYS  70          3HZ       LYS  70 -10.206  -7.804   2.323
  537    H    PHE  71           H        PHE  71  -8.346  -2.677  -1.879
  538    HA   PHE  71           HA       PHE  71 -10.452  -0.672  -2.384
  539   1HB   PHE  71          2HB       PHE  71  -8.948   0.548  -3.452
  540   2HB   PHE  71          3HB       PHE  71  -7.796  -0.395  -2.541
  541    HD1  PHE  71           1HD      PHE  71  -9.663  -0.497  -5.854
  542    HD2  PHE  71           2HD      PHE  71  -5.926  -0.976  -3.778
  543    HE1  PHE  71           1HE      PHE  71  -8.525  -0.992  -8.004
  544    HE2  PHE  71           2HE      PHE  71  -4.780  -1.367  -5.971
  545    HZ   PHE  71           HZ       PHE  71  -6.107  -1.446  -8.061
  546    H    GLU  72           H        GLU  72  -8.825  -3.495  -3.853
  547    HA   GLU  72           HA       GLU  72 -11.113  -3.768  -5.774
  548   1HB   GLU  72          2HB       GLU  72  -8.361  -3.372  -6.315
  549   2HB   GLU  72          3HB       GLU  72  -8.580  -5.089  -6.483
  550   1HG   GLU  72          2HG       GLU  72 -10.632  -4.520  -7.995
  551   2HG   GLU  72          3HG       GLU  72  -9.998  -2.871  -8.002
  552    H    SER  73           H        SER  73 -11.133  -6.028  -6.681
  553    HA   SER  73           HA       SER  73 -10.805  -8.134  -4.602
  554   1HB   SER  73          2HB       SER  73 -12.092  -8.348  -7.350
  555   2HB   SER  73          3HB       SER  73 -12.232  -9.465  -5.979
  556    HG   SER  73           HG       SER  73 -13.146  -7.523  -4.853
  557    H    GLY  74           H        GLY  74  -9.343  -6.860  -7.609
  558   1HA   GLY  74          1HA       GLY  74  -8.009  -9.484  -8.159
  559   2HA   GLY  74          2HA       GLY  74  -8.494  -8.260  -9.335
  560    H    ALA  75           H        ALA  75  -7.239  -6.889  -6.453
  561    HA   ALA  75           HA       ALA  75  -5.062  -5.725  -7.914
  562   1HB   ALA  75          1HB       ALA  75  -5.590  -5.723  -4.914
  563   2HB   ALA  75          2HB       ALA  75  -4.506  -4.659  -5.852
  564   3HB   ALA  75          3HB       ALA  75  -6.261  -4.549  -6.082
  565    H    ARG  76           H        ARG  76  -2.815  -5.783  -7.245
  566    HA   ARG  76           HA       ARG  76  -2.050  -8.402  -7.783
  567   1HB   ARG  76          2HB       ARG  76  -1.053  -6.039  -8.487
  568   2HB   ARG  76          3HB       ARG  76  -0.059  -6.245  -7.046
  569   1HG   ARG  76          2HG       ARG  76   1.313  -7.459  -8.331
  570   2HG   ARG  76          3HG       ARG  76   0.161  -8.743  -8.196
  571   1HD   ARG  76          2HD       ARG  76   0.119  -8.751 -10.440
  572   2HD   ARG  76          3HD       ARG  76  -1.088  -7.493 -10.262
  573    HE   ARG  76           HE       ARG  76   1.863  -7.156 -10.802
  574   1HH1  ARG  76          2HH2      ARG  76  -1.283  -5.414 -10.884
  575   2HH1  ARG  76          1HH2      ARG  76  -0.458  -4.014 -11.584
  576   1HH2  ARG  76          2HH1      ARG  76   2.702  -5.430 -11.567
  577   2HH2  ARG  76          1HH1      ARG  76   1.715  -4.005 -12.002
  578    H    GLU  77           H        GLU  77  -2.913  -8.002  -4.823
  579    HA   GLU  77           HA       GLU  77  -0.635  -8.095  -3.182
  580   1HB   GLU  77          2HB       GLU  77  -3.402  -9.264  -2.690
  581   2HB   GLU  77          3HB       GLU  77  -2.144  -8.966  -1.477
  582   1HG   GLU  77          2HG       GLU  77  -3.358  -6.761  -3.223
  583   2HG   GLU  77          3HG       GLU  77  -3.777  -7.085  -1.542
  584    H    LEU  78           H        LEU  78  -2.404 -10.597  -4.762
  585    HA   LEU  78           HA       LEU  78  -1.225 -12.896  -3.744
  586   1HB   LEU  78          2HB       LEU  78  -1.753 -12.740  -6.711
  587   2HB   LEU  78          3HB       LEU  78  -1.961 -14.075  -5.587
  588    HG   LEU  78           HG       LEU  78  -4.114 -13.542  -6.034
  589   1HD1  LEU  78          1HD1      LEU  78  -3.743 -13.345  -3.553
  590   2HD1  LEU  78          2HD1      LEU  78  -3.875 -11.582  -3.733
  591   3HD1  LEU  78          3HD1      LEU  78  -5.221 -12.612  -4.199
  592   1HD2  LEU  78          1HD2      LEU  78  -4.034 -11.823  -7.530
  593   2HD2  LEU  78          2HD2      LEU  78  -4.923 -11.074  -6.197
  594   3HD2  LEU  78          3HD2      LEU  78  -3.199 -10.701  -6.464
  595    H    THR  79           H        THR  79   0.270 -10.566  -6.059
  596    HA   THR  79           HA       THR  79   2.367 -12.476  -6.760
  597    HB   THR  79           HB       THR  79   2.312  -9.496  -7.316
  598    HG1  THR  79           1HG      THR  79   1.989 -10.745  -9.440
  599   1HG2  THR  79          1HG2      THR  79   3.974 -10.199  -9.082
  600   2HG2  THR  79          2HG2      THR  79   4.582 -10.549  -7.465
  601   3HG2  THR  79          3HG2      THR  79   3.918 -11.851  -8.460
  602    H    GLU  80           H        GLU  80   3.622 -13.037  -5.202
  603    HA   GLU  80           HA       GLU  80   4.132 -11.643  -2.824
  604   1HB   GLU  80          2HB       GLU  80   5.922 -13.166  -2.361
  605   2HB   GLU  80          3HB       GLU  80   4.512 -14.024  -2.977
  606   1HG   GLU  80          2HG       GLU  80   5.588 -14.380  -5.140
  607   2HG   GLU  80          3HG       GLU  80   6.965 -13.355  -4.681
  608    H    SER  81           H        SER  81   6.023 -11.608  -5.842
  609    HA   SER  81           HA       SER  81   8.203 -10.088  -4.868
  610   1HB   SER  81          2HB       SER  81   7.092 -10.404  -7.668
  611   2HB   SER  81          3HB       SER  81   8.612  -9.579  -7.296
  612    HG   SER  81           HG       SER  81   7.933 -12.299  -6.851
  613    H    GLU  82           H        GLU  82   5.274  -8.844  -6.669
  614    HA   GLU  82           HA       GLU  82   6.002  -6.116  -6.384
  615   1HB   GLU  82          2HB       GLU  82   3.179  -7.288  -6.532
  616   2HB   GLU  82          3HB       GLU  82   3.680  -5.609  -6.778
  617   1HG   GLU  82          2HG       GLU  82   5.338  -6.612  -8.539
  618   2HG   GLU  82          3HG       GLU  82   4.274  -8.040  -8.499
  619    H    THR  83           H        THR  83   3.963  -8.242  -4.316
  620    HA   THR  83           HA       THR  83   3.322  -6.416  -2.414
  621    HB   THR  83           HB       THR  83   3.649  -9.364  -2.479
  622    HG1  THR  83           1HG      THR  83   1.753  -8.184  -0.936
  623   1HG2  THR  83          1HG2      THR  83   3.221  -9.652  -0.035
  624   2HG2  THR  83          2HG2      THR  83   4.880  -9.199  -0.405
  625   3HG2  THR  83          3HG2      THR  83   3.755  -7.979   0.217
  626    H    LYS  84           H        LYS  84   6.273  -8.420  -2.622
  627    HA   LYS  84           HA       LYS  84   7.574  -7.449  -0.294
  628   1HB   LYS  84          2HB       LYS  84   8.499  -9.027  -2.700
  629   2HB   LYS  84          3HB       LYS  84   9.615  -8.545  -1.416
  630   1HG   LYS  84          2HG       LYS  84   8.435  -9.723   0.267
  631   2HG   LYS  84          3HG       LYS  84   7.022  -9.980  -0.764
  632   1HD   LYS  84          2HD       LYS  84   8.305 -11.477  -2.227
  633   2HD   LYS  84          3HD       LYS  84   9.760 -11.219  -1.239
  634   1HE   LYS  84          2HE       LYS  84   8.588 -12.169   0.748
  635   2HE   LYS  84          3HE       LYS  84   7.106 -12.361  -0.195
  636   1HZ   LYS  84          1HZ       LYS  84   8.238 -13.964  -1.584
  637   2HZ   LYS  84          2HZ       LYS  84   9.631 -13.782  -0.748
  638   3HZ   LYS  84          3HZ       LYS  84   8.292 -14.411  -0.024
  639    H    SER  85           H        SER  85   7.545  -6.245  -3.635
  640    HA   SER  85           HA       SER  85   9.682  -4.394  -3.365
  641   1HB   SER  85          2HB       SER  85   8.303  -5.055  -5.464
  642   2HB   SER  85          3HB       SER  85   7.156  -3.801  -4.952
  643    HG   SER  85           HG       SER  85   8.771  -3.029  -6.382
  644    H    LEU  86           H        LEU  86   6.170  -4.119  -2.581
  645    HA   LEU  86           HA       LEU  86   6.465  -1.466  -1.436
  646   1HB   LEU  86          2HB       LEU  86   4.285  -3.501  -1.570
  647   2HB   LEU  86          3HB       LEU  86   4.239  -2.400  -0.195
  648    HG   LEU  86           HG       LEU  86   2.943  -1.628  -2.184
  649   1HD1  LEU  86          1HD1      LEU  86   5.158   0.288  -1.340
  650   2HD1  LEU  86          2HD1      LEU  86   3.572   0.698  -2.004
  651   3HD1  LEU  86          3HD1      LEU  86   3.689  -0.080  -0.421
  652   1HD2  LEU  86          1HD2      LEU  86   5.701  -1.350  -3.488
  653   2HD2  LEU  86          2HD2      LEU  86   4.321  -2.319  -4.030
  654   3HD2  LEU  86          3HD2      LEU  86   4.268  -0.548  -4.065
  655    H    MET  87           H        MET  87   6.257  -4.708   0.129
  656    HA   MET  87           HA       MET  87   6.824  -3.951   2.682
  657   1HB   MET  87          2HB       MET  87   6.632  -6.335   1.753
  658   2HB   MET  87          3HB       MET  87   8.361  -6.220   1.383
  659   1HG   MET  87          2HG       MET  87   8.702  -5.611   3.868
  660   2HG   MET  87          3HG       MET  87   7.037  -6.151   4.099
  661   1HE   MET  87          1HE       MET  87   7.318  -9.922   3.051
  662   2HE   MET  87          2HE       MET  87   6.241  -8.548   3.440
  663   3HE   MET  87          3HE       MET  87   7.073  -8.615   1.874
  664    H    ALA  88           H        ALA  88   9.263  -4.387   0.128
  665    HA   ALA  88           HA       ALA  88  11.582  -4.218   1.582
  666   1HB   ALA  88          1HB       ALA  88  11.042  -3.378  -1.302
  667   2HB   ALA  88          2HB       ALA  88  12.659  -3.611  -0.602
  668   3HB   ALA  88          3HB       ALA  88  11.535  -4.975  -0.727
  669    H    ALA  89           H        ALA  89   9.835  -1.474   0.062
  670    HA   ALA  89           HA       ALA  89  11.821   0.432   1.163
  671   1HB   ALA  89          1HB       ALA  89   9.309   0.874  -0.449
  672   2HB   ALA  89          2HB       ALA  89  10.476   2.131   0.017
  673   3HB   ALA  89          3HB       ALA  89  10.990   0.825  -1.062
  674    H    ALA  90           H        ALA  90   8.380  -0.509   1.743
  675    HA   ALA  90           HA       ALA  90   7.802   1.597   3.631
  676   1HB   ALA  90          1HB       ALA  90   6.064   0.154   2.594
  677   2HB   ALA  90          2HB       ALA  90   6.751  -1.256   3.446
  678   3HB   ALA  90          3HB       ALA  90   6.021   0.068   4.376
  679    H    ASP  91           H        ASP  91   9.330  -1.630   4.019
  680    HA   ASP  91           HA       ASP  91   9.438  -1.388   6.873
  681   1HB   ASP  91          2HB       ASP  91   9.712  -3.612   5.916
  682   2HB   ASP  91          3HB       ASP  91  11.086  -3.057   4.935
  683    H    ASN  92           H        ASN  92  10.597   0.175   7.885
  684    HA   ASN  92           HA       ASN  92  12.882   1.440   6.398
  685   1HB   ASN  92          2HB       ASN  92  11.410   2.385   8.869
  686   2HB   ASN  92          3HB       ASN  92  12.719   3.235   8.032
  687   1HD2  ASN  92          1HD2      ASN  92   9.462   3.327   8.356
  688   2HD2  ASN  92          2HD2      ASN  92   8.957   3.790   6.746
  689    H    ASP  93           H        ASP  93  12.593  -1.244   8.297
  690    HA   ASP  93           HA       ASP  93  14.937  -0.608  10.032
  691   1HB   ASP  93          2HB       ASP  93  13.133  -3.053   9.990
  692   2HB   ASP  93          3HB       ASP  93  14.454  -2.736  11.109
  693    H    GLY  94           H        GLY  94  13.766  -3.167   7.746
  694   1HA   GLY  94          1HA       GLY  94  15.197  -4.536   6.386
  695   2HA   GLY  94          2HA       GLY  94  16.564  -4.180   7.453
  696    H    ASP  95           H        ASP  95  13.151  -5.085   7.949
  697    HA   ASP  95           HA       ASP  95  13.902  -7.595   9.301
  698   1HB   ASP  95          2HB       ASP  95  12.529  -7.299  11.164
  699   2HB   ASP  95          3HB       ASP  95  13.663  -5.955  11.118
  700    H    GLY  96           H        GLY  96  11.160  -5.584   8.258
  701   1HA   GLY  96          1HA       GLY  96  10.208  -6.388   6.071
  702   2HA   GLY  96          2HA       GLY  96  10.004  -7.983   6.808
  703    H    LYS  97           H        LYS  97   9.062  -7.327   9.345
  704    HA   LYS  97           HA       LYS  97   6.334  -6.656   8.962
  705   1HB   LYS  97          2HB       LYS  97   6.173  -6.564  11.379
  706   2HB   LYS  97          3HB       LYS  97   7.161  -7.941  10.879
  707   1HG   LYS  97          2HG       LYS  97   9.196  -6.519  11.303
  708   2HG   LYS  97          3HG       LYS  97   8.160  -5.287  12.013
  709   1HD   LYS  97          2HD       LYS  97   8.474  -6.344  13.985
  710   2HD   LYS  97          3HD       LYS  97   7.313  -7.527  13.381
  711   1HE   LYS  97          2HE       LYS  97   9.184  -8.843  14.056
  712   2HE   LYS  97          3HE       LYS  97   9.346  -8.729  12.299
  713   1HZ   LYS  97          1HZ       LYS  97  10.856  -6.780  12.778
  714   2HZ   LYS  97          2HZ       LYS  97  10.842  -7.209  14.343
  715   3HZ   LYS  97          3HZ       LYS  97  11.449  -8.249  13.218
  716    H    ILE  98           H        ILE  98   5.224  -4.749   9.008
  717    HA   ILE  98           HA       ILE  98   6.791  -2.200   9.099
  718    HB   ILE  98           HB       ILE  98   4.728  -3.269   7.180
  719   1HG1  ILE  98          2HG1      ILE  98   7.251  -1.856   6.390
  720   2HG1  ILE  98          3HG1      ILE  98   7.483  -3.430   7.121
  721   1HG2  ILE  98          1HG2      ILE  98   5.774  -0.406   7.357
  722   2HG2  ILE  98          2HG2      ILE  98   4.806  -1.092   6.055
  723   3HG2  ILE  98          3HG2      ILE  98   4.106  -0.922   7.675
  724   1HD1  ILE  98          1HD1      ILE  98   5.730  -2.881   4.703
  725   2HD1  ILE  98          2HD1      ILE  98   7.352  -3.630   4.749
  726   3HD1  ILE  98          3HD1      ILE  98   5.963  -4.462   5.484
  727    H    GLY  99           H        GLY  99   6.170  -1.067  10.835
  728   1HA   GLY  99          1HA       GLY  99   3.539  -1.363  12.061
  729   2HA   GLY  99          2HA       GLY  99   4.752  -0.136  12.426
  730    H    ALA 100           H        ALA 100   1.961   0.434  12.182
  731    HA   ALA 100           HA       ALA 100   1.272   1.599   9.647
  732   1HB   ALA 100          1HB       ALA 100  -0.407   1.238  11.389
  733   2HB   ALA 100          2HB       ALA 100   0.424   2.396  12.460
  734   3HB   ALA 100          3HB       ALA 100  -0.314   2.954  10.941
  735    H    GLU 101           H        GLU 101   3.148   2.713  12.478
  736    HA   GLU 101           HA       GLU 101   3.840   5.278  11.689
  737   1HB   GLU 101          2HB       GLU 101   5.952   4.857  12.956
  738   2HB   GLU 101          3HB       GLU 101   4.432   4.576  13.804
  739   1HG   GLU 101          2HG       GLU 101   5.048   2.066  12.678
  740   2HG   GLU 101          3HG       GLU 101   6.598   2.703  13.228
  741    H    GLU 102           H        GLU 102   5.977   2.442  11.044
  742    HA   GLU 102           HA       GLU 102   7.657   3.500   9.226
  743   1HB   GLU 102          2HB       GLU 102   6.395   0.728   9.111
  744   2HB   GLU 102          3HB       GLU 102   7.838   1.221   8.216
  745   1HG   GLU 102          2HG       GLU 102   8.949   1.709  10.430
  746   2HG   GLU 102          3HG       GLU 102   7.560   0.965  11.239
  747    H    PHE 103           H        PHE 103   4.437   2.168   8.421
  748    HA   PHE 103           HA       PHE 103   4.743   2.655   5.616
  749   1HB   PHE 103          2HB       PHE 103   2.676   1.626   7.421
  750   2HB   PHE 103          3HB       PHE 103   1.965   2.635   6.206
  751    HD1  PHE 103           1HD      PHE 103   3.689   2.011   3.776
  752    HD2  PHE 103           2HD      PHE 103   1.921  -0.516   6.789
  753    HE1  PHE 103           1HE      PHE 103   3.538   0.159   2.150
  754    HE2  PHE 103           2HE      PHE 103   1.785  -2.366   5.153
  755    HZ   PHE 103           HZ       PHE 103   2.563  -2.025   2.823
  756    H    GLN 104           H        GLN 104   3.074   4.576   8.147
  757    HA   GLN 104           HA       GLN 104   2.158   6.701   6.393
  758   1HB   GLN 104          2HB       GLN 104   1.198   6.148   8.584
  759   2HB   GLN 104          3HB       GLN 104   2.668   6.691   9.395
  760   1HG   GLN 104          2HG       GLN 104   1.377   8.635   7.479
  761   2HG   GLN 104          3HG       GLN 104   0.442   8.222   8.910
  762   1HE2  GLN 104          1HE2      GLN 104   2.338  10.636   7.881
  763   2HE2  GLN 104          2HE2      GLN 104   3.079  11.079   9.403
  764    H    GLU 105           H        GLU 105   5.234   6.112   8.152
  765    HA   GLU 105           HA       GLU 105   6.475   8.617   7.555
  766   1HB   GLU 105          2HB       GLU 105   7.534   5.783   7.931
  767   2HB   GLU 105          3HB       GLU 105   8.599   7.146   7.650
  768   1HG   GLU 105          2HG       GLU 105   8.042   8.205   9.668
  769   2HG   GLU 105          3HG       GLU 105   6.526   7.313   9.854
  770    H    MET 106           H        MET 106   6.640   5.451   5.829
  771    HA   MET 106           HA       MET 106   8.249   6.337   3.743
  772   1HB   MET 106          2HB       MET 106   7.719   3.966   4.253
  773   2HB   MET 106          3HB       MET 106   6.078   4.201   3.638
  774   1HG   MET 106          2HG       MET 106   7.346   3.105   1.971
  775   2HG   MET 106          3HG       MET 106   7.056   4.720   1.360
  776   1HE   MET 106          1HE       MET 106  10.574   6.075   0.790
  777   2HE   MET 106          2HE       MET 106   8.891   6.013   0.219
  778   3HE   MET 106          3HE       MET 106   9.274   6.689   1.819
  779    H    VAL 107           H        VAL 107   4.704   6.267   3.998
  780    HA   VAL 107           HA       VAL 107   4.260   7.430   1.389
  781    HB   VAL 107           HB       VAL 107   2.515   6.930   3.822
  782   1HG1  VAL 107          1HG1      VAL 107   0.587   7.484   2.386
  783   2HG1  VAL 107          2HG1      VAL 107   1.566   8.910   2.718
  784   3HG1  VAL 107          3HG1      VAL 107   1.699   8.099   1.145
  785   1HG2  VAL 107          1HG2      VAL 107   2.746   5.739   1.016
  786   2HG2  VAL 107          2HG2      VAL 107   3.200   4.957   2.542
  787   3HG2  VAL 107          3HG2      VAL 107   1.490   5.309   2.181
  788    H    HIS 108           H        HIS 108   3.764   8.880   4.701
  789    HA   HIS 108           HA       HIS 108   2.937  11.288   3.570
  790   1HB   HIS 108          2HB       HIS 108   2.628  10.500   5.927
  791   2HB   HIS 108          3HB       HIS 108   4.280  11.029   6.287
  792    HD1  HIS 108           1HD      HIS 108   1.473  12.902   4.330
  793    HD2  HIS 108           2HD      HIS 108   3.952  13.209   7.722
  794    HE1  HIS 108           1HE      HIS 108   1.010  15.186   5.375
  795    H    SER 109           H        SER 109   6.115  10.105   4.463
  796    HA   SER 109           HA       SER 109   8.175  10.741   4.132
  797   1HB   SER 109          2HB       SER 109   8.712  11.535   1.854
  798   2HB   SER 109          3HB       SER 109   7.555  10.189   1.891
  799    HG   SER 109           HG       SER 109   6.267  12.558   1.931
  Start of MODEL    6
    1   1H    MET   1           H1       MET   1 -16.154   0.079   2.544
    2   2H    MET   1           H2       MET   1 -17.062  -0.009   1.149
    3   3H    MET   1           H3       MET   1 -15.460   0.428   1.098
    4    HA   MET   1           HA       MET   1 -16.695   2.422   0.914
    5   1HB   MET   1          2HB       MET   1 -18.153   1.310   3.337
    6   2HB   MET   1          3HB       MET   1 -18.235   3.009   2.858
    7   1HG   MET   1          2HG       MET   1 -20.175   1.830   1.983
    8   2HG   MET   1          3HG       MET   1 -19.156   2.433   0.683
    9   1HE   MET   1          1HE       MET   1 -18.572   1.084  -1.316
   10   2HE   MET   1          2HE       MET   1 -19.412  -0.458  -1.581
   11   3HE   MET   1          3HE       MET   1 -20.343   0.991  -1.141
   12    H    SER   2           H        SER   2 -15.527   4.164   1.696
   13    HA   SER   2           HA       SER   2 -14.568   5.192   3.792
   14   1HB   SER   2          2HB       SER   2 -12.819   2.691   3.585
   15   2HB   SER   2          3HB       SER   2 -12.282   4.210   4.326
   16    HG   SER   2           HG       SER   2 -14.528   2.684   5.096
   17    H    ILE   3           H        ILE   3 -12.242   3.485   1.648
   18    HA   ILE   3           HA       ILE   3 -11.221   6.108   0.937
   19    HB   ILE   3           HB       ILE   3  -9.332   5.076   0.177
   20   1HG1  ILE   3          2HG1      ILE   3 -10.297   2.239   0.273
   21   2HG1  ILE   3          3HG1      ILE   3 -10.441   3.195  -1.213
   22   1HG2  ILE   3          1HG2      ILE   3 -10.296   3.241   2.414
   23   2HG2  ILE   3          2HG2      ILE   3  -8.655   3.833   2.142
   24   3HG2  ILE   3          3HG2      ILE   3  -9.924   4.956   2.655
   25   1HD1  ILE   3          1HD1      ILE   3  -8.083   3.712  -1.249
   26   2HD1  ILE   3          2HD1      ILE   3  -7.814   2.936   0.323
   27   3HD1  ILE   3          3HD1      ILE   3  -8.250   1.968  -1.072
   28    H    THR   4           H        THR   4 -13.270   3.750  -0.664
   29    HA   THR   4           HA       THR   4 -12.851   4.232  -3.247
   30    HB   THR   4           HB       THR   4 -14.151   2.424  -2.109
   31    HG1  THR   4           1HG      THR   4 -14.609   3.781  -4.218
   32   1HG2  THR   4          1HG2      THR   4 -15.483   3.875  -0.506
   33   2HG2  THR   4          2HG2      THR   4 -16.431   4.445  -1.896
   34   3HG2  THR   4          3HG2      THR   4 -16.459   2.733  -1.463
   35    H    ASP   5           H        ASP   5 -14.668   6.235  -0.936
   36    HA   ASP   5           HA       ASP   5 -15.468   8.035  -3.163
   37   1HB   ASP   5          2HB       ASP   5 -17.322   6.869  -1.959
   38   2HB   ASP   5          3HB       ASP   5 -16.796   7.647  -0.451
   39    H    VAL   6           H        VAL   6 -12.911   8.131  -2.187
   40    HA   VAL   6           HA       VAL   6 -12.855  10.812  -0.810
   41    HB   VAL   6           HB       VAL   6 -10.879   8.497  -0.699
   42   1HG1  VAL   6          1HG1      VAL   6  -9.553  10.552  -0.831
   43   2HG1  VAL   6          2HG1      VAL   6 -10.574  11.318   0.406
   44   3HG1  VAL   6          3HG1      VAL   6  -9.544   9.931   0.820
   45   1HG2  VAL   6          1HG2      VAL   6 -12.893   8.410   0.801
   46   2HG2  VAL   6          2HG2      VAL   6 -11.368   8.537   1.693
   47   3HG2  VAL   6          3HG2      VAL   6 -12.412   9.962   1.495
   48    H    LEU   7           H        LEU   7 -10.829   8.803  -2.940
   49    HA   LEU   7           HA       LEU   7 -10.620  10.741  -5.069
   50   1HB   LEU   7          2HB       LEU   7  -9.246  11.965  -3.418
   51   2HB   LEU   7          3HB       LEU   7  -8.348  10.503  -3.045
   52    HG   LEU   7           HG       LEU   7  -7.977  10.777  -5.828
   53   1HD1  LEU   7          1HD1      LEU   7  -7.771  13.522  -4.535
   54   2HD1  LEU   7          2HD1      LEU   7  -7.232  13.067  -6.164
   55   3HD1  LEU   7          3HD1      LEU   7  -8.960  13.037  -5.767
   56   1HD2  LEU   7          1HD2      LEU   7  -6.189  11.771  -3.575
   57   2HD2  LEU   7          2HD2      LEU   7  -6.297  10.091  -4.145
   58   3HD2  LEU   7          3HD2      LEU   7  -5.686  11.353  -5.225
   59    H    SER   8           H        SER   8  -8.767   8.352  -3.203
   60    HA   SER   8           HA       SER   8  -7.142   7.122  -4.669
   61   1HB   SER   8          2HB       SER   8  -9.065   5.530  -2.980
   62   2HB   SER   8          3HB       SER   8  -7.315   5.292  -3.228
   63    HG   SER   8           HG       SER   8  -7.624   6.422  -1.286
   64    H    ALA   9           H        ALA   9 -10.560   6.680  -5.401
   65    HA   ALA   9           HA       ALA   9 -10.504   4.273  -6.927
   66   1HB   ALA   9          1HB       ALA   9 -12.143   6.815  -7.303
   67   2HB   ALA   9          2HB       ALA   9 -12.502   5.223  -8.009
   68   3HB   ALA   9          3HB       ALA   9 -12.578   5.453  -6.250
   69    H    ASP  10           H        ASP  10  -9.798   7.678  -7.858
   70    HA   ASP  10           HA       ASP  10  -9.390   7.040 -10.653
   71   1HB   ASP  10          2HB       ASP  10  -9.892   9.321  -9.707
   72   2HB   ASP  10          3HB       ASP  10  -8.252   9.359  -9.031
   73    H    ASP  11           H        ASP  11  -7.317   7.284  -7.764
   74    HA   ASP  11           HA       ASP  11  -4.848   7.164  -9.107
   75   1HB   ASP  11          2HB       ASP  11  -5.412   6.390  -6.217
   76   2HB   ASP  11          3HB       ASP  11  -3.928   7.031  -6.946
   77    H    ILE  12           H        ILE  12  -6.878   4.592  -7.502
   78    HA   ILE  12           HA       ILE  12  -5.046   2.536  -8.095
   79    HB   ILE  12           HB       ILE  12  -6.781   1.033  -7.834
   80   1HG1  ILE  12          2HG1      ILE  12  -8.775   3.095  -7.090
   81   2HG1  ILE  12          3HG1      ILE  12  -8.706   2.424  -8.725
   82   1HG2  ILE  12          1HG2      ILE  12  -7.060   1.284  -5.445
   83   2HG2  ILE  12          2HG2      ILE  12  -5.486   1.927  -5.909
   84   3HG2  ILE  12          3HG2      ILE  12  -6.817   3.040  -5.563
   85   1HD1  ILE  12          1HD1      ILE  12  -9.128   0.740  -6.237
   86   2HD1  ILE  12          2HD1      ILE  12 -10.372   1.249  -7.392
   87   3HD1  ILE  12          3HD1      ILE  12  -9.063   0.173  -7.916
   88    H    ALA  13           H        ALA  13  -7.655   4.013 -10.061
   89    HA   ALA  13           HA       ALA  13  -7.540   2.110 -12.176
   90   1HB   ALA  13          1HB       ALA  13  -8.549   3.777 -13.578
   91   2HB   ALA  13          2HB       ALA  13  -9.280   3.885 -11.964
   92   3HB   ALA  13          3HB       ALA  13  -8.085   5.090 -12.491
   93    H    ALA  14           H        ALA  14  -5.603   5.092 -11.597
   94    HA   ALA  14           HA       ALA  14  -3.895   4.793 -13.870
   95   1HB   ALA  14          1HB       ALA  14  -3.202   5.987 -11.150
   96   2HB   ALA  14          2HB       ALA  14  -2.325   6.225 -12.668
   97   3HB   ALA  14          3HB       ALA  14  -3.982   6.841 -12.494
   98    H    ALA  15           H        ALA  15  -3.401   3.703 -10.486
   99    HA   ALA  15           HA       ALA  15  -0.912   2.492 -10.785
  100   1HB   ALA  15          1HB       ALA  15  -2.186   2.972  -8.610
  101   2HB   ALA  15          2HB       ALA  15  -3.115   1.495  -8.930
  102   3HB   ALA  15          3HB       ALA  15  -1.360   1.411  -8.700
  103    H    LEU  16           H        LEU  16  -4.120   1.090 -11.217
  104    HA   LEU  16           HA       LEU  16  -3.505  -1.587 -11.668
  105   1HB   LEU  16          2HB       LEU  16  -5.729  -0.957 -11.371
  106   2HB   LEU  16          3HB       LEU  16  -5.701   0.260 -12.639
  107    HG   LEU  16           HG       LEU  16  -5.273  -2.597 -13.486
  108   1HD1  LEU  16          1HD1      LEU  16  -7.132  -2.803 -11.915
  109   2HD1  LEU  16          2HD1      LEU  16  -7.967  -1.431 -12.680
  110   3HD1  LEU  16          3HD1      LEU  16  -7.723  -2.946 -13.578
  111   1HD2  LEU  16          1HD2      LEU  16  -5.260  -0.724 -15.181
  112   2HD2  LEU  16          2HD2      LEU  16  -6.625  -1.813 -15.425
  113   3HD2  LEU  16          3HD2      LEU  16  -6.873  -0.246 -14.635
  114    H    GLN  17           H        GLN  17  -3.211   1.200 -13.888
  115    HA   GLN  17           HA       GLN  17  -2.581  -0.635 -16.111
  116   1HB   GLN  17          2HB       GLN  17  -4.105   1.367 -16.322
  117   2HB   GLN  17          3HB       GLN  17  -2.659   2.388 -16.232
  118   1HG   GLN  17          2HG       GLN  17  -1.714   1.297 -18.213
  119   2HG   GLN  17          3HG       GLN  17  -2.998   0.080 -18.219
  120   1HE2  GLN  17          1HE2      GLN  17  -5.340   1.090 -18.260
  121   2HE2  GLN  17          2HE2      GLN  17  -5.524   2.343 -19.476
  122    H    GLU  18           H        GLU  18  -0.994   1.892 -14.106
  123    HA   GLU  18           HA       GLU  18   1.433   1.774 -15.626
  124   1HB   GLU  18          2HB       GLU  18   2.123   3.511 -14.416
  125   2HB   GLU  18          3HB       GLU  18   0.414   3.616 -14.059
  126   1HG   GLU  18          2HG       GLU  18   1.192   3.900 -11.969
  127   2HG   GLU  18          3HG       GLU  18   1.090   2.141 -11.915
  128    H    CYS  19           H        CYS  19   0.296   0.043 -12.776
  129    HA   CYS  19           HA       CYS  19   2.772  -1.631 -12.741
  130   1HB   CYS  19          2HB       CYS  19   2.090  -0.413 -10.608
  131   2HB   CYS  19          3HB       CYS  19   0.624  -1.425 -10.599
  132    HG   CYS  19           HG       CYS  19   3.808  -2.210 -10.540
  133    H    ARG  20           H        ARG  20   1.271  -2.106 -14.878
  134    HA   ARG  20           HA       ARG  20  -0.666  -4.281 -14.298
  135   1HB   ARG  20          2HB       ARG  20  -1.187  -2.523 -15.865
  136   2HB   ARG  20          3HB       ARG  20   0.182  -2.941 -16.899
  137   1HG   ARG  20          2HG       ARG  20  -0.855  -4.839 -17.719
  138   2HG   ARG  20          3HG       ARG  20  -1.792  -5.128 -16.247
  139   1HD   ARG  20          2HD       ARG  20  -3.476  -3.681 -16.771
  140   2HD   ARG  20          3HD       ARG  20  -2.472  -2.584 -17.694
  141    HE   ARG  20           HE       ARG  20  -3.960  -4.859 -18.693
  142   1HH1  ARG  20          2HH2      ARG  20  -1.055  -2.957 -19.220
  143   2HH1  ARG  20          1HH2      ARG  20  -1.096  -3.008 -20.954
  144   1HH2  ARG  20          2HH1      ARG  20  -4.066  -5.008 -21.020
  145   2HH2  ARG  20          1HH1      ARG  20  -2.850  -4.253 -22.000
  146    H    ASP  21           H        ASP  21   2.381  -3.691 -16.102
  147    HA   ASP  21           HA       ASP  21   2.935  -6.303 -16.866
  148   1HB   ASP  21          2HB       ASP  21   4.940  -4.142 -16.157
  149   2HB   ASP  21          3HB       ASP  21   5.144  -5.405 -17.371
  150    HA   PRO  22           HA       PRO  22   4.046  -8.200 -13.084
  151   1HB   PRO  22          2HB       PRO  22   5.918 -10.100 -13.746
  152   2HB   PRO  22          3HB       PRO  22   4.198 -10.207 -14.227
  153   1HG   PRO  22          2HG       PRO  22   6.505  -9.114 -15.863
  154   2HG   PRO  22          3HG       PRO  22   5.287 -10.320 -16.375
  155   1HD   PRO  22          2HD       PRO  22   5.022  -7.695 -17.005
  156   2HD   PRO  22          3HD       PRO  22   3.586  -8.640 -16.509
  157    H    ASP  23           H        ASP  23   5.296  -7.812 -11.371
  158    HA   ASP  23           HA       ASP  23   6.916  -7.196 -10.034
  159   1HB   ASP  23          2HB       ASP  23   8.729  -8.179 -12.250
  160   2HB   ASP  23          3HB       ASP  23   9.272  -7.743 -10.633
  161    H    THR  24           H        THR  24   5.805  -5.163 -11.938
  162    HA   THR  24           HA       THR  24   7.996  -3.207 -12.263
  163    HB   THR  24           HB       THR  24   5.115  -3.387 -13.188
  164    HG1  THR  24           1HG      THR  24   6.379  -3.172 -15.183
  165   1HG2  THR  24          1HG2      THR  24   5.373  -1.005 -12.727
  166   2HG2  THR  24          2HG2      THR  24   6.968  -0.992 -13.516
  167   3HG2  THR  24          3HG2      THR  24   5.492  -1.286 -14.460
  168    H    PHE  25           H        PHE  25   5.727  -4.031  -9.846
  169    HA   PHE  25           HA       PHE  25   4.953  -1.555  -8.803
  170   1HB   PHE  25          2HB       PHE  25   4.300  -3.935  -8.161
  171   2HB   PHE  25          3HB       PHE  25   5.737  -3.972  -7.148
  172    HD1  PHE  25           1HD      PHE  25   5.925  -1.795  -5.460
  173    HD2  PHE  25           2HD      PHE  25   2.279  -3.374  -7.171
  174    HE1  PHE  25           1HE      PHE  25   4.597  -0.511  -3.841
  175    HE2  PHE  25           2HE      PHE  25   0.989  -2.317  -5.342
  176    HZ   PHE  25           HZ       PHE  25   2.118  -0.839  -3.721
  177    H    GLU  26           H        GLU  26   6.113   0.114  -8.107
  178    HA   GLU  26           HA       GLU  26   8.621  -0.316  -6.556
  179   1HB   GLU  26          2HB       GLU  26   8.053   1.568  -8.811
  180   2HB   GLU  26          3HB       GLU  26   8.691   2.333  -7.358
  181   1HG   GLU  26          2HG       GLU  26  10.535   0.461  -7.458
  182   2HG   GLU  26          3HG       GLU  26  10.046   0.372  -9.159
  183    HA   PRO  27           HA       PRO  27   6.486   1.523  -3.240
  184   1HB   PRO  27          2HB       PRO  27   8.433   2.853  -1.818
  185   2HB   PRO  27          3HB       PRO  27   8.282   1.084  -1.986
  186   1HG   PRO  27          2HG       PRO  27  10.098   2.919  -3.605
  187   2HG   PRO  27          3HG       PRO  27  10.533   1.408  -2.787
  188   1HD   PRO  27          2HD       PRO  27   9.938   1.475  -5.414
  189   2HD   PRO  27          3HD       PRO  27   9.447   0.090  -4.394
  190    H    GLN  28           H        GLN  28   8.728   4.284  -3.678
  191    HA   GLN  28           HA       GLN  28   6.880   6.285  -3.192
  192   1HB   GLN  28          2HB       GLN  28   9.409   6.278  -4.862
  193   2HB   GLN  28          3HB       GLN  28   8.523   7.759  -4.461
  194   1HG   GLN  28          2HG       GLN  28   8.867   7.481  -2.108
  195   2HG   GLN  28          3HG       GLN  28   9.416   5.814  -2.294
  196   1HE2  GLN  28          1HE2      GLN  28  10.416   9.191  -2.466
  197   2HE2  GLN  28          2HE2      GLN  28  12.110   8.828  -2.745
  198    H    LYS  29           H        LYS  29   7.786   4.952  -6.331
  199    HA   LYS  29           HA       LYS  29   6.160   6.206  -8.179
  200   1HB   LYS  29          2HB       LYS  29   7.754   4.286  -8.539
  201   2HB   LYS  29          3HB       LYS  29   6.603   3.235  -7.743
  202   1HG   LYS  29          2HG       LYS  29   6.128   2.717  -9.857
  203   2HG   LYS  29          3HG       LYS  29   4.912   3.940  -9.643
  204   1HD   LYS  29          2HD       LYS  29   7.645   4.807 -10.668
  205   2HD   LYS  29          3HD       LYS  29   6.693   3.728 -11.679
  206   1HE   LYS  29          2HE       LYS  29   4.831   5.722 -10.956
  207   2HE   LYS  29          3HE       LYS  29   6.342   6.615 -11.206
  208   1HZ   LYS  29          1HZ       LYS  29   5.013   4.737 -13.032
  209   2HZ   LYS  29          2HZ       LYS  29   5.079   6.356 -13.240
  210   3HZ   LYS  29          3HZ       LYS  29   6.460   5.451 -13.384
  211    H    PHE  30           H        PHE  30   5.144   3.256  -6.292
  212    HA   PHE  30           HA       PHE  30   2.454   3.518  -7.164
  213   1HB   PHE  30          2HB       PHE  30   3.635   1.419  -6.485
  214   2HB   PHE  30          3HB       PHE  30   3.474   1.914  -4.803
  215    HD1  PHE  30           1HD      PHE  30   1.899   0.446  -7.743
  216    HD2  PHE  30           2HD      PHE  30   1.075   2.154  -3.862
  217    HE1  PHE  30           1HE      PHE  30  -0.315  -0.649  -7.728
  218    HE2  PHE  30           2HE      PHE  30  -1.206   1.187  -3.935
  219    HZ   PHE  30           HZ       PHE  30  -1.894  -0.238  -5.854
  220    H    PHE  31           H        PHE  31   4.140   4.590  -4.176
  221    HA   PHE  31           HA       PHE  31   1.846   5.264  -2.665
  222   1HB   PHE  31          2HB       PHE  31   4.437   6.829  -2.690
  223   2HB   PHE  31          3HB       PHE  31   3.247   6.718  -1.393
  224    HD1  PHE  31           1HD      PHE  31   6.130   6.419  -0.956
  225    HD2  PHE  31           2HD      PHE  31   3.070   3.483  -1.760
  226    HE1  PHE  31           1HE      PHE  31   7.489   4.696   0.147
  227    HE2  PHE  31           2HE      PHE  31   4.391   1.797  -0.533
  228    HZ   PHE  31           HZ       PHE  31   6.613   2.378   0.412
  229    H    GLN  32           H        GLN  32   3.649   7.157  -5.155
  230    HA   GLN  32           HA       GLN  32   1.866   9.460  -4.906
  231   1HB   GLN  32          2HB       GLN  32   3.905   8.584  -6.988
  232   2HB   GLN  32          3HB       GLN  32   2.863  10.004  -7.186
  233   1HG   GLN  32          2HG       GLN  32   3.723  10.973  -5.087
  234   2HG   GLN  32          3HG       GLN  32   4.748   9.551  -4.830
  235   1HE2  GLN  32          1HE2      GLN  32   4.029  11.819  -7.586
  236   2HE2  GLN  32          2HE2      GLN  32   5.723  12.103  -7.952
  237    H    THR  33           H        THR  33   2.145   6.680  -7.218
  238    HA   THR  33           HA       THR  33   0.116   7.670  -8.854
  239    HB   THR  33           HB       THR  33   2.042   5.643  -9.006
  240    HG1  THR  33           1HG      THR  33  -0.059   6.481 -10.601
  241   1HG2  THR  33          1HG2      THR  33   0.985   3.607  -9.610
  242   2HG2  THR  33          2HG2      THR  33   0.369   3.996  -7.998
  243   3HG2  THR  33          3HG2      THR  33  -0.629   4.326  -9.435
  244    H    SER  34           H        SER  34  -0.055   5.772  -5.952
  245    HA   SER  34           HA       SER  34  -2.876   5.098  -6.319
  246   1HB   SER  34          2HB       SER  34  -1.298   3.452  -5.425
  247   2HB   SER  34          3HB       SER  34  -0.972   4.501  -4.033
  248    HG   SER  34           HG       SER  34  -3.390   4.406  -3.781
  249    H    GLY  35           H        GLY  35  -1.232   7.876  -5.305
  250   1HA   GLY  35          1HA       GLY  35  -2.334   9.834  -4.761
  251   2HA   GLY  35          2HA       GLY  35  -3.732   8.927  -4.160
  252    H    LEU  36           H        LEU  36  -1.271   7.299  -2.835
  253    HA   LEU  36           HA       LEU  36  -2.098   8.087  -0.242
  254   1HB   LEU  36          2HB       LEU  36   0.192   6.301  -1.167
  255   2HB   LEU  36          3HB       LEU  36  -0.498   6.378   0.444
  256    HG   LEU  36           HG       LEU  36  -1.908   5.406  -2.061
  257   1HD1  LEU  36          1HD1      LEU  36  -1.161   3.991   0.519
  258   2HD1  LEU  36          2HD1      LEU  36  -1.949   3.259  -0.895
  259   3HD1  LEU  36          3HD1      LEU  36  -0.279   3.845  -1.018
  260   1HD2  LEU  36          1HD2      LEU  36  -3.785   4.795  -0.498
  261   2HD2  LEU  36          2HD2      LEU  36  -3.017   5.800   0.748
  262   3HD2  LEU  36          3HD2      LEU  36  -3.618   6.528  -0.761
  263    H    SER  37           H        SER  37   0.875   8.829  -2.115
  264    HA   SER  37           HA       SER  37   2.110  10.227   0.121
  265   1HB   SER  37          2HB       SER  37   2.592  10.553  -2.870
  266   2HB   SER  37          3HB       SER  37   3.642  11.134  -1.560
  267    HG   SER  37           HG       SER  37   4.017   9.055  -0.934
  268    H    LYS  38           H        LYS  38  -0.542  11.027  -1.949
  269    HA   LYS  38           HA       LYS  38  -0.064  13.939  -1.764
  270   1HB   LYS  38          2HB       LYS  38  -1.318  12.194  -3.679
  271   2HB   LYS  38          3HB       LYS  38  -2.590  13.178  -2.965
  272   1HG   LYS  38          2HG       LYS  38  -1.186  15.227  -3.451
  273   2HG   LYS  38          3HG       LYS  38   0.025  14.160  -4.197
  274   1HD   LYS  38          2HD       LYS  38  -1.804  13.337  -5.767
  275   2HD   LYS  38          3HD       LYS  38  -2.860  14.597  -5.091
  276   1HE   LYS  38          2HE       LYS  38  -1.157  16.332  -5.787
  277   2HE   LYS  38          3HE       LYS  38  -0.176  15.043  -6.505
  278   1HZ   LYS  38          1HZ       LYS  38  -2.027  14.566  -7.985
  279   2HZ   LYS  38          2HZ       LYS  38  -2.893  15.811  -7.345
  280   3HZ   LYS  38          3HZ       LYS  38  -1.496  16.114  -8.157
  281    H    MET  39           H        MET  39  -2.159  11.291  -0.645
  282    HA   MET  39           HA       MET  39  -3.854  12.874   1.025
  283   1HB   MET  39          2HB       MET  39  -2.934   9.989   1.100
  284   2HB   MET  39          3HB       MET  39  -4.049  10.648   2.287
  285   1HG   MET  39          2HG       MET  39  -4.580  10.686  -0.719
  286   2HG   MET  39          3HG       MET  39  -5.107   9.436   0.403
  287   1HE   MET  39          1HE       MET  39  -5.537  13.497  -0.082
  288   2HE   MET  39          2HE       MET  39  -6.176  12.526  -1.421
  289   3HE   MET  39          3HE       MET  39  -7.281  13.368  -0.321
  290    H    SER  40           H        SER  40  -3.553  13.774   2.932
  291    HA   SER  40           HA       SER  40  -0.852  14.134   3.874
  292   1HB   SER  40          2HB       SER  40  -2.995  15.694   4.066
  293   2HB   SER  40          3HB       SER  40  -3.249  14.829   5.589
  294    HG   SER  40           HG       SER  40  -1.139  15.552   6.205
  295    H    ALA  41           H        ALA  41  -0.060  13.493   6.004
  296    HA   ALA  41           HA       ALA  41  -0.077  10.892   6.714
  297   1HB   ALA  41          1HB       ALA  41   0.569  11.640   9.012
  298   2HB   ALA  41          2HB       ALA  41   1.434  12.498   7.719
  299   3HB   ALA  41          3HB       ALA  41   0.095  13.291   8.584
  300    H    ASN  42           H        ASN  42  -2.460  13.267   7.892
  301    HA   ASN  42           HA       ASN  42  -3.915  11.631   9.685
  302   1HB   ASN  42          2HB       ASN  42  -4.378  14.166   8.212
  303   2HB   ASN  42          3HB       ASN  42  -5.847  13.219   8.409
  304   1HD2  ASN  42          1HD2      ASN  42  -2.984  14.175  10.439
  305   2HD2  ASN  42          2HD2      ASN  42  -3.978  14.528  11.841
  306    H    GLN  43           H        GLN  43  -4.389  12.018   6.123
  307    HA   GLN  43           HA       GLN  43  -6.634  10.159   6.181
  308   1HB   GLN  43          2HB       GLN  43  -5.187  11.706   4.027
  309   2HB   GLN  43          3HB       GLN  43  -6.132  10.288   3.569
  310   1HG   GLN  43          2HG       GLN  43  -7.192  12.696   5.093
  311   2HG   GLN  43          3HG       GLN  43  -7.483  12.338   3.387
  312   1HE2  GLN  43          1HE2      GLN  43  -8.150   9.632   3.343
  313   2HE2  GLN  43          2HE2      GLN  43  -9.480   9.304   4.438
  314    H    VAL  44           H        VAL  44  -3.124   9.990   5.392
  315    HA   VAL  44           HA       VAL  44  -3.256   7.291   4.434
  316    HB   VAL  44           HB       VAL  44  -1.012   8.785   5.858
  317   1HG1  VAL  44          1HG1      VAL  44  -0.566   6.371   5.983
  318   2HG1  VAL  44          2HG1      VAL  44  -0.974   6.185   4.260
  319   3HG1  VAL  44          3HG1      VAL  44   0.464   7.102   4.745
  320   1HG2  VAL  44          1HG2      VAL  44  -0.159   9.136   3.575
  321   2HG2  VAL  44          2HG2      VAL  44  -1.532   8.239   2.895
  322   3HG2  VAL  44          3HG2      VAL  44  -1.787   9.801   3.688
  323    H    LYS  45           H        LYS  45  -2.984   8.668   7.740
  324    HA   LYS  45           HA       LYS  45  -2.823   6.175   9.091
  325   1HB   LYS  45          2HB       LYS  45  -2.204   8.375  10.035
  326   2HB   LYS  45          3HB       LYS  45  -3.923   8.793  10.169
  327   1HG   LYS  45          2HG       LYS  45  -4.286   6.894  11.696
  328   2HG   LYS  45          3HG       LYS  45  -2.614   6.349  11.447
  329   1HD   LYS  45          2HD       LYS  45  -1.781   8.498  12.386
  330   2HD   LYS  45          3HD       LYS  45  -3.457   9.008  12.685
  331   1HE   LYS  45          2HE       LYS  45  -3.784   7.087  14.223
  332   2HE   LYS  45          3HE       LYS  45  -2.151   6.499  13.867
  333   1HZ   LYS  45          1HZ       LYS  45  -1.266   8.493  14.852
  334   2HZ   LYS  45          2HZ       LYS  45  -2.779   9.055  15.190
  335   3HZ   LYS  45          3HZ       LYS  45  -2.218   7.696  15.926
  336    H    ASP  46           H        ASP  46  -5.656   8.194   8.105
  337    HA   ASP  46           HA       ASP  46  -7.680   6.555   9.239
  338   1HB   ASP  46          2HB       ASP  46  -8.275   8.700   8.324
  339   2HB   ASP  46          3HB       ASP  46  -7.699   8.248   6.713
  340    H    VAL  47           H        VAL  47  -6.571   6.498   5.805
  341    HA   VAL  47           HA       VAL  47  -7.988   4.192   5.130
  342    HB   VAL  47           HB       VAL  47  -6.614   3.983   3.166
  343   1HG1  VAL  47          1HG1      VAL  47  -8.196   6.042   3.557
  344   2HG1  VAL  47          2HG1      VAL  47  -6.698   6.967   3.608
  345   3HG1  VAL  47          3HG1      VAL  47  -7.093   6.035   2.164
  346   1HG2  VAL  47          1HG2      VAL  47  -4.649   5.761   4.464
  347   2HG2  VAL  47          2HG2      VAL  47  -4.379   4.098   3.908
  348   3HG2  VAL  47          3HG2      VAL  47  -4.652   5.394   2.730
  349    H    PHE  48           H        PHE  48  -4.658   4.414   6.354
  350    HA   PHE  48           HA       PHE  48  -3.765   1.814   6.484
  351   1HB   PHE  48          2HB       PHE  48  -2.350   3.470   7.231
  352   2HB   PHE  48          3HB       PHE  48  -3.550   4.156   8.303
  353    HD1  PHE  48           1HD      PHE  48  -3.927   3.431  10.526
  354    HD2  PHE  48           2HD      PHE  48  -1.195   1.308   7.943
  355    HE1  PHE  48           1HE      PHE  48  -3.021   2.210  12.485
  356    HE2  PHE  48           2HE      PHE  48  -0.249   0.148   9.928
  357    HZ   PHE  48           HZ       PHE  48  -1.093   0.686  12.181
  358    H    ARG  49           H        ARG  49  -6.279   3.239   8.699
  359    HA   ARG  49           HA       ARG  49  -6.275   1.033  10.511
  360   1HB   ARG  49          2HB       ARG  49  -8.674   2.774   9.811
  361   2HB   ARG  49          3HB       ARG  49  -8.423   1.795  11.259
  362   1HG   ARG  49          2HG       ARG  49  -6.279   3.337  11.591
  363   2HG   ARG  49          3HG       ARG  49  -7.125   4.384  10.438
  364   1HD   ARG  49          2HD       ARG  49  -7.731   5.158  12.578
  365   2HD   ARG  49          3HD       ARG  49  -9.149   4.323  11.902
  366    HE   ARG  49           HE       ARG  49  -7.615   2.449  13.391
  367   1HH1  ARG  49          2HH2      ARG  49  -9.643   5.267  13.930
  368   2HH1  ARG  49          1HH2      ARG  49 -10.047   4.891  15.577
  369   1HH2  ARG  49          2HH1      ARG  49  -8.099   1.894  15.590
  370   2HH2  ARG  49          1HH1      ARG  49  -9.145   2.898  16.538
  371    H    PHE  50           H        PHE  50  -7.710   1.428   7.332
  372    HA   PHE  50           HA       PHE  50  -9.607  -0.776   7.664
  373   1HB   PHE  50          2HB       PHE  50  -9.704   1.447   6.198
  374   2HB   PHE  50          3HB       PHE  50  -8.910   0.443   5.002
  375    HD1  PHE  50           1HD      PHE  50 -12.059   1.452   6.418
  376    HD2  PHE  50           2HD      PHE  50 -10.083  -1.824   4.475
  377    HE1  PHE  50           1HE      PHE  50 -14.252   0.461   5.868
  378    HE2  PHE  50           2HE      PHE  50 -12.296  -2.832   3.902
  379    HZ   PHE  50           HZ       PHE  50 -14.382  -1.700   4.641
  380    H    ILE  51           H        ILE  51  -6.402  -0.181   6.280
  381    HA   ILE  51           HA       ILE  51  -6.001  -2.888   5.227
  382    HB   ILE  51           HB       ILE  51  -4.130  -0.531   5.683
  383   1HG1  ILE  51          2HG1      ILE  51  -3.996  -0.812   3.084
  384   2HG1  ILE  51          3HG1      ILE  51  -5.477  -1.749   3.225
  385   1HG2  ILE  51          1HG2      ILE  51  -2.724  -2.473   5.868
  386   2HG2  ILE  51          2HG2      ILE  51  -3.509  -3.242   4.453
  387   3HG2  ILE  51          3HG2      ILE  51  -2.497  -1.801   4.273
  388   1HD1  ILE  51          1HD1      ILE  51  -6.640   0.267   4.042
  389   2HD1  ILE  51          2HD1      ILE  51  -5.080   1.130   4.159
  390   3HD1  ILE  51          3HD1      ILE  51  -5.735   0.661   2.584
  391    H    ASP  52           H        ASP  52  -3.910  -4.036   6.313
  392    HA   ASP  52           HA       ASP  52  -3.056  -5.231   8.001
  393   1HB   ASP  52          2HB       ASP  52  -2.582  -3.296   9.319
  394   2HB   ASP  52          3HB       ASP  52  -4.249  -3.146   9.863
  395    H    ASN  53           H        ASN  53  -6.350  -4.212   8.825
  396    HA   ASN  53           HA       ASN  53  -8.280  -5.375   8.920
  397   1HB   ASN  53          2HB       ASN  53  -7.303  -6.842   7.089
  398   2HB   ASN  53          3HB       ASN  53  -6.908  -8.028   8.341
  399   1HD2  ASN  53          1HD2      ASN  53  -8.638  -9.231   9.326
  400   2HD2  ASN  53          2HD2      ASN  53 -10.285  -9.090   8.745
  401    H    ASP  54           H        ASP  54  -5.559  -7.113  10.537
  402    HA   ASP  54           HA       ASP  54  -6.929  -8.063  12.833
  403   1HB   ASP  54          2HB       ASP  54  -4.292  -6.551  12.674
  404   2HB   ASP  54          3HB       ASP  54  -4.907  -7.332  14.142
  405    H    GLN  55           H        GLN  55  -5.556  -4.881  12.146
  406    HA   GLN  55           HA       GLN  55  -6.211  -2.797  12.631
  407   1HB   GLN  55          2HB       GLN  55  -7.903  -2.070  13.921
  408   2HB   GLN  55          3HB       GLN  55  -8.514  -3.671  13.519
  409   1HG   GLN  55          2HG       GLN  55  -7.355  -4.359  15.829
  410   2HG   GLN  55          3HG       GLN  55  -7.335  -2.623  16.121
  411   1HE2  GLN  55          1HE2      GLN  55  -9.956  -2.195  14.653
  412   2HE2  GLN  55          2HE2      GLN  55 -11.152  -2.801  15.787
  413    H    SER  56           H        SER  56  -4.521  -5.140  13.955
  414    HA   SER  56           HA       SER  56  -3.166  -4.288  16.252
  415   1HB   SER  56          2HB       SER  56  -1.357  -5.688  15.401
  416   2HB   SER  56          3HB       SER  56  -2.896  -6.496  15.104
  417    HG   SER  56           HG       SER  56  -2.670  -5.355  12.903
  418    H    GLY  57           H        GLY  57  -2.859  -3.376  12.835
  419   1HA   GLY  57          1HA       GLY  57  -1.979  -1.464  11.942
  420   2HA   GLY  57          2HA       GLY  57  -1.301  -0.985  13.524
  421    H    TYR  58           H        TYR  58  -0.245  -4.020  13.417
  422    HA   TYR  58           HA       TYR  58   2.301  -3.536  11.920
  423   1HB   TYR  58          2HB       TYR  58   1.211  -5.800  13.633
  424   2HB   TYR  58          3HB       TYR  58   2.617  -5.975  12.593
  425    HD1  TYR  58           HD1      TYR  58   4.505  -4.148  12.833
  426    HD2  TYR  58           HD2      TYR  58   1.661  -5.197  15.902
  427    HE1  TYR  58           HE1      TYR  58   6.120  -3.446  14.565
  428    HE2  TYR  58           HE2      TYR  58   3.289  -4.496  17.637
  429    HH   TYR  58           HH       TYR  58   6.530  -3.230  16.825
  430    H    LEU  59           H        LEU  59   1.787  -3.315   9.838
  431    HA   LEU  59           HA       LEU  59   0.211  -5.340   8.410
  432   1HB   LEU  59          2HB       LEU  59   2.146  -3.179   7.505
  433   2HB   LEU  59          3HB       LEU  59   1.480  -4.419   6.439
  434    HG   LEU  59           HG       LEU  59  -0.845  -3.677   7.065
  435   1HD1  LEU  59          1HD1      LEU  59  -1.081  -1.359   7.938
  436   2HD1  LEU  59          2HD1      LEU  59  -0.423  -2.448   9.152
  437   3HD1  LEU  59          3HD1      LEU  59   0.663  -1.330   8.295
  438   1HD2  LEU  59          1HD2      LEU  59  -0.596  -1.516   5.662
  439   2HD2  LEU  59          2HD2      LEU  59   1.138  -1.857   5.653
  440   3HD2  LEU  59          3HD2      LEU  59  -0.010  -3.032   4.959
  441    H    ASP  60           H        ASP  60   1.006  -7.121   9.361
  442    HA   ASP  60           HA       ASP  60   3.746  -8.086   9.145
  443   1HB   ASP  60          2HB       ASP  60   1.159  -9.688   9.314
  444   2HB   ASP  60          3HB       ASP  60   2.790 -10.220   9.754
  445    H    GLU  61           H        GLU  61   4.534  -9.625   7.449
  446    HA   GLU  61           HA       GLU  61   4.210  -8.815   4.945
  447   1HB   GLU  61          2HB       GLU  61   5.875 -10.395   6.042
  448   2HB   GLU  61          3HB       GLU  61   4.830 -11.722   5.524
  449   1HG   GLU  61          2HG       GLU  61   5.632  -9.597   3.493
  450   2HG   GLU  61          3HG       GLU  61   6.844 -10.685   4.143
  451    H    GLU  62           H        GLU  62   2.511 -11.715   6.181
  452    HA   GLU  62           HA       GLU  62   1.045 -12.286   3.880
  453   1HB   GLU  62          2HB       GLU  62   1.235 -13.895   5.588
  454   2HB   GLU  62          3HB       GLU  62   0.530 -12.854   6.827
  455   1HG   GLU  62          2HG       GLU  62  -1.622 -13.316   6.226
  456   2HG   GLU  62          3HG       GLU  62  -1.254 -13.476   4.515
  457    H    GLU  63           H        GLU  63   0.389  -9.614   6.149
  458    HA   GLU  63           HA       GLU  63  -2.363  -9.315   5.173
  459   1HB   GLU  63          2HB       GLU  63  -0.530  -7.534   6.793
  460   2HB   GLU  63          3HB       GLU  63  -2.219  -7.151   6.416
  461   1HG   GLU  63          2HG       GLU  63  -3.072  -9.018   7.579
  462   2HG   GLU  63          3HG       GLU  63  -1.526  -9.867   7.648
  463    H    LEU  64           H        LEU  64   0.863  -8.267   4.215
  464    HA   LEU  64           HA       LEU  64  -0.112  -6.210   2.419
  465   1HB   LEU  64          2HB       LEU  64   2.545  -7.662   2.559
  466   2HB   LEU  64          3HB       LEU  64   2.178  -6.338   1.454
  467    HG   LEU  64           HG       LEU  64   1.711  -5.917   4.428
  468   1HD1  LEU  64          1HD1      LEU  64   4.038  -4.966   4.504
  469   2HD1  LEU  64          2HD1      LEU  64   3.959  -6.726   4.435
  470   3HD1  LEU  64          3HD1      LEU  64   4.363  -5.804   2.970
  471   1HD2  LEU  64          1HD2      LEU  64   0.945  -4.212   2.758
  472   2HD2  LEU  64          2HD2      LEU  64   2.250  -3.587   3.782
  473   3HD2  LEU  64          3HD2      LEU  64   2.605  -4.138   2.133
  474    H    LYS  65           H        LYS  65   0.019  -9.704   2.348
  475    HA   LYS  65           HA       LYS  65  -0.337 -10.054  -0.474
  476   1HB   LYS  65          2HB       LYS  65   0.201 -11.857   1.247
  477   2HB   LYS  65          3HB       LYS  65  -1.518 -11.748   1.709
  478   1HG   LYS  65          2HG       LYS  65  -2.278 -12.527  -0.405
  479   2HG   LYS  65          3HG       LYS  65  -0.646 -12.482  -1.081
  480   1HD   LYS  65          2HD       LYS  65  -1.588 -14.752  -0.393
  481   2HD   LYS  65          3HD       LYS  65   0.027 -14.363   0.231
  482   1HE   LYS  65          2HE       LYS  65  -0.781 -13.878   2.408
  483   2HE   LYS  65          3HE       LYS  65  -2.481 -13.835   1.899
  484   1HZ   LYS  65          1HZ       LYS  65  -2.433 -16.182   1.637
  485   2HZ   LYS  65          2HZ       LYS  65  -0.803 -16.254   1.940
  486   3HZ   LYS  65          3HZ       LYS  65  -1.821 -15.802   3.116
  487    H    PHE  66           H        PHE  66  -2.396  -8.408   1.806
  488    HA   PHE  66           HA       PHE  66  -4.376  -8.353  -0.374
  489   1HB   PHE  66          2HB       PHE  66  -6.233  -8.317   1.318
  490   2HB   PHE  66          3HB       PHE  66  -5.431  -9.850   1.061
  491    HD1  PHE  66           1HD      PHE  66  -4.571 -11.082   2.903
  492    HD2  PHE  66           2HD      PHE  66  -5.444  -6.891   3.419
  493    HE1  PHE  66           1HE      PHE  66  -4.624 -11.388   5.360
  494    HE2  PHE  66           2HE      PHE  66  -5.339  -7.191   5.878
  495    HZ   PHE  66           HZ       PHE  66  -5.144  -9.465   6.845
  496    H    PHE  67           H        PHE  67  -2.205  -6.550   0.305
  497    HA   PHE  67           HA       PHE  67  -2.949  -4.313   1.765
  498   1HB   PHE  67          2HB       PHE  67  -0.724  -4.647   0.942
  499   2HB   PHE  67          3HB       PHE  67  -1.226  -4.558  -0.719
  500    HD1  PHE  67           1HD      PHE  67  -0.765  -2.592   2.415
  501    HD2  PHE  67           2HD      PHE  67  -1.398  -2.442  -1.851
  502    HE1  PHE  67           1HE      PHE  67  -0.087  -0.221   2.401
  503    HE2  PHE  67           2HE      PHE  67  -0.786  -0.040  -1.850
  504    HZ   PHE  67           HZ       PHE  67  -0.101   1.074   0.258
  505    H    LEU  68           H        LEU  68  -3.191  -4.247  -1.867
  506    HA   LEU  68           HA       LEU  68  -5.134  -2.100  -1.706
  507   1HB   LEU  68          2HB       LEU  68  -3.305  -2.900  -3.603
  508   2HB   LEU  68          3HB       LEU  68  -4.784  -3.611  -4.246
  509    HG   LEU  68           HG       LEU  68  -5.816  -1.227  -3.939
  510   1HD1  LEU  68          1HD1      LEU  68  -4.084   0.604  -3.971
  511   2HD1  LEU  68          2HD1      LEU  68  -4.077  -0.283  -2.442
  512   3HD1  LEU  68          3HD1      LEU  68  -2.833  -0.615  -3.652
  513   1HD2  LEU  68          1HD2      LEU  68  -5.323  -2.090  -6.128
  514   2HD2  LEU  68          2HD2      LEU  68  -4.678  -0.443  -6.067
  515   3HD2  LEU  68          3HD2      LEU  68  -3.580  -1.835  -5.915
  516    H    GLN  69           H        GLN  69  -5.321  -5.524  -1.745
  517    HA   GLN  69           HA       GLN  69  -7.860  -5.964  -2.879
  518   1HB   GLN  69          2HB       GLN  69  -5.863  -7.524  -1.637
  519   2HB   GLN  69          3HB       GLN  69  -7.289  -7.734  -0.623
  520   1HG   GLN  69          2HG       GLN  69  -7.487  -9.448  -2.112
  521   2HG   GLN  69          3HG       GLN  69  -8.513  -8.229  -2.890
  522   1HE2  GLN  69          1HE2      GLN  69  -7.172  -6.814  -4.588
  523   2HE2  GLN  69          2HE2      GLN  69  -5.978  -7.731  -5.510
  524    H    LYS  70           H        LYS  70  -6.960  -4.347   0.062
  525    HA   LYS  70           HA       LYS  70  -9.413  -4.725   1.489
  526   1HB   LYS  70          2HB       LYS  70  -6.948  -3.293   1.879
  527   2HB   LYS  70          3HB       LYS  70  -8.229  -2.077   1.892
  528   1HG   LYS  70          2HG       LYS  70  -8.044  -2.836   4.090
  529   2HG   LYS  70          3HG       LYS  70  -9.505  -3.625   3.430
  530   1HD   LYS  70          2HD       LYS  70  -7.639  -5.533   2.830
  531   2HD   LYS  70          3HD       LYS  70  -6.844  -4.813   4.220
  532   1HE   LYS  70          2HE       LYS  70  -9.582  -6.150   4.058
  533   2HE   LYS  70          3HE       LYS  70  -8.187  -6.631   5.016
  534   1HZ   LYS  70          1HZ       LYS  70  -8.597  -4.362   6.197
  535   2HZ   LYS  70          2HZ       LYS  70 -10.048  -4.401   5.478
  536   3HZ   LYS  70          3HZ       LYS  70  -9.641  -5.627   6.489
  537    H    PHE  71           H        PHE  71  -8.496  -2.672  -1.202
  538    HA   PHE  71           HA       PHE  71 -10.984  -1.057  -1.029
  539   1HB   PHE  71          2HB       PHE  71  -8.816  -0.034  -1.470
  540   2HB   PHE  71          3HB       PHE  71  -8.674  -0.911  -2.980
  541    HD1  PHE  71           1HD      PHE  71  -8.272   1.703  -3.446
  542    HD2  PHE  71           2HD      PHE  71 -12.157  -0.083  -2.766
  543    HE1  PHE  71           1HE      PHE  71  -9.343   3.440  -4.823
  544    HE2  PHE  71           2HE      PHE  71 -13.149   1.498  -4.332
  545    HZ   PHE  71           HZ       PHE  71 -11.785   3.310  -5.323
  546    H    GLU  72           H        GLU  72  -9.086  -3.055  -3.371
  547    HA   GLU  72           HA       GLU  72 -11.535  -3.490  -5.018
  548   1HB   GLU  72          2HB       GLU  72  -9.347  -2.190  -5.721
  549   2HB   GLU  72          3HB       GLU  72  -8.664  -3.796  -5.972
  550   1HG   GLU  72          2HG       GLU  72 -11.340  -3.124  -7.249
  551   2HG   GLU  72          3HG       GLU  72  -9.893  -2.332  -7.869
  552    H    SER  73           H        SER  73 -10.956  -5.734  -6.422
  553    HA   SER  73           HA       SER  73 -10.327  -7.835  -4.353
  554   1HB   SER  73          2HB       SER  73 -12.548  -7.844  -6.408
  555   2HB   SER  73          3HB       SER  73 -12.100  -9.186  -5.331
  556    HG   SER  73           HG       SER  73 -13.761  -7.970  -4.374
  557    H    GLY  74           H        GLY  74  -9.636  -6.680  -7.548
  558   1HA   GLY  74          1HA       GLY  74  -8.128  -9.198  -8.183
  559   2HA   GLY  74          2HA       GLY  74  -9.118  -8.317  -9.358
  560    H    ALA  75           H        ALA  75  -7.174  -6.847  -6.837
  561    HA   ALA  75           HA       ALA  75  -5.542  -5.330  -8.686
  562   1HB   ALA  75          1HB       ALA  75  -5.281  -5.616  -5.662
  563   2HB   ALA  75          2HB       ALA  75  -4.526  -4.385  -6.687
  564   3HB   ALA  75          3HB       ALA  75  -6.285  -4.436  -6.514
  565    H    ARG  76           H        ARG  76  -3.181  -6.010  -6.507
  566    HA   ARG  76           HA       ARG  76  -2.003  -8.075  -8.341
  567   1HB   ARG  76          2HB       ARG  76  -1.398  -5.561  -8.632
  568   2HB   ARG  76          3HB       ARG  76  -0.571  -5.732  -7.081
  569   1HG   ARG  76          2HG       ARG  76   1.189  -6.276  -8.378
  570   2HG   ARG  76          3HG       ARG  76   0.504  -7.883  -8.403
  571   1HD   ARG  76          2HD       ARG  76  -0.869  -7.118 -10.500
  572   2HD   ARG  76          3HD       ARG  76   0.246  -5.751 -10.532
  573    HE   ARG  76           HE       ARG  76   2.113  -7.138 -10.831
  574   1HH1  ARG  76          2HH2      ARG  76  -0.896  -9.005 -11.130
  575   2HH1  ARG  76          1HH2      ARG  76  -0.095 -10.453 -11.659
  576   1HH2  ARG  76          2HH1      ARG  76   3.108  -8.982 -11.339
  577   2HH2  ARG  76          1HH1      ARG  76   2.298 -10.385 -12.046
  578    H    GLU  77           H        GLU  77  -2.791  -7.401  -5.148
  579    HA   GLU  77           HA       GLU  77  -0.628  -7.765  -3.679
  580   1HB   GLU  77          2HB       GLU  77  -3.174  -9.014  -2.717
  581   2HB   GLU  77          3HB       GLU  77  -1.968  -8.029  -1.855
  582   1HG   GLU  77          2HG       GLU  77  -4.246  -7.189  -3.636
  583   2HG   GLU  77          3HG       GLU  77  -3.776  -6.618  -2.035
  584    H    LEU  78           H        LEU  78  -2.227 -10.332  -5.289
  585    HA   LEU  78           HA       LEU  78  -1.234 -12.633  -4.026
  586   1HB   LEU  78          2HB       LEU  78  -1.397 -12.550  -7.033
  587   2HB   LEU  78          3HB       LEU  78  -1.832 -13.818  -5.903
  588    HG   LEU  78           HG       LEU  78  -3.809 -13.101  -6.852
  589   1HD1  LEU  78          1HD1      LEU  78  -3.810 -11.594  -4.204
  590   2HD1  LEU  78          2HD1      LEU  78  -5.189 -12.286  -5.065
  591   3HD1  LEU  78          3HD1      LEU  78  -3.943 -13.352  -4.387
  592   1HD2  LEU  78          1HD2      LEU  78  -4.265 -11.121  -7.744
  593   2HD2  LEU  78          2HD2      LEU  78  -3.949 -10.242  -6.250
  594   3HD2  LEU  78          3HD2      LEU  78  -2.605 -10.637  -7.351
  595    H    THR  79           H        THR  79   0.368 -10.468  -6.440
  596    HA   THR  79           HA       THR  79   2.538 -12.319  -6.884
  597    HB   THR  79           HB       THR  79   2.425  -9.363  -7.574
  598    HG1  THR  79           1HG      THR  79   2.334 -10.799  -9.629
  599   1HG2  THR  79          1HG2      THR  79   4.202 -11.696  -8.502
  600   2HG2  THR  79          2HG2      THR  79   4.221 -10.073  -9.205
  601   3HG2  THR  79          3HG2      THR  79   4.752 -10.316  -7.544
  602    H    GLU  80           H        GLU  80   3.616 -12.845  -5.175
  603    HA   GLU  80           HA       GLU  80   4.215 -11.407  -2.889
  604   1HB   GLU  80          2HB       GLU  80   5.994 -13.001  -2.465
  605   2HB   GLU  80          3HB       GLU  80   4.496 -13.766  -2.993
  606   1HG   GLU  80          2HG       GLU  80   5.430 -14.083  -5.286
  607   2HG   GLU  80          3HG       GLU  80   6.928 -13.271  -4.797
  608    H    SER  81           H        SER  81   6.236 -11.507  -5.897
  609    HA   SER  81           HA       SER  81   8.330  -9.934  -4.951
  610   1HB   SER  81          2HB       SER  81   7.139  -9.940  -7.749
  611   2HB   SER  81          3HB       SER  81   8.710  -9.277  -7.299
  612    HG   SER  81           HG       SER  81   8.808 -11.344  -8.137
  613    H    GLU  82           H        GLU  82   5.116  -8.880  -6.095
  614    HA   GLU  82           HA       GLU  82   5.996  -6.092  -6.294
  615   1HB   GLU  82          2HB       GLU  82   3.303  -7.448  -6.769
  616   2HB   GLU  82          3HB       GLU  82   3.643  -5.741  -7.046
  617   1HG   GLU  82          2HG       GLU  82   5.601  -6.401  -8.489
  618   2HG   GLU  82          3HG       GLU  82   5.112  -8.102  -8.340
  619    H    THR  83           H        THR  83   3.813  -8.076  -4.284
  620    HA   THR  83           HA       THR  83   3.182  -6.216  -2.338
  621    HB   THR  83           HB       THR  83   3.555  -9.191  -2.424
  622    HG1  THR  83           1HG      THR  83   1.567  -7.787  -1.086
  623   1HG2  THR  83          1HG2      THR  83   4.636  -8.975  -0.284
  624   2HG2  THR  83          2HG2      THR  83   3.492  -7.721   0.234
  625   3HG2  THR  83          3HG2      THR  83   2.953  -9.398   0.017
  626    H    LYS  84           H        LYS  84   6.101  -8.340  -2.481
  627    HA   LYS  84           HA       LYS  84   7.187  -7.232  -0.124
  628   1HB   LYS  84          2HB       LYS  84   8.884  -8.724  -0.226
  629   2HB   LYS  84          3HB       LYS  84   7.631  -9.559  -1.137
  630   1HG   LYS  84          2HG       LYS  84   8.767  -8.494  -3.219
  631   2HG   LYS  84          3HG       LYS  84  10.115  -8.091  -2.146
  632   1HD   LYS  84          2HD       LYS  84  10.298 -10.536  -1.571
  633   2HD   LYS  84          3HD       LYS  84   8.998 -10.863  -2.735
  634   1HE   LYS  84          2HE       LYS  84  10.498  -9.627  -4.489
  635   2HE   LYS  84          3HE       LYS  84  11.787  -9.725  -3.292
  636   1HZ   LYS  84          1HZ       LYS  84  11.542 -12.132  -3.360
  637   2HZ   LYS  84          2HZ       LYS  84  10.329 -12.013  -4.469
  638   3HZ   LYS  84          3HZ       LYS  84  11.848 -11.533  -4.863
  639    H    SER  85           H        SER  85   7.462  -6.175  -3.497
  640    HA   SER  85           HA       SER  85   9.695  -4.445  -3.135
  641   1HB   SER  85          2HB       SER  85   8.599  -4.950  -5.333
  642   2HB   SER  85          3HB       SER  85   7.244  -3.908  -4.859
  643    HG   SER  85           HG       SER  85   8.841  -2.794  -6.071
  644    H    LEU  86           H        LEU  86   6.146  -3.931  -2.555
  645    HA   LEU  86           HA       LEU  86   6.491  -1.318  -1.448
  646   1HB   LEU  86          2HB       LEU  86   4.292  -2.258  -2.118
  647   2HB   LEU  86          3HB       LEU  86   4.299  -3.311  -0.713
  648    HG   LEU  86           HG       LEU  86   4.882  -0.461  -0.065
  649   1HD1  LEU  86          1HD1      LEU  86   2.162  -1.220  -1.201
  650   2HD1  LEU  86          2HD1      LEU  86   2.506   0.259  -0.285
  651   3HD1  LEU  86          3HD1      LEU  86   3.294  -0.006  -1.846
  652   1HD2  LEU  86          1HD2      LEU  86   3.359  -0.836   1.757
  653   2HD2  LEU  86          2HD2      LEU  86   2.703  -2.284   0.976
  654   3HD2  LEU  86          3HD2      LEU  86   4.365  -2.289   1.621
  655    H    MET  87           H        MET  87   6.166  -4.539   0.186
  656    HA   MET  87           HA       MET  87   6.651  -3.755   2.757
  657   1HB   MET  87          2HB       MET  87   6.303  -6.157   1.875
  658   2HB   MET  87          3HB       MET  87   8.051  -6.187   1.628
  659   1HG   MET  87          2HG       MET  87   8.198  -5.436   4.149
  660   2HG   MET  87          3HG       MET  87   6.515  -5.939   4.217
  661   1HE   MET  87          1HE       MET  87  10.146  -8.709   3.634
  662   2HE   MET  87          2HE       MET  87   9.664  -7.604   2.333
  663   3HE   MET  87          3HE       MET  87  10.229  -6.953   3.893
  664    H    ALA  88           H        ALA  88   9.176  -4.514   0.379
  665    HA   ALA  88           HA       ALA  88  11.426  -4.507   1.978
  666   1HB   ALA  88          1HB       ALA  88  11.077  -3.827  -0.977
  667   2HB   ALA  88          2HB       ALA  88  12.656  -4.086  -0.197
  668   3HB   ALA  88          3HB       ALA  88  11.472  -5.400  -0.267
  669    H    ALA  89           H        ALA  89   9.912  -1.737   0.328
  670    HA   ALA  89           HA       ALA  89  12.041   0.084   1.326
  671   1HB   ALA  89          1HB       ALA  89   9.637   0.532  -0.431
  672   2HB   ALA  89          2HB       ALA  89  10.883   1.752  -0.061
  673   3HB   ALA  89          3HB       ALA  89  11.316   0.284  -0.973
  674    H    ALA  90           H        ALA  90   8.512  -0.538   1.797
  675    HA   ALA  90           HA       ALA  90   8.010   1.706   3.528
  676   1HB   ALA  90          1HB       ALA  90   6.141   0.295   4.354
  677   2HB   ALA  90          2HB       ALA  90   6.192   0.358   2.569
  678   3HB   ALA  90          3HB       ALA  90   6.797  -1.077   3.436
  679    H    ASP  91           H        ASP  91   9.290  -1.594   4.119
  680    HA   ASP  91           HA       ASP  91   9.393  -1.207   6.955
  681   1HB   ASP  91          2HB       ASP  91   9.375  -3.476   5.918
  682   2HB   ASP  91          3HB       ASP  91  11.005  -3.172   5.280
  683    H    ASN  92           H        ASN  92  10.861   0.035   7.997
  684    HA   ASN  92           HA       ASN  92  13.334   0.947   6.507
  685   1HB   ASN  92          2HB       ASN  92  11.636   2.343   8.597
  686   2HB   ASN  92          3HB       ASN  92  13.269   2.855   8.167
  687   1HD2  ASN  92          1HD2      ASN  92  10.051   2.175   6.555
  688   2HD2  ASN  92          2HD2      ASN  92  10.338   3.389   5.342
  689    H    ASP  93           H        ASP  93  12.700  -1.530   8.391
  690    HA   ASP  93           HA       ASP  93  14.872  -1.033  10.400
  691   1HB   ASP  93          2HB       ASP  93  12.778  -3.225  10.143
  692   2HB   ASP  93          3HB       ASP  93  14.088  -3.207  11.330
  693    H    GLY  94           H        GLY  94  13.778  -3.065   7.729
  694   1HA   GLY  94          1HA       GLY  94  15.006  -4.552   6.359
  695   2HA   GLY  94          2HA       GLY  94  16.365  -4.521   7.500
  696    H    ASP  95           H        ASP  95  12.837  -4.770   8.205
  697    HA   ASP  95           HA       ASP  95  13.332  -7.502   9.345
  698   1HB   ASP  95          2HB       ASP  95  12.504  -7.057  11.320
  699   2HB   ASP  95          3HB       ASP  95  12.930  -5.391  10.977
  700    H    GLY  96           H        GLY  96  10.557  -5.382   8.349
  701   1HA   GLY  96          1HA       GLY  96   9.458  -6.204   6.264
  702   2HA   GLY  96          2HA       GLY  96   9.322  -7.789   7.041
  703    H    LYS  97           H        LYS  97   8.787  -6.711   9.751
  704    HA   LYS  97           HA       LYS  97   5.919  -6.389   9.642
  705   1HB   LYS  97          2HB       LYS  97   7.928  -5.634  11.811
  706   2HB   LYS  97          3HB       LYS  97   6.193  -5.788  12.040
  707   1HG   LYS  97          2HG       LYS  97   7.945  -8.128  11.154
  708   2HG   LYS  97          3HG       LYS  97   7.728  -7.643  12.832
  709   1HD   LYS  97          2HD       LYS  97   5.196  -7.898  12.499
  710   2HD   LYS  97          3HD       LYS  97   5.525  -8.484  10.874
  711   1HE   LYS  97          2HE       LYS  97   5.159 -10.369  12.343
  712   2HE   LYS  97          3HE       LYS  97   6.847 -10.377  11.796
  713   1HZ   LYS  97          1HZ       LYS  97   7.463  -9.414  13.909
  714   2HZ   LYS  97          2HZ       LYS  97   5.886  -9.369  14.393
  715   3HZ   LYS  97          3HZ       LYS  97   6.638 -10.814  14.154
  716    H    ILE  98           H        ILE  98   4.945  -4.526   8.842
  717    HA   ILE  98           HA       ILE  98   6.420  -1.920   9.115
  718    HB   ILE  98           HB       ILE  98   4.479  -3.053   7.129
  719   1HG1  ILE  98          2HG1      ILE  98   6.946  -1.425   6.538
  720   2HG1  ILE  98          3HG1      ILE  98   7.199  -3.043   7.198
  721   1HG2  ILE  98          1HG2      ILE  98   5.163  -0.108   7.533
  722   2HG2  ILE  98          2HG2      ILE  98   4.448  -0.783   6.055
  723   3HG2  ILE  98          3HG2      ILE  98   3.546  -0.851   7.570
  724   1HD1  ILE  98          1HD1      ILE  98   5.502  -2.497   4.743
  725   2HD1  ILE  98          2HD1      ILE  98   7.192  -3.072   4.783
  726   3HD1  ILE  98          3HD1      ILE  98   5.901  -4.073   5.468
  727    H    GLY  99           H        GLY  99   5.839  -0.787  10.821
  728   1HA   GLY  99          1HA       GLY  99   3.142  -0.928  11.980
  729   2HA   GLY  99          2HA       GLY  99   4.454   0.169  12.432
  730    H    ALA 100           H        ALA 100   1.929   1.199  12.260
  731    HA   ALA 100           HA       ALA 100   1.186   2.409   9.812
  732   1HB   ALA 100          1HB       ALA 100   0.977   4.129  12.243
  733   2HB   ALA 100          2HB       ALA 100  -0.249   3.653  11.053
  734   3HB   ALA 100          3HB       ALA 100   0.205   2.558  12.392
  735    H    GLU 101           H        GLU 101   3.520   3.315  12.316
  736    HA   GLU 101           HA       GLU 101   4.131   5.846  11.330
  737   1HB   GLU 101          2HB       GLU 101   4.810   4.362  13.563
  738   2HB   GLU 101          3HB       GLU 101   6.373   4.463  12.748
  739   1HG   GLU 101          2HG       GLU 101   6.359   6.845  12.870
  740   2HG   GLU 101          3HG       GLU 101   4.617   6.916  13.198
  741    H    GLU 102           H        GLU 102   6.228   2.912  10.974
  742    HA   GLU 102           HA       GLU 102   7.893   3.655   8.943
  743   1HB   GLU 102          2HB       GLU 102   6.454   1.034   9.495
  744   2HB   GLU 102          3HB       GLU 102   7.490   1.201   8.075
  745   1HG   GLU 102          2HG       GLU 102   9.391   1.863   9.468
  746   2HG   GLU 102          3HG       GLU 102   8.417   1.679  10.933
  747    H    PHE 103           H        PHE 103   4.534   2.429   8.422
  748    HA   PHE 103           HA       PHE 103   4.713   2.555   5.586
  749   1HB   PHE 103          2HB       PHE 103   2.978   1.290   6.791
  750   2HB   PHE 103          3HB       PHE 103   2.289   2.778   7.414
  751    HD1  PHE 103           1HD      PHE 103   3.356   1.451   4.029
  752    HD2  PHE 103           2HD      PHE 103   0.286   3.409   6.351
  753    HE1  PHE 103           1HE      PHE 103   1.935   1.615   2.016
  754    HE2  PHE 103           2HE      PHE 103  -1.171   3.483   4.348
  755    HZ   PHE 103           HZ       PHE 103  -0.359   2.578   2.186
  756    H    GLN 104           H        GLN 104   3.292   4.882   7.891
  757    HA   GLN 104           HA       GLN 104   2.494   6.806   5.929
  758   1HB   GLN 104          2HB       GLN 104   1.503   6.503   8.172
  759   2HB   GLN 104          3HB       GLN 104   2.972   7.127   8.930
  760   1HG   GLN 104          2HG       GLN 104   1.630   8.826   6.812
  761   2HG   GLN 104          3HG       GLN 104   0.799   8.627   8.361
  762   1HE2  GLN 104          1HE2      GLN 104   3.786   9.833   6.852
  763   2HE2  GLN 104          2HE2      GLN 104   4.206  10.891   8.195
  764    H    GLU 105           H        GLU 105   5.522   6.446   7.835
  765    HA   GLU 105           HA       GLU 105   6.761   8.868   7.029
  766   1HB   GLU 105          2HB       GLU 105   7.853   6.074   7.611
  767   2HB   GLU 105          3HB       GLU 105   8.892   7.443   7.220
  768   1HG   GLU 105          2HG       GLU 105   8.116   8.699   9.146
  769   2HG   GLU 105          3HG       GLU 105   6.919   7.461   9.544
  770    H    MET 106           H        MET 106   7.048   5.585   5.528
  771    HA   MET 106           HA       MET 106   8.538   6.660   3.377
  772   1HB   MET 106          2HB       MET 106   8.074   4.114   4.293
  773   2HB   MET 106          3HB       MET 106   7.096   4.108   2.817
  774   1HG   MET 106          2HG       MET 106   9.343   3.376   2.286
  775   2HG   MET 106          3HG       MET 106   9.153   4.990   1.591
  776   1HE   MET 106          1HE       MET 106  12.957   4.768   2.609
  777   2HE   MET 106          2HE       MET 106  11.947   3.411   2.067
  778   3HE   MET 106          3HE       MET 106  11.821   4.993   1.256
  779    H    VAL 107           H        VAL 107   5.063   6.037   3.665
  780    HA   VAL 107           HA       VAL 107   4.355   6.722   0.975
  781    HB   VAL 107           HB       VAL 107   2.864   6.815   3.614
  782   1HG1  VAL 107          1HG1      VAL 107   0.792   7.034   2.246
  783   2HG1  VAL 107          2HG1      VAL 107   1.786   8.490   2.197
  784   3HG1  VAL 107          3HG1      VAL 107   1.804   7.363   0.820
  785   1HG2  VAL 107          1HG2      VAL 107   3.487   4.559   2.617
  786   2HG2  VAL 107          2HG2      VAL 107   1.742   4.849   2.726
  787   3HG2  VAL 107          3HG2      VAL 107   2.578   5.006   1.166
  788    H    HIS 108           H        HIS 108   4.737   8.745   3.942
  789    HA   HIS 108           HA       HIS 108   3.631  11.070   2.735
  790   1HB   HIS 108          2HB       HIS 108   3.568  10.728   5.090
  791   2HB   HIS 108          3HB       HIS 108   5.346  10.671   5.202
  792    HD1  HIS 108           1HD      HIS 108   2.709  13.291   4.038
  793    HD2  HIS 108           2HD      HIS 108   6.275  12.834   6.226
  794    HE1  HIS 108           1HE      HIS 108   3.220  15.563   5.103
  795    H    SER 109           H        SER 109   6.817   9.687   3.026
  796    HA   SER 109           HA       SER 109   8.618  11.612   2.499
  797   1HB   SER 109          2HB       SER 109   8.905   9.057   2.728
  798   2HB   SER 109          3HB       SER 109   8.644   8.991   0.973
  799    HG   SER 109           HG       SER 109  10.854   9.085   1.501
  Start of MODEL    7
    1   1H    MET   1           H1       MET   1 -14.969   1.505  -0.560
    2   2H    MET   1           H2       MET   1 -16.124   1.543  -1.730
    3   3H    MET   1           H3       MET   1 -15.150   2.832  -1.539
    4    HA   MET   1           HA       MET   1 -17.165   3.436  -0.584
    5   1HB   MET   1          2HB       MET   1 -18.456   1.989   0.862
    6   2HB   MET   1          3HB       MET   1 -18.092   1.196  -0.673
    7   1HG   MET   1          2HG       MET   1 -16.152   0.011   0.551
    8   2HG   MET   1          3HG       MET   1 -16.880   0.587   2.050
    9   1HE   MET   1          1HE       MET   1 -20.047   0.292   1.360
   10   2HE   MET   1          2HE       MET   1 -20.304  -1.333   2.027
   11   3HE   MET   1          3HE       MET   1 -19.280  -0.171   2.902
   12    H    SER   2           H        SER   2 -14.552   4.180   0.084
   13    HA   SER   2           HA       SER   2 -14.797   5.350   2.588
   14   1HB   SER   2          2HB       SER   2 -13.165   2.771   2.666
   15   2HB   SER   2          3HB       SER   2 -12.745   4.163   3.676
   16    HG   SER   2           HG       SER   2 -15.377   3.173   3.670
   17    H    ILE   3           H        ILE   3 -12.250   3.758   0.666
   18    HA   ILE   3           HA       ILE   3 -10.746   6.308   0.547
   19    HB   ILE   3           HB       ILE   3  -9.021   4.986  -0.440
   20   1HG1  ILE   3          2HG1      ILE   3  -9.700   2.303   0.027
   21   2HG1  ILE   3          3HG1      ILE   3 -11.072   2.901  -0.860
   22   1HG2  ILE   3          1HG2      ILE   3 -10.138   3.554   2.017
   23   2HG2  ILE   3          2HG2      ILE   3  -8.434   3.719   1.548
   24   3HG2  ILE   3          3HG2      ILE   3  -9.367   5.147   2.049
   25   1HD1  ILE   3          1HD1      ILE   3  -9.341   1.997  -2.347
   26   2HD1  ILE   3          2HD1      ILE   3  -9.555   3.712  -2.657
   27   3HD1  ILE   3          3HD1      ILE   3  -8.150   3.149  -1.713
   28    H    THR   4           H        THR   4 -12.516   4.114  -1.548
   29    HA   THR   4           HA       THR   4 -11.749   5.133  -4.038
   30    HB   THR   4           HB       THR   4 -13.861   4.080  -4.745
   31    HG1  THR   4           1HG      THR   4 -15.307   4.336  -3.194
   32   1HG2  THR   4          1HG2      THR   4 -12.425   2.318  -2.710
   33   2HG2  THR   4          2HG2      THR   4 -13.321   1.803  -4.146
   34   3HG2  THR   4          3HG2      THR   4 -11.810   2.703  -4.329
   35    H    ASP   5           H        ASP   5 -14.540   5.824  -2.010
   36    HA   ASP   5           HA       ASP   5 -15.639   7.864  -3.720
   37   1HB   ASP   5          2HB       ASP   5 -16.899   6.074  -2.454
   38   2HB   ASP   5          3HB       ASP   5 -16.473   6.903  -0.942
   39    H    VAL   6           H        VAL   6 -13.184   8.713  -2.990
   40    HA   VAL   6           HA       VAL   6 -13.628  11.195  -1.429
   41    HB   VAL   6           HB       VAL   6 -11.398   9.146  -0.971
   42   1HG1  VAL   6          1HG1      VAL   6 -10.450  10.657   0.675
   43   2HG1  VAL   6          2HG1      VAL   6 -10.461  11.417  -0.924
   44   3HG1  VAL   6          3HG1      VAL   6 -11.667  11.899   0.288
   45   1HG2  VAL   6          1HG2      VAL   6 -13.438   8.599   0.204
   46   2HG2  VAL   6          2HG2      VAL   6 -12.211   9.160   1.365
   47   3HG2  VAL   6          3HG2      VAL   6 -13.543  10.239   0.886
   48    H    LEU   7           H        LEU   7 -11.251   9.234  -3.209
   49    HA   LEU   7           HA       LEU   7 -10.833  11.134  -5.340
   50   1HB   LEU   7          2HB       LEU   7  -9.536  12.298  -3.531
   51   2HB   LEU   7          3HB       LEU   7  -8.691  10.795  -3.190
   52    HG   LEU   7           HG       LEU   7  -8.080  11.026  -5.841
   53   1HD1  LEU   7          1HD1      LEU   7  -8.298  13.893  -4.861
   54   2HD1  LEU   7          2HD1      LEU   7  -7.591  13.337  -6.395
   55   3HD1  LEU   7          3HD1      LEU   7  -9.329  13.138  -6.099
   56   1HD2  LEU   7          1HD2      LEU   7  -5.929  11.909  -5.182
   57   2HD2  LEU   7          2HD2      LEU   7  -6.583  12.485  -3.635
   58   3HD2  LEU   7          3HD2      LEU   7  -6.464  10.739  -3.975
   59    H    SER   8           H        SER   8  -9.173   8.743  -3.306
   60    HA   SER   8           HA       SER   8  -7.450   7.639  -4.834
   61   1HB   SER   8          2HB       SER   8  -8.913   5.734  -3.102
   62   2HB   SER   8          3HB       SER   8  -7.181   6.089  -3.209
   63    HG   SER   8           HG       SER   8  -9.251   7.402  -1.828
   64    H    ALA   9           H        ALA   9 -10.839   6.975  -5.445
   65    HA   ALA   9           HA       ALA   9 -10.712   4.508  -6.849
   66   1HB   ALA   9          1HB       ALA   9 -12.828   5.605  -6.345
   67   2HB   ALA   9          2HB       ALA   9 -12.386   7.004  -7.345
   68   3HB   ALA   9          3HB       ALA   9 -12.661   5.419  -8.098
   69    H    ASP  10           H        ASP  10 -10.027   7.883  -7.890
   70    HA   ASP  10           HA       ASP  10  -9.581   7.225 -10.659
   71   1HB   ASP  10          2HB       ASP  10 -10.123   9.503  -9.614
   72   2HB   ASP  10          3HB       ASP  10  -8.424   9.581  -9.116
   73    H    ASP  11           H        ASP  11  -7.541   7.472  -7.759
   74    HA   ASP  11           HA       ASP  11  -5.052   7.318  -9.119
   75   1HB   ASP  11          2HB       ASP  11  -5.653   6.755  -6.190
   76   2HB   ASP  11          3HB       ASP  11  -4.118   7.194  -6.958
   77    H    ILE  12           H        ILE  12  -7.091   4.818  -7.398
   78    HA   ILE  12           HA       ILE  12  -5.258   2.726  -7.906
   79    HB   ILE  12           HB       ILE  12  -7.016   1.239  -7.503
   80   1HG1  ILE  12          2HG1      ILE  12  -8.876   3.548  -7.278
   81   2HG1  ILE  12          3HG1      ILE  12  -8.947   2.264  -8.492
   82   1HG2  ILE  12          1HG2      ILE  12  -7.284   1.691  -5.144
   83   2HG2  ILE  12          2HG2      ILE  12  -5.701   2.260  -5.667
   84   3HG2  ILE  12          3HG2      ILE  12  -7.012   3.426  -5.407
   85   1HD1  ILE  12          1HD1      ILE  12  -9.336   0.619  -6.613
   86   2HD1  ILE  12          2HD1      ILE  12  -9.513   2.011  -5.515
   87   3HD1  ILE  12          3HD1      ILE  12 -10.632   1.800  -6.869
   88    H    ALA  13           H        ALA  13  -7.993   4.068  -9.858
   89    HA   ALA  13           HA       ALA  13  -7.760   2.231 -11.998
   90   1HB   ALA  13          1HB       ALA  13  -9.592   3.785 -11.925
   91   2HB   ALA  13          2HB       ALA  13  -8.510   5.179 -12.074
   92   3HB   ALA  13          3HB       ALA  13  -8.677   4.048 -13.423
   93    H    ALA  14           H        ALA  14  -5.905   5.301 -11.468
   94    HA   ALA  14           HA       ALA  14  -4.228   5.028 -13.738
   95   1HB   ALA  14          1HB       ALA  14  -2.653   6.478 -12.567
   96   2HB   ALA  14          2HB       ALA  14  -4.316   7.060 -12.348
   97   3HB   ALA  14          3HB       ALA  14  -3.488   6.216 -11.027
   98    H    ALA  15           H        ALA  15  -3.513   3.994 -10.380
   99    HA   ALA  15           HA       ALA  15  -1.136   2.655 -10.677
  100   1HB   ALA  15          1HB       ALA  15  -1.644   1.488  -8.670
  101   2HB   ALA  15          2HB       ALA  15  -2.323   3.116  -8.529
  102   3HB   ALA  15          3HB       ALA  15  -3.387   1.737  -8.885
  103    H    LEU  16           H        LEU  16  -4.384   1.411 -11.303
  104    HA   LEU  16           HA       LEU  16  -3.708  -1.281 -11.656
  105   1HB   LEU  16          2HB       LEU  16  -6.022  -0.394 -11.327
  106   2HB   LEU  16          3HB       LEU  16  -5.964   0.309 -12.947
  107    HG   LEU  16           HG       LEU  16  -5.730  -2.023 -13.894
  108   1HD1  LEU  16          1HD1      LEU  16  -4.857  -3.218 -11.919
  109   2HD1  LEU  16          2HD1      LEU  16  -6.323  -2.808 -11.000
  110   3HD1  LEU  16          3HD1      LEU  16  -6.415  -3.904 -12.392
  111   1HD2  LEU  16          1HD2      LEU  16  -7.882  -0.838 -13.823
  112   2HD2  LEU  16          2HD2      LEU  16  -8.109  -2.575 -13.551
  113   3HD2  LEU  16          3HD2      LEU  16  -8.180  -1.446 -12.180
  114    H    GLN  17           H        GLN  17  -3.644   1.467 -13.936
  115    HA   GLN  17           HA       GLN  17  -3.224  -0.387 -16.206
  116   1HB   GLN  17          2HB       GLN  17  -4.730   1.786 -16.198
  117   2HB   GLN  17          3HB       GLN  17  -3.187   2.605 -16.517
  118   1HG   GLN  17          2HG       GLN  17  -2.803   0.969 -18.415
  119   2HG   GLN  17          3HG       GLN  17  -4.401   0.281 -18.094
  120   1HE2  GLN  17          1HE2      GLN  17  -6.208   1.275 -19.042
  121   2HE2  GLN  17          2HE2      GLN  17  -6.075   2.759 -19.970
  122    H    GLU  18           H        GLU  18  -1.497   2.117 -14.322
  123    HA   GLU  18           HA       GLU  18   0.832   2.052 -16.012
  124   1HB   GLU  18          2HB       GLU  18   1.760   3.580 -14.509
  125   2HB   GLU  18          3HB       GLU  18   0.023   3.891 -14.506
  126   1HG   GLU  18          2HG       GLU  18   0.481   4.028 -12.262
  127   2HG   GLU  18          3HG       GLU  18  -0.102   2.379 -12.454
  128    H    CYS  19           H        CYS  19   0.004   0.455 -12.886
  129    HA   CYS  19           HA       CYS  19   2.455  -1.138 -12.936
  130   1HB   CYS  19          2HB       CYS  19   0.914  -0.053 -10.902
  131   2HB   CYS  19          3HB       CYS  19   0.359  -1.717 -10.874
  132    HG   CYS  19           HG       CYS  19   2.736  -2.771 -10.861
  133    H    ARG  20           H        ARG  20   1.098  -1.645 -15.224
  134    HA   ARG  20           HA       ARG  20  -0.800  -3.894 -14.827
  135   1HB   ARG  20          2HB       ARG  20  -1.449  -2.304 -16.382
  136   2HB   ARG  20          3HB       ARG  20   0.119  -2.304 -17.230
  137   1HG   ARG  20          2HG       ARG  20  -0.283  -4.491 -18.141
  138   2HG   ARG  20          3HG       ARG  20  -1.712  -4.737 -17.105
  139   1HD   ARG  20          2HD       ARG  20  -2.901  -2.943 -18.208
  140   2HD   ARG  20          3HD       ARG  20  -1.464  -2.513 -19.174
  141    HE   ARG  20           HE       ARG  20  -1.889  -5.161 -19.784
  142   1HH1  ARG  20          2HH2      ARG  20  -3.805  -2.222 -20.009
  143   2HH1  ARG  20          1HH2      ARG  20  -4.762  -2.731 -21.367
  144   1HH2  ARG  20          2HH1      ARG  20  -3.097  -5.876 -21.628
  145   2HH2  ARG  20          1HH1      ARG  20  -4.323  -4.867 -22.323
  146    H    ASP  21           H        ASP  21   2.263  -3.293 -16.681
  147    HA   ASP  21           HA       ASP  21   2.882  -5.927 -17.204
  148   1HB   ASP  21          2HB       ASP  21   4.598  -3.461 -16.752
  149   2HB   ASP  21          3HB       ASP  21   5.256  -5.004 -17.300
  150    HA   PRO  22           HA       PRO  22   3.414  -7.492 -13.119
  151   1HB   PRO  22          2HB       PRO  22   4.896  -9.765 -13.523
  152   2HB   PRO  22          3HB       PRO  22   3.179  -9.610 -13.995
  153   1HG   PRO  22          2HG       PRO  22   5.622  -9.190 -15.738
  154   2HG   PRO  22          3HG       PRO  22   4.189 -10.201 -16.102
  155   1HD   PRO  22          2HD       PRO  22   4.417  -7.678 -17.072
  156   2HD   PRO  22          3HD       PRO  22   2.832  -8.259 -16.469
  157    H    ASP  23           H        ASP  23   4.879  -7.519 -11.437
  158    HA   ASP  23           HA       ASP  23   6.647  -7.080 -10.229
  159   1HB   ASP  23          2HB       ASP  23   8.319  -7.823 -12.634
  160   2HB   ASP  23          3HB       ASP  23   8.886  -7.688 -10.971
  161    H    THR  24           H        THR  24   5.746  -4.917 -12.573
  162    HA   THR  24           HA       THR  24   7.996  -3.149 -12.611
  163    HB   THR  24           HB       THR  24   5.083  -2.585 -13.367
  164    HG1  THR  24           1HG      THR  24   5.440  -4.159 -14.619
  165   1HG2  THR  24          1HG2      THR  24   6.175  -1.158 -15.115
  166   2HG2  THR  24          2HG2      THR  24   6.468  -0.537 -13.487
  167   3HG2  THR  24          3HG2      THR  24   7.747  -1.435 -14.340
  168    H    PHE  25           H        PHE  25   5.850  -3.815 -10.110
  169    HA   PHE  25           HA       PHE  25   5.114  -1.207  -9.268
  170   1HB   PHE  25          2HB       PHE  25   3.887  -3.231  -8.708
  171   2HB   PHE  25          3HB       PHE  25   5.266  -3.884  -7.848
  172    HD1  PHE  25           1HD      PHE  25   5.985  -2.803  -5.714
  173    HD2  PHE  25           2HD      PHE  25   2.217  -1.926  -7.612
  174    HE1  PHE  25           1HE      PHE  25   5.123  -2.063  -3.602
  175    HE2  PHE  25           2HE      PHE  25   1.260  -1.349  -5.400
  176    HZ   PHE  25           HZ       PHE  25   2.686  -1.389  -3.376
  177    H    GLU  26           H        GLU  26   6.484   0.286  -8.675
  178    HA   GLU  26           HA       GLU  26   8.662  -0.290  -6.722
  179   1HB   GLU  26          2HB       GLU  26   8.321   1.755  -8.866
  180   2HB   GLU  26          3HB       GLU  26   8.786   2.426  -7.308
  181   1HG   GLU  26          2HG       GLU  26  10.642   0.528  -7.340
  182   2HG   GLU  26          3HG       GLU  26  10.347   0.595  -9.084
  183    HA   PRO  27           HA       PRO  27   6.309   1.303  -3.422
  184   1HB   PRO  27          2HB       PRO  27   8.165   2.467  -1.754
  185   2HB   PRO  27          3HB       PRO  27   8.039   0.716  -2.063
  186   1HG   PRO  27          2HG       PRO  27   9.967   2.661  -3.367
  187   2HG   PRO  27          3HG       PRO  27  10.299   1.048  -2.717
  188   1HD   PRO  27          2HD       PRO  27   9.899   1.463  -5.347
  189   2HD   PRO  27          3HD       PRO  27   9.361  -0.038  -4.533
  190    H    GLN  28           H        GLN  28   8.680   4.018  -3.779
  191    HA   GLN  28           HA       GLN  28   6.902   6.075  -3.077
  192   1HB   GLN  28          2HB       GLN  28   9.349   6.121  -4.874
  193   2HB   GLN  28          3HB       GLN  28   8.505   7.566  -4.289
  194   1HG   GLN  28          2HG       GLN  28   8.916   6.942  -1.957
  195   2HG   GLN  28          3HG       GLN  28   9.744   5.460  -2.457
  196   1HE2  GLN  28          1HE2      GLN  28  11.603   5.937  -4.206
  197   2HE2  GLN  28          2HE2      GLN  28  12.632   7.282  -3.745
  198    H    LYS  29           H        LYS  29   7.735   4.827  -6.245
  199    HA   LYS  29           HA       LYS  29   6.125   6.296  -7.967
  200   1HB   LYS  29          2HB       LYS  29   7.840   4.506  -8.413
  201   2HB   LYS  29          3HB       LYS  29   6.636   3.287  -8.025
  202   1HG   LYS  29          2HG       LYS  29   6.424   5.305 -10.324
  203   2HG   LYS  29          3HG       LYS  29   7.145   3.702 -10.426
  204   1HD   LYS  29          2HD       LYS  29   5.069   3.112 -11.165
  205   2HD   LYS  29          3HD       LYS  29   4.867   2.837  -9.452
  206   1HE   LYS  29          2HE       LYS  29   3.019   4.042  -9.747
  207   2HE   LYS  29          3HE       LYS  29   4.078   5.463  -9.545
  208   1HZ   LYS  29          1HZ       LYS  29   4.126   5.774 -11.839
  209   2HZ   LYS  29          2HZ       LYS  29   3.367   4.335 -12.117
  210   3HZ   LYS  29          3HZ       LYS  29   2.544   5.555 -11.345
  211    H    PHE  30           H        PHE  30   5.162   3.120  -6.436
  212    HA   PHE  30           HA       PHE  30   2.449   3.278  -7.043
  213   1HB   PHE  30          2HB       PHE  30   3.314   1.224  -6.248
  214   2HB   PHE  30          3HB       PHE  30   3.930   1.949  -4.771
  215    HD1  PHE  30           1HD      PHE  30   2.655   2.036  -2.813
  216    HD2  PHE  30           2HD      PHE  30   0.697   1.259  -6.571
  217    HE1  PHE  30           1HE      PHE  30   0.484   1.818  -1.635
  218    HE2  PHE  30           2HE      PHE  30  -1.460   0.953  -5.380
  219    HZ   PHE  30           HZ       PHE  30  -1.585   1.377  -2.927
  220    H    PHE  31           H        PHE  31   4.022   4.497  -3.997
  221    HA   PHE  31           HA       PHE  31   1.698   5.302  -2.696
  222   1HB   PHE  31          2HB       PHE  31   4.316   6.838  -2.657
  223   2HB   PHE  31          3HB       PHE  31   3.056   6.852  -1.426
  224    HD1  PHE  31           1HD      PHE  31   6.054   6.314  -1.060
  225    HD2  PHE  31           2HD      PHE  31   2.530   3.866  -1.155
  226    HE1  PHE  31           1HE      PHE  31   7.314   4.492   0.018
  227    HE2  PHE  31           2HE      PHE  31   3.682   2.214   0.279
  228    HZ   PHE  31           HZ       PHE  31   6.125   2.407   0.697
  229    H    GLN  32           H        GLN  32   3.634   7.229  -5.064
  230    HA   GLN  32           HA       GLN  32   1.785   9.448  -4.776
  231   1HB   GLN  32          2HB       GLN  32   4.172   9.679  -5.408
  232   2HB   GLN  32          3HB       GLN  32   3.792   9.032  -7.017
  233   1HG   GLN  32          2HG       GLN  32   2.394  10.930  -7.528
  234   2HG   GLN  32          3HG       GLN  32   2.242  11.377  -5.826
  235   1HE2  GLN  32          1HE2      GLN  32   5.102  10.762  -7.977
  236   2HE2  GLN  32          2HE2      GLN  32   5.879  12.276  -7.539
  237    H    THR  33           H        THR  33   2.082   6.712  -7.096
  238    HA   THR  33           HA       THR  33   0.136   7.685  -8.922
  239    HB   THR  33           HB       THR  33   1.827   5.369  -8.541
  240    HG1  THR  33           1HG      THR  33   0.252   6.307 -10.664
  241   1HG2  THR  33          1HG2      THR  33   0.535   3.633  -9.562
  242   2HG2  THR  33          2HG2      THR  33  -0.133   4.046  -7.991
  243   3HG2  THR  33          3HG2      THR  33  -0.929   4.636  -9.484
  244    H    SER  34           H        SER  34  -0.129   5.821  -5.929
  245    HA   SER  34           HA       SER  34  -2.978   5.281  -6.294
  246   1HB   SER  34          2HB       SER  34  -2.774   4.293  -4.025
  247   2HB   SER  34          3HB       SER  34  -1.643   3.615  -5.209
  248    HG   SER  34           HG       SER  34   0.009   4.728  -4.294
  249    H    GLY  35           H        GLY  35  -1.230   8.040  -5.499
  250   1HA   GLY  35          1HA       GLY  35  -2.138  10.099  -4.959
  251   2HA   GLY  35          2HA       GLY  35  -3.655   9.333  -4.460
  252    H    LEU  36           H        LEU  36  -1.394   7.475  -2.979
  253    HA   LEU  36           HA       LEU  36  -2.172   8.325  -0.403
  254   1HB   LEU  36          2HB       LEU  36   0.032   6.487  -1.417
  255   2HB   LEU  36          3HB       LEU  36  -0.397   6.681   0.263
  256    HG   LEU  36           HG       LEU  36  -2.279   5.632  -1.869
  257   1HD1  LEU  36          1HD1      LEU  36  -1.956   3.473  -0.737
  258   2HD1  LEU  36          2HD1      LEU  36  -0.390   4.112  -1.267
  259   3HD1  LEU  36          3HD1      LEU  36  -0.858   4.227   0.441
  260   1HD2  LEU  36          1HD2      LEU  36  -3.621   6.706  -0.151
  261   2HD2  LEU  36          2HD2      LEU  36  -3.678   4.964   0.097
  262   3HD2  LEU  36          3HD2      LEU  36  -2.638   5.966   1.137
  263    H    SER  37           H        SER  37   0.775   9.045  -2.326
  264    HA   SER  37           HA       SER  37   2.016  10.458  -0.103
  265   1HB   SER  37          2HB       SER  37   2.586  10.777  -3.075
  266   2HB   SER  37          3HB       SER  37   3.620  11.273  -1.724
  267    HG   SER  37           HG       SER  37   3.894   9.187  -1.131
  268    H    LYS  38           H        LYS  38  -0.563  11.303  -2.277
  269    HA   LYS  38           HA       LYS  38  -0.043  14.189  -1.973
  270   1HB   LYS  38          2HB       LYS  38  -1.236  12.657  -4.025
  271   2HB   LYS  38          3HB       LYS  38  -2.594  13.444  -3.219
  272   1HG   LYS  38          2HG       LYS  38  -1.348  15.645  -3.414
  273   2HG   LYS  38          3HG       LYS  38  -0.041  14.782  -4.234
  274   1HD   LYS  38          2HD       LYS  38  -1.293  15.854  -5.914
  275   2HD   LYS  38          3HD       LYS  38  -1.638  14.120  -6.052
  276   1HE   LYS  38          2HE       LYS  38  -3.823  14.401  -4.996
  277   2HE   LYS  38          3HE       LYS  38  -3.445  16.068  -4.527
  278   1HZ   LYS  38          1HZ       LYS  38  -3.769  15.113  -7.294
  279   2HZ   LYS  38          2HZ       LYS  38  -4.865  15.986  -6.438
  280   3HZ   LYS  38          3HZ       LYS  38  -3.424  16.661  -6.844
  281    H    MET  39           H        MET  39  -2.154  11.560  -0.907
  282    HA   MET  39           HA       MET  39  -3.920  13.126   0.650
  283   1HB   MET  39          2HB       MET  39  -3.013  10.223   0.682
  284   2HB   MET  39          3HB       MET  39  -4.013  10.840   1.995
  285   1HG   MET  39          2HG       MET  39  -4.777  11.029  -0.936
  286   2HG   MET  39          3HG       MET  39  -5.361   9.795   0.195
  287   1HE   MET  39          1HE       MET  39  -8.462  12.183  -0.367
  288   2HE   MET  39          2HE       MET  39  -7.236  11.681  -1.553
  289   3HE   MET  39          3HE       MET  39  -7.928  10.476  -0.432
  290    H    SER  40           H        SER  40  -3.821  13.936   2.666
  291    HA   SER  40           HA       SER  40  -1.265  14.390   3.905
  292   1HB   SER  40          2HB       SER  40  -4.136  14.706   4.889
  293   2HB   SER  40          3HB       SER  40  -2.717  15.256   5.799
  294    HG   SER  40           HG       SER  40  -2.959  16.028   3.111
  295    H    ALA  41           H        ALA  41  -0.451  13.564   5.817
  296    HA   ALA  41           HA       ALA  41  -0.342  10.950   6.498
  297   1HB   ALA  41          1HB       ALA  41   0.231  11.735   8.804
  298   2HB   ALA  41          2HB       ALA  41   1.073  12.626   7.521
  299   3HB   ALA  41          3HB       ALA  41  -0.316  13.360   8.359
  300    H    ASN  42           H        ASN  42  -2.826  13.226   7.619
  301    HA   ASN  42           HA       ASN  42  -4.269  11.665   9.437
  302   1HB   ASN  42          2HB       ASN  42  -5.446  13.567   7.360
  303   2HB   ASN  42          3HB       ASN  42  -6.182  13.093   8.895
  304   1HD2  ASN  42          1HD2      ASN  42  -5.094  15.770   7.622
  305   2HD2  ASN  42          2HD2      ASN  42  -4.122  16.420   8.926
  306    H    GLN  43           H        GLN  43  -4.704  11.857   5.874
  307    HA   GLN  43           HA       GLN  43  -6.950   9.961   5.910
  308   1HB   GLN  43          2HB       GLN  43  -6.004  12.019   4.193
  309   2HB   GLN  43          3HB       GLN  43  -5.902  10.518   3.275
  310   1HG   GLN  43          2HG       GLN  43  -8.169  10.137   3.298
  311   2HG   GLN  43          3HG       GLN  43  -8.447  10.958   4.840
  312   1HE2  GLN  43          1HE2      GLN  43 -10.218  11.374   2.808
  313   2HE2  GLN  43          2HE2      GLN  43 -10.061  13.047   2.305
  314    H    VAL  44           H        VAL  44  -3.412   9.947   5.118
  315    HA   VAL  44           HA       VAL  44  -3.352   7.313   4.074
  316    HB   VAL  44           HB       VAL  44  -1.408   9.175   5.526
  317   1HG1  VAL  44          1HG1      VAL  44  -0.542   7.003   5.907
  318   2HG1  VAL  44          2HG1      VAL  44  -0.776   6.549   4.186
  319   3HG1  VAL  44          3HG1      VAL  44   0.434   7.775   4.653
  320   1HG2  VAL  44          1HG2      VAL  44  -0.474   9.536   3.289
  321   2HG2  VAL  44          2HG2      VAL  44  -1.635   8.382   2.591
  322   3HG2  VAL  44          3HG2      VAL  44  -2.195   9.917   3.276
  323    H    LYS  45           H        LYS  45  -2.996   8.582   7.434
  324    HA   LYS  45           HA       LYS  45  -2.706   6.085   8.734
  325   1HB   LYS  45          2HB       LYS  45  -2.368   8.343   9.768
  326   2HB   LYS  45          3HB       LYS  45  -4.121   8.592   9.746
  327   1HG   LYS  45          2HG       LYS  45  -4.364   6.543  11.213
  328   2HG   LYS  45          3HG       LYS  45  -2.592   6.452  11.275
  329   1HD   LYS  45          2HD       LYS  45  -2.579   8.828  12.152
  330   2HD   LYS  45          3HD       LYS  45  -4.354   8.776  12.192
  331   1HE   LYS  45          2HE       LYS  45  -4.260   6.856  13.786
  332   2HE   LYS  45          3HE       LYS  45  -2.489   6.889  13.726
  333   1HZ   LYS  45          1HZ       LYS  45  -2.558   9.099  14.666
  334   2HZ   LYS  45          2HZ       LYS  45  -4.202   9.057  14.747
  335   3HZ   LYS  45          3HZ       LYS  45  -3.304   8.019  15.651
  336    H    ASP  46           H        ASP  46  -5.725   7.959   7.928
  337    HA   ASP  46           HA       ASP  46  -7.451   6.058   9.061
  338   1HB   ASP  46          2HB       ASP  46  -8.168   8.318   8.280
  339   2HB   ASP  46          3HB       ASP  46  -8.112   7.717   6.608
  340    H    VAL  47           H        VAL  47  -6.325   6.205   5.614
  341    HA   VAL  47           HA       VAL  47  -7.680   3.862   4.859
  342    HB   VAL  47           HB       VAL  47  -6.432   3.695   2.944
  343   1HG1  VAL  47          1HG1      VAL  47  -6.173   6.648   3.208
  344   2HG1  VAL  47          2HG1      VAL  47  -6.844   5.675   1.909
  345   3HG1  VAL  47          3HG1      VAL  47  -7.772   5.913   3.408
  346   1HG2  VAL  47          1HG2      VAL  47  -4.211   5.401   3.914
  347   2HG2  VAL  47          2HG2      VAL  47  -4.140   3.639   3.729
  348   3HG2  VAL  47          3HG2      VAL  47  -4.398   4.678   2.325
  349    H    PHE  48           H        PHE  48  -4.431   4.165   6.384
  350    HA   PHE  48           HA       PHE  48  -3.777   1.422   6.415
  351   1HB   PHE  48          2HB       PHE  48  -3.213   3.398   8.612
  352   2HB   PHE  48          3HB       PHE  48  -2.447   1.838   8.373
  353    HD1  PHE  48           1HD      PHE  48  -0.869   4.225   8.742
  354    HD2  PHE  48           2HD      PHE  48  -2.411   2.491   5.093
  355    HE1  PHE  48           1HE      PHE  48   0.932   5.289   7.455
  356    HE2  PHE  48           2HE      PHE  48  -0.608   3.565   3.822
  357    HZ   PHE  48           HZ       PHE  48   1.068   4.991   4.990
  358    H    ARG  49           H        ARG  49  -6.186   3.092   8.472
  359    HA   ARG  49           HA       ARG  49  -6.443   0.892  10.342
  360   1HB   ARG  49          2HB       ARG  49  -8.580   2.870   9.463
  361   2HB   ARG  49          3HB       ARG  49  -8.613   1.825  10.883
  362   1HG   ARG  49          2HG       ARG  49  -6.673   3.015  11.856
  363   2HG   ARG  49          3HG       ARG  49  -6.535   4.009  10.402
  364   1HD   ARG  49          2HD       ARG  49  -7.702   5.324  12.020
  365   2HD   ARG  49          3HD       ARG  49  -8.820   4.862  10.722
  366    HE   ARG  49           HE       ARG  49  -8.811   2.992  12.959
  367   1HH1  ARG  49          2HH2      ARG  49 -10.266   5.948  11.680
  368   2HH1  ARG  49          1HH2      ARG  49 -11.538   6.025  12.856
  369   1HH2  ARG  49          2HH1      ARG  49 -10.544   2.984  14.463
  370   2HH2  ARG  49          1HH1      ARG  49 -11.736   4.243  14.454
  371    H    PHE  50           H        PHE  50  -7.832   1.673   7.163
  372    HA   PHE  50           HA       PHE  50  -9.694  -0.537   7.107
  373   1HB   PHE  50          2HB       PHE  50  -9.406   1.684   5.591
  374   2HB   PHE  50          3HB       PHE  50  -8.545   0.558   4.558
  375    HD1  PHE  50           1HD      PHE  50 -11.732   1.901   5.412
  376    HD2  PHE  50           2HD      PHE  50  -9.890  -1.816   4.236
  377    HE1  PHE  50           1HE      PHE  50 -13.935   0.998   4.755
  378    HE2  PHE  50           2HE      PHE  50 -12.088  -2.664   3.482
  379    HZ   PHE  50           HZ       PHE  50 -14.114  -1.258   3.733
  380    H    ILE  51           H        ILE  51  -6.338   0.002   5.969
  381    HA   ILE  51           HA       ILE  51  -5.973  -2.545   4.776
  382    HB   ILE  51           HB       ILE  51  -3.871  -0.859   6.172
  383   1HG1  ILE  51          2HG1      ILE  51  -4.759   0.522   4.416
  384   2HG1  ILE  51          3HG1      ILE  51  -3.247  -0.160   3.845
  385   1HG2  ILE  51          1HG2      ILE  51  -3.541  -3.078   4.124
  386   2HG2  ILE  51          2HG2      ILE  51  -2.269  -2.046   4.818
  387   3HG2  ILE  51          3HG2      ILE  51  -3.158  -3.167   5.846
  388   1HD1  ILE  51          1HD1      ILE  51  -4.748  -0.268   2.038
  389   2HD1  ILE  51          2HD1      ILE  51  -4.671  -1.927   2.621
  390   3HD1  ILE  51          3HD1      ILE  51  -6.073  -0.911   3.035
  391    H    ASP  52           H        ASP  52  -5.189  -1.518   8.137
  392    HA   ASP  52           HA       ASP  52  -4.308  -4.157   8.864
  393   1HB   ASP  52          2HB       ASP  52  -3.497  -1.837   9.746
  394   2HB   ASP  52          3HB       ASP  52  -4.855  -1.941  10.869
  395    H    ASN  53           H        ASN  53  -6.404  -4.974   8.015
  396    HA   ASN  53           HA       ASN  53  -8.926  -4.634   9.135
  397   1HB   ASN  53          2HB       ASN  53  -8.501  -5.788   7.041
  398   2HB   ASN  53          3HB       ASN  53  -7.655  -7.101   7.878
  399   1HD2  ASN  53          1HD2      ASN  53  -8.889  -8.900   8.432
  400   2HD2  ASN  53          2HD2      ASN  53 -10.642  -8.893   8.428
  401    H    ASP  54           H        ASP  54  -6.243  -6.570  10.348
  402    HA   ASP  54           HA       ASP  54  -7.736  -8.037  12.369
  403   1HB   ASP  54          2HB       ASP  54  -5.437  -8.738  13.000
  404   2HB   ASP  54          3HB       ASP  54  -5.753  -9.001  11.278
  405    H    GLN  55           H        GLN  55  -6.021  -4.948  12.086
  406    HA   GLN  55           HA       GLN  55  -5.443  -3.365  13.492
  407   1HB   GLN  55          2HB       GLN  55  -8.071  -4.191  14.592
  408   2HB   GLN  55          3HB       GLN  55  -7.074  -3.156  15.625
  409   1HG   GLN  55          2HG       GLN  55  -6.764  -1.521  13.841
  410   2HG   GLN  55          3HG       GLN  55  -7.697  -2.516  12.717
  411   1HE2  GLN  55          1HE2      GLN  55  -9.961  -3.202  13.778
  412   2HE2  GLN  55          2HE2      GLN  55 -10.860  -1.824  14.396
  413    H    SER  56           H        SER  56  -3.672  -4.938  13.551
  414    HA   SER  56           HA       SER  56  -3.010  -5.914  16.303
  415   1HB   SER  56          2HB       SER  56  -0.952  -6.761  15.324
  416   2HB   SER  56          3HB       SER  56  -2.371  -7.411  14.516
  417    HG   SER  56           HG       SER  56  -0.538  -6.614  13.172
  418    H    GLY  57           H        GLY  57  -1.898  -3.579  13.861
  419   1HA   GLY  57          1HA       GLY  57  -0.848  -1.436  14.599
  420   2HA   GLY  57          2HA       GLY  57   0.001  -2.354  15.849
  421    H    TYR  58           H        TYR  58   0.103  -4.643  13.640
  422    HA   TYR  58           HA       TYR  58   2.478  -3.566  12.163
  423   1HB   TYR  58          2HB       TYR  58   2.065  -6.345  13.303
  424   2HB   TYR  58          3HB       TYR  58   3.399  -5.843  12.272
  425    HD1  TYR  58           HD1      TYR  58   4.859  -3.819  13.110
  426    HD2  TYR  58           HD2      TYR  58   2.306  -6.189  15.656
  427    HE1  TYR  58           HE1      TYR  58   6.099  -3.025  15.105
  428    HE2  TYR  58           HE2      TYR  58   3.542  -5.392  17.640
  429    HH   TYR  58           HH       TYR  58   5.206  -4.002  18.426
  430    H    LEU  59           H        LEU  59   2.581  -3.951  10.044
  431    HA   LEU  59           HA       LEU  59   0.418  -5.539   8.753
  432   1HB   LEU  59          2HB       LEU  59   1.737  -2.976   8.248
  433   2HB   LEU  59          3HB       LEU  59   1.944  -4.050   6.871
  434    HG   LEU  59           HG       LEU  59  -0.801  -3.908   8.076
  435   1HD1  LEU  59          1HD1      LEU  59   0.095  -1.705   6.219
  436   2HD1  LEU  59          2HD1      LEU  59  -1.461  -1.928   7.034
  437   3HD1  LEU  59          3HD1      LEU  59  -0.036  -1.524   7.986
  438   1HD2  LEU  59          1HD2      LEU  59  -0.037  -5.406   6.155
  439   2HD2  LEU  59          2HD2      LEU  59  -1.366  -4.342   5.705
  440   3HD2  LEU  59          3HD2      LEU  59   0.298  -3.936   5.233
  441    H    ASP  60           H        ASP  60   1.680  -7.339   9.805
  442    HA   ASP  60           HA       ASP  60   4.073  -8.307   8.879
  443   1HB   ASP  60          2HB       ASP  60   1.559  -9.922   9.479
  444   2HB   ASP  60          3HB       ASP  60   3.226 -10.492   9.609
  445    H    GLU  61           H        GLU  61   4.576 -10.058   7.333
  446    HA   GLU  61           HA       GLU  61   4.173  -9.462   4.715
  447   1HB   GLU  61          2HB       GLU  61   4.771 -12.143   6.025
  448   2HB   GLU  61          3HB       GLU  61   4.778 -11.909   4.269
  449   1HG   GLU  61          2HG       GLU  61   6.425 -10.161   4.426
  450   2HG   GLU  61          3HG       GLU  61   6.488 -10.275   6.200
  451    H    GLU  62           H        GLU  62   2.284 -12.048   6.334
  452    HA   GLU  62           HA       GLU  62   0.691 -12.563   4.023
  453   1HB   GLU  62          2HB       GLU  62   0.948 -14.230   5.775
  454   2HB   GLU  62          3HB       GLU  62   0.246 -13.162   7.000
  455   1HG   GLU  62          2HG       GLU  62  -1.929 -13.406   6.198
  456   2HG   GLU  62          3HG       GLU  62  -1.399 -13.863   4.581
  457    H    GLU  63           H        GLU  63   0.464  -9.999   6.407
  458    HA   GLU  63           HA       GLU  63  -2.340  -9.441   5.858
  459   1HB   GLU  63          2HB       GLU  63  -0.928  -8.873   7.925
  460   2HB   GLU  63          3HB       GLU  63  -0.262  -7.532   6.984
  461   1HG   GLU  63          2HG       GLU  63  -2.514  -6.599   6.663
  462   2HG   GLU  63          3HG       GLU  63  -3.239  -8.016   7.465
  463    H    LEU  64           H        LEU  64   0.872  -8.354   4.761
  464    HA   LEU  64           HA       LEU  64   0.071  -6.402   2.906
  465   1HB   LEU  64          2HB       LEU  64   2.470  -7.463   3.672
  466   2HB   LEU  64          3HB       LEU  64   2.312  -8.171   2.076
  467    HG   LEU  64           HG       LEU  64   3.587  -6.176   1.915
  468   1HD1  LEU  64          1HD1      LEU  64   2.568  -4.981   0.208
  469   2HD1  LEU  64          2HD1      LEU  64   1.658  -6.495   0.169
  470   3HD1  LEU  64          3HD1      LEU  64   0.960  -5.072   0.929
  471   1HD2  LEU  64          1HD2      LEU  64   2.988  -4.023   2.687
  472   2HD2  LEU  64          2HD2      LEU  64   1.358  -4.531   3.164
  473   3HD2  LEU  64          3HD2      LEU  64   2.765  -5.123   4.062
  474    H    LYS  65           H        LYS  65   0.284  -9.941   2.585
  475    HA   LYS  65           HA       LYS  65  -0.416 -10.273  -0.104
  476   1HB   LYS  65          2HB       LYS  65   0.259 -12.026   1.619
  477   2HB   LYS  65          3HB       LYS  65  -1.444 -12.025   2.116
  478   1HG   LYS  65          2HG       LYS  65  -2.180 -12.870  -0.021
  479   2HG   LYS  65          3HG       LYS  65  -0.567 -12.629  -0.710
  480   1HD   LYS  65          2HD       LYS  65  -0.766 -14.974  -0.239
  481   2HD   LYS  65          3HD       LYS  65   0.355 -14.271   0.931
  482   1HE   LYS  65          2HE       LYS  65  -1.861 -14.091   2.441
  483   2HE   LYS  65          3HE       LYS  65  -2.477 -15.316   1.344
  484   1HZ   LYS  65          1HZ       LYS  65  -0.651 -16.737   2.042
  485   2HZ   LYS  65          2HZ       LYS  65  -0.005 -15.521   2.956
  486   3HZ   LYS  65          3HZ       LYS  65  -1.404 -16.160   3.391
  487    H    PHE  66           H        PHE  66  -2.455  -8.931   2.395
  488    HA   PHE  66           HA       PHE  66  -4.501  -8.647   0.310
  489   1HB   PHE  66          2HB       PHE  66  -5.162  -9.191   3.240
  490   2HB   PHE  66          3HB       PHE  66  -6.326  -8.864   1.963
  491    HD1  PHE  66           1HD      PHE  66  -3.930 -11.353   3.329
  492    HD2  PHE  66           2HD      PHE  66  -7.192 -10.666   0.584
  493    HE1  PHE  66           1HE      PHE  66  -4.215 -13.791   3.030
  494    HE2  PHE  66           2HE      PHE  66  -7.323 -13.085   0.132
  495    HZ   PHE  66           HZ       PHE  66  -5.846 -14.666   1.358
  496    H    PHE  67           H        PHE  67  -2.542  -6.844   0.647
  497    HA   PHE  67           HA       PHE  67  -3.416  -4.661   2.366
  498   1HB   PHE  67          2HB       PHE  67  -1.134  -4.922   1.928
  499   2HB   PHE  67          3HB       PHE  67  -1.327  -4.940   0.194
  500    HD1  PHE  67           1HD      PHE  67  -1.449  -2.861  -1.069
  501    HD2  PHE  67           2HD      PHE  67  -0.983  -2.892   3.202
  502    HE1  PHE  67           1HE      PHE  67  -0.816  -0.477  -1.124
  503    HE2  PHE  67           2HE      PHE  67  -0.412  -0.479   3.163
  504    HZ   PHE  67           HZ       PHE  67  -0.332   0.741   0.996
  505    H    LEU  68           H        LEU  68  -3.033  -4.523  -1.237
  506    HA   LEU  68           HA       LEU  68  -5.099  -2.509  -1.337
  507   1HB   LEU  68          2HB       LEU  68  -2.929  -3.122  -2.895
  508   2HB   LEU  68          3HB       LEU  68  -4.229  -3.842  -3.823
  509    HG   LEU  68           HG       LEU  68  -5.376  -1.505  -3.609
  510   1HD1  LEU  68          1HD1      LEU  68  -2.467  -0.830  -2.950
  511   2HD1  LEU  68          2HD1      LEU  68  -3.762   0.348  -3.242
  512   3HD1  LEU  68          3HD1      LEU  68  -3.803  -0.684  -1.797
  513   1HD2  LEU  68          1HD2      LEU  68  -3.983  -0.623  -5.499
  514   2HD2  LEU  68          2HD2      LEU  68  -2.809  -1.924  -5.200
  515   3HD2  LEU  68          3HD2      LEU  68  -4.463  -2.313  -5.718
  516    H    GLN  69           H        GLN  69  -5.350  -5.886  -1.231
  517    HA   GLN  69           HA       GLN  69  -7.454  -6.610  -2.906
  518   1HB   GLN  69          2HB       GLN  69  -6.838  -7.374  -0.022
  519   2HB   GLN  69          3HB       GLN  69  -8.173  -8.102  -0.916
  520   1HG   GLN  69          2HG       GLN  69  -5.292  -8.213  -1.877
  521   2HG   GLN  69          3HG       GLN  69  -6.077  -9.475  -0.941
  522   1HE2  GLN  69          1HE2      GLN  69  -5.465  -8.445  -4.134
  523   2HE2  GLN  69          2HE2      GLN  69  -6.788  -9.347  -4.875
  524    H    LYS  70           H        LYS  70  -7.691  -4.966   0.267
  525    HA   LYS  70           HA       LYS  70 -10.556  -4.961   0.307
  526   1HB   LYS  70          2HB       LYS  70 -10.215  -3.084   2.019
  527   2HB   LYS  70          3HB       LYS  70  -9.793  -4.734   2.425
  528   1HG   LYS  70          2HG       LYS  70  -7.662  -2.933   1.308
  529   2HG   LYS  70          3HG       LYS  70  -8.222  -2.615   2.937
  530   1HD   LYS  70          2HD       LYS  70  -6.986  -5.229   2.010
  531   2HD   LYS  70          3HD       LYS  70  -6.247  -3.972   2.998
  532   1HE   LYS  70          2HE       LYS  70  -8.072  -4.462   4.745
  533   2HE   LYS  70          3HE       LYS  70  -8.432  -5.907   3.782
  534   1HZ   LYS  70          1HZ       LYS  70  -5.928  -6.304   3.967
  535   2HZ   LYS  70          2HZ       LYS  70  -5.981  -5.241   5.236
  536   3HZ   LYS  70          3HZ       LYS  70  -6.866  -6.615   5.299
  537    H    PHE  71           H        PHE  71  -8.482  -3.186  -1.713
  538    HA   PHE  71           HA       PHE  71 -10.456  -0.973  -2.061
  539   1HB   PHE  71          2HB       PHE  71  -7.629  -1.297  -3.096
  540   2HB   PHE  71          3HB       PHE  71  -8.662   0.097  -3.304
  541    HD1  PHE  71           1HD      PHE  71  -6.001   0.491  -2.308
  542    HD2  PHE  71           2HD      PHE  71  -9.582  -0.426  -0.077
  543    HE1  PHE  71           1HE      PHE  71  -5.024   1.524  -0.278
  544    HE2  PHE  71           2HE      PHE  71  -8.600   0.578   1.923
  545    HZ   PHE  71           HZ       PHE  71  -6.340   1.610   1.830
  546    H    GLU  72           H        GLU  72  -8.437  -3.209  -4.061
  547    HA   GLU  72           HA       GLU  72 -10.360  -2.708  -6.287
  548   1HB   GLU  72          2HB       GLU  72  -7.788  -2.338  -6.407
  549   2HB   GLU  72          3HB       GLU  72  -7.716  -4.111  -6.519
  550   1HG   GLU  72          2HG       GLU  72  -7.619  -3.212  -8.725
  551   2HG   GLU  72          3HG       GLU  72  -9.198  -3.981  -8.553
  552    H    SER  73           H        SER  73  -9.468  -5.281  -4.089
  553    HA   SER  73           HA       SER  73 -10.130  -7.396  -3.850
  554   1HB   SER  73          2HB       SER  73 -12.351  -6.469  -4.751
  555   2HB   SER  73          3HB       SER  73 -11.929  -7.257  -6.286
  556    HG   SER  73           HG       SER  73 -13.162  -8.587  -4.850
  557    H    GLY  74           H        GLY  74  -9.624  -6.600  -7.280
  558   1HA   GLY  74          1HA       GLY  74  -8.091  -9.157  -7.696
  559   2HA   GLY  74          2HA       GLY  74  -8.762  -8.115  -8.952
  560    H    ALA  75           H        ALA  75  -6.851  -7.159  -6.072
  561    HA   ALA  75           HA       ALA  75  -5.033  -5.613  -7.805
  562   1HB   ALA  75          1HB       ALA  75  -4.159  -4.718  -5.787
  563   2HB   ALA  75          2HB       ALA  75  -5.908  -4.694  -5.640
  564   3HB   ALA  75          3HB       ALA  75  -4.997  -5.943  -4.788
  565    H    ARG  76           H        ARG  76  -2.627  -5.806  -6.359
  566    HA   ARG  76           HA       ARG  76  -1.686  -8.106  -7.931
  567   1HB   ARG  76          2HB       ARG  76  -0.834  -5.575  -8.003
  568   2HB   ARG  76          3HB       ARG  76   0.073  -6.066  -6.569
  569   1HG   ARG  76          2HG       ARG  76   1.599  -6.749  -8.088
  570   2HG   ARG  76          3HG       ARG  76   0.637  -8.202  -8.178
  571   1HD   ARG  76          2HD       ARG  76   0.535  -7.811 -10.390
  572   2HD   ARG  76          3HD       ARG  76  -0.760  -6.665 -10.012
  573    HE   ARG  76           HE       ARG  76   1.836  -5.450  -9.714
  574   1HH1  ARG  76          2HH2      ARG  76  -0.154  -6.645 -12.340
  575   2HH1  ARG  76          1HH2      ARG  76   0.901  -6.045 -13.586
  576   1HH2  ARG  76          2HH1      ARG  76   3.240  -4.957 -11.108
  577   2HH2  ARG  76          1HH1      ARG  76   2.961  -4.896 -12.851
  578    H    GLU  77           H        GLU  77  -2.306  -7.343  -4.720
  579    HA   GLU  77           HA       GLU  77  -0.329  -7.892  -3.192
  580   1HB   GLU  77          2HB       GLU  77  -2.935  -9.186  -2.415
  581   2HB   GLU  77          3HB       GLU  77  -1.768  -8.290  -1.424
  582   1HG   GLU  77          2HG       GLU  77  -3.860  -7.249  -3.338
  583   2HG   GLU  77          3HG       GLU  77  -3.569  -6.826  -1.644
  584    H    LEU  78           H        LEU  78  -2.164 -10.499  -4.602
  585    HA   LEU  78           HA       LEU  78  -0.992 -12.758  -3.493
  586   1HB   LEU  78          2HB       LEU  78  -1.504 -12.685  -6.474
  587   2HB   LEU  78          3HB       LEU  78  -1.680 -14.003  -5.326
  588    HG   LEU  78           HG       LEU  78  -3.846 -13.517  -5.782
  589   1HD1  LEU  78          1HD1      LEU  78  -3.474 -13.316  -3.311
  590   2HD1  LEU  78          2HD1      LEU  78  -3.596 -11.552  -3.482
  591   3HD1  LEU  78          3HD1      LEU  78  -4.954 -12.573  -3.938
  592   1HD2  LEU  78          1HD2      LEU  78  -3.868 -11.815  -7.277
  593   2HD2  LEU  78          2HD2      LEU  78  -4.674 -11.025  -5.915
  594   3HD2  LEU  78          3HD2      LEU  78  -2.962 -10.687  -6.281
  595    H    THR  79           H        THR  79   0.371 -10.735  -6.164
  596    HA   THR  79           HA       THR  79   2.566 -12.473  -6.700
  597    HB   THR  79           HB       THR  79   2.447  -9.479  -7.228
  598    HG1  THR  79           1HG      THR  79   2.064 -10.591  -9.355
  599   1HG2  THR  79          1HG2      THR  79   4.721 -10.500  -7.457
  600   2HG2  THR  79          2HG2      THR  79   4.046 -11.804  -8.442
  601   3HG2  THR  79          3HG2      THR  79   4.057 -10.147  -9.056
  602    H    GLU  80           H        GLU  80   3.900 -12.975  -5.238
  603    HA   GLU  80           HA       GLU  80   4.475 -11.558  -2.858
  604   1HB   GLU  80          2HB       GLU  80   6.300 -13.124  -2.486
  605   2HB   GLU  80          3HB       GLU  80   4.796 -13.919  -2.957
  606   1HG   GLU  80          2HG       GLU  80   5.683 -14.210  -5.278
  607   2HG   GLU  80          3HG       GLU  80   7.205 -13.449  -4.766
  608    H    SER  81           H        SER  81   6.300 -11.584  -6.003
  609    HA   SER  81           HA       SER  81   8.446 -10.044  -5.352
  610   1HB   SER  81          2HB       SER  81   6.897  -9.288  -7.844
  611   2HB   SER  81          3HB       SER  81   8.622  -9.492  -7.614
  612    HG   SER  81           HG       SER  81   7.597 -11.050  -8.846
  613    H    GLU  82           H        GLU  82   5.259  -8.733  -6.381
  614    HA   GLU  82           HA       GLU  82   6.150  -6.022  -6.185
  615   1HB   GLU  82          2HB       GLU  82   3.310  -7.096  -6.495
  616   2HB   GLU  82          3HB       GLU  82   3.900  -5.477  -6.909
  617   1HG   GLU  82          2HG       GLU  82   5.693  -6.769  -8.333
  618   2HG   GLU  82          3HG       GLU  82   4.591  -8.150  -8.191
  619    H    THR  83           H        THR  83   4.053  -8.101  -4.164
  620    HA   THR  83           HA       THR  83   3.505  -6.300  -2.121
  621    HB   THR  83           HB       THR  83   3.835  -9.274  -2.342
  622    HG1  THR  83           1HG      THR  83   1.932  -8.027  -0.809
  623   1HG2  THR  83          1HG2      THR  83   5.018  -9.104  -0.235
  624   2HG2  THR  83          2HG2      THR  83   3.876  -7.892   0.367
  625   3HG2  THR  83          3HG2      THR  83   3.353  -9.572   0.106
  626    H    LYS  84           H        LYS  84   6.416  -8.365  -2.595
  627    HA   LYS  84           HA       LYS  84   7.698  -7.451  -0.219
  628   1HB   LYS  84          2HB       LYS  84   8.713  -9.026  -2.590
  629   2HB   LYS  84          3HB       LYS  84   9.711  -8.664  -1.183
  630   1HG   LYS  84          2HG       LYS  84   6.998  -9.993  -0.873
  631   2HG   LYS  84          3HG       LYS  84   8.418 -10.940  -1.260
  632   1HD   LYS  84          2HD       LYS  84   8.672  -9.045   1.075
  633   2HD   LYS  84          3HD       LYS  84   7.561 -10.408   1.279
  634   1HE   LYS  84          2HE       LYS  84   9.309 -12.016   0.704
  635   2HE   LYS  84          3HE       LYS  84  10.466 -10.709   0.387
  636   1HZ   LYS  84          1HZ       LYS  84  10.708 -11.708   2.591
  637   2HZ   LYS  84          2HZ       LYS  84  10.299 -10.121   2.733
  638   3HZ   LYS  84          3HZ       LYS  84   9.192 -11.291   2.997
  639    H    SER  85           H        SER  85   7.905  -6.317  -3.624
  640    HA   SER  85           HA       SER  85   9.983  -4.458  -3.253
  641   1HB   SER  85          2HB       SER  85   7.471  -4.245  -4.944
  642   2HB   SER  85          3HB       SER  85   8.882  -3.181  -5.083
  643    HG   SER  85           HG       SER  85   8.956  -4.928  -6.561
  644    H    LEU  86           H        LEU  86   6.462  -4.172  -2.428
  645    HA   LEU  86           HA       LEU  86   6.748  -1.486  -1.390
  646   1HB   LEU  86          2HB       LEU  86   4.532  -2.992  -1.826
  647   2HB   LEU  86          3HB       LEU  86   4.757  -3.410  -0.162
  648    HG   LEU  86           HG       LEU  86   3.196  -1.546  -0.531
  649   1HD1  LEU  86          1HD1      LEU  86   5.656  -0.768   1.071
  650   2HD1  LEU  86          2HD1      LEU  86   4.056  -0.065   1.237
  651   3HD1  LEU  86          3HD1      LEU  86   4.311  -1.776   1.652
  652   1HD2  LEU  86          1HD2      LEU  86   4.639  -0.373  -2.397
  653   2HD2  LEU  86          2HD2      LEU  86   3.737   0.579  -1.245
  654   3HD2  LEU  86          3HD2      LEU  86   5.486   0.369  -1.041
  655    H    MET  87           H        MET  87   6.495  -4.649   0.297
  656    HA   MET  87           HA       MET  87   6.995  -3.759   2.795
  657   1HB   MET  87          2HB       MET  87   6.359  -6.046   2.140
  658   2HB   MET  87          3HB       MET  87   8.029  -6.386   1.676
  659   1HG   MET  87          2HG       MET  87   8.775  -6.556   3.814
  660   2HG   MET  87          3HG       MET  87   7.660  -5.362   4.469
  661   1HE   MET  87          1HE       MET  87   4.899  -6.021   3.905
  662   2HE   MET  87          2HE       MET  87   4.374  -7.284   5.041
  663   3HE   MET  87          3HE       MET  87   5.331  -5.937   5.626
  664    H    ALA  88           H        ALA  88   9.509  -4.730   0.509
  665    HA   ALA  88           HA       ALA  88  11.836  -4.620   1.998
  666   1HB   ALA  88          1HB       ALA  88  12.933  -4.126  -0.213
  667   2HB   ALA  88          2HB       ALA  88  11.766  -5.458  -0.291
  668   3HB   ALA  88          3HB       ALA  88  11.321  -3.861  -0.916
  669    H    ALA  89           H        ALA  89  10.153  -1.890   0.371
  670    HA   ALA  89           HA       ALA  89  12.289  -0.018   1.208
  671   1HB   ALA  89          1HB       ALA  89  11.322   0.229  -0.973
  672   2HB   ALA  89          2HB       ALA  89   9.682   0.402  -0.289
  673   3HB   ALA  89          3HB       ALA  89  10.916   1.648   0.020
  674    H    ALA  90           H        ALA  90   8.803  -0.589   1.851
  675    HA   ALA  90           HA       ALA  90   8.392   1.556   3.678
  676   1HB   ALA  90          1HB       ALA  90   6.523   0.413   2.767
  677   2HB   ALA  90          2HB       ALA  90   7.110  -1.158   3.364
  678   3HB   ALA  90          3HB       ALA  90   6.540   0.082   4.515
  679    H    ASP  91           H        ASP  91   9.602  -1.774   4.258
  680    HA   ASP  91           HA       ASP  91   9.686  -1.327   7.103
  681   1HB   ASP  91          2HB       ASP  91   9.407  -3.605   6.104
  682   2HB   ASP  91          3HB       ASP  91  11.064  -3.506   5.483
  683    H    ASN  92           H        ASN  92  10.840   0.673   7.168
  684    HA   ASN  92           HA       ASN  92  13.657   0.739   6.346
  685   1HB   ASN  92          2HB       ASN  92  13.693   2.966   7.351
  686   2HB   ASN  92          3HB       ASN  92  12.414   2.746   6.153
  687   1HD2  ASN  92          1HD2      ASN  92  12.010   4.897   7.518
  688   2HD2  ASN  92          2HD2      ASN  92  10.754   4.734   8.716
  689    H    ASP  93           H        ASP  93  13.476  -1.459   7.752
  690    HA   ASP  93           HA       ASP  93  15.049  -0.962  10.240
  691   1HB   ASP  93          2HB       ASP  93  12.669  -2.850   9.920
  692   2HB   ASP  93          3HB       ASP  93  13.871  -2.999  11.198
  693    H    GLY  94           H        GLY  94  13.679  -3.532   8.139
  694   1HA   GLY  94          1HA       GLY  94  14.964  -5.206   6.976
  695   2HA   GLY  94          2HA       GLY  94  16.287  -5.013   8.137
  696    H    ASP  95           H        ASP  95  12.741  -5.219   8.617
  697    HA   ASP  95           HA       ASP  95  13.024  -7.817  10.020
  698   1HB   ASP  95          2HB       ASP  95  11.392  -7.233  11.673
  699   2HB   ASP  95          3HB       ASP  95  12.794  -6.166  11.770
  700    H    GLY  96           H        GLY  96  10.409  -5.644   8.813
  701   1HA   GLY  96          1HA       GLY  96   9.420  -6.310   6.574
  702   2HA   GLY  96          2HA       GLY  96   9.296  -7.949   7.226
  703    H    LYS  97           H        LYS  97   8.786  -6.451   9.961
  704    HA   LYS  97           HA       LYS  97   5.829  -6.354   9.700
  705   1HB   LYS  97          2HB       LYS  97   7.709  -6.375  12.099
  706   2HB   LYS  97          3HB       LYS  97   5.949  -6.141  12.179
  707   1HG   LYS  97          2HG       LYS  97   5.645  -8.284  10.913
  708   2HG   LYS  97          3HG       LYS  97   7.398  -8.567  11.004
  709   1HD   LYS  97          2HD       LYS  97   7.219  -8.543  13.509
  710   2HD   LYS  97          3HD       LYS  97   5.471  -8.249  13.333
  711   1HE   LYS  97          2HE       LYS  97   5.768 -10.454  11.706
  712   2HE   LYS  97          3HE       LYS  97   7.047 -10.782  12.881
  713   1HZ   LYS  97          1HZ       LYS  97   4.187 -10.293  13.284
  714   2HZ   LYS  97          2HZ       LYS  97   4.940 -11.720  13.535
  715   3HZ   LYS  97          3HZ       LYS  97   5.228 -10.463  14.579
  716    H    ILE  98           H        ILE  98   5.350  -4.509   8.745
  717    HA   ILE  98           HA       ILE  98   6.854  -2.047   9.316
  718    HB   ILE  98           HB       ILE  98   4.703  -2.734   7.317
  719   1HG1  ILE  98          2HG1      ILE  98   7.632  -2.087   6.858
  720   2HG1  ILE  98          3HG1      ILE  98   7.158  -3.745   7.169
  721   1HG2  ILE  98          1HG2      ILE  98   6.517  -0.271   7.417
  722   2HG2  ILE  98          2HG2      ILE  98   5.218  -0.567   6.278
  723   3HG2  ILE  98          3HG2      ILE  98   4.836  -0.251   7.964
  724   1HD1  ILE  98          1HD1      ILE  98   7.361  -3.091   4.786
  725   2HD1  ILE  98          2HD1      ILE  98   5.822  -3.872   5.222
  726   3HD1  ILE  98          3HD1      ILE  98   5.869  -2.141   4.940
  727    H    GLY  99           H        GLY  99   6.226  -0.851  11.038
  728   1HA   GLY  99          1HA       GLY  99   3.550  -0.904  12.158
  729   2HA   GLY  99          2HA       GLY  99   4.842   0.251  12.525
  730    H    ALA 100           H        ALA 100   2.244   1.183  12.376
  731    HA   ALA 100           HA       ALA 100   1.442   2.116   9.794
  732   1HB   ALA 100          1HB       ALA 100   0.032   3.695  11.034
  733   2HB   ALA 100          2HB       ALA 100  -0.113   2.047  11.671
  734   3HB   ALA 100          3HB       ALA 100   0.855   3.262  12.550
  735    H    GLU 101           H        GLU 101   3.613   3.431  12.314
  736    HA   GLU 101           HA       GLU 101   4.045   5.929  11.077
  737   1HB   GLU 101          2HB       GLU 101   5.737   4.322  13.030
  738   2HB   GLU 101          3HB       GLU 101   6.148   5.956  12.487
  739   1HG   GLU 101          2HG       GLU 101   4.026   6.843  13.311
  740   2HG   GLU 101          3HG       GLU 101   3.472   5.228  13.789
  741    H    GLU 102           H        GLU 102   6.105   2.949  10.951
  742    HA   GLU 102           HA       GLU 102   7.955   3.644   9.036
  743   1HB   GLU 102          2HB       GLU 102   6.414   1.020   9.194
  744   2HB   GLU 102          3HB       GLU 102   7.942   1.285   8.332
  745   1HG   GLU 102          2HG       GLU 102   9.050   1.736  10.504
  746   2HG   GLU 102          3HG       GLU 102   7.538   1.373  11.348
  747    H    PHE 103           H        PHE 103   4.633   2.417   8.414
  748    HA   PHE 103           HA       PHE 103   4.739   2.693   5.580
  749   1HB   PHE 103          2HB       PHE 103   2.632   2.224   7.629
  750   2HB   PHE 103          3HB       PHE 103   2.092   3.062   6.207
  751    HD1  PHE 103           1HD      PHE 103   2.638   2.200   3.868
  752    HD2  PHE 103           2HD      PHE 103   2.623  -0.174   7.470
  753    HE1  PHE 103           1HE      PHE 103   2.252   0.140   2.533
  754    HE2  PHE 103           2HE      PHE 103   2.714  -2.226   6.085
  755    HZ   PHE 103           HZ       PHE 103   2.381  -2.082   3.630
  756    H    GLN 104           H        GLN 104   3.396   5.003   7.995
  757    HA   GLN 104           HA       GLN 104   2.407   7.019   6.191
  758   1HB   GLN 104          2HB       GLN 104   1.990   6.848   8.689
  759   2HB   GLN 104          3HB       GLN 104   3.627   7.458   8.949
  760   1HG   GLN 104          2HG       GLN 104   3.052   9.494   7.596
  761   2HG   GLN 104          3HG       GLN 104   1.414   8.866   7.374
  762   1HE2  GLN 104          1HE2      GLN 104   0.360   8.173   9.630
  763   2HE2  GLN 104          2HE2      GLN 104   0.554   9.393  10.885
  764    H    GLU 105           H        GLU 105   5.638   6.667   7.824
  765    HA   GLU 105           HA       GLU 105   6.925   8.915   6.783
  766   1HB   GLU 105          2HB       GLU 105   7.922   6.099   7.388
  767   2HB   GLU 105          3HB       GLU 105   9.012   7.420   6.970
  768   1HG   GLU 105          2HG       GLU 105   8.484   8.646   8.934
  769   2HG   GLU 105          3HG       GLU 105   7.040   7.683   9.268
  770    H    MET 106           H        MET 106   6.911   5.584   5.373
  771    HA   MET 106           HA       MET 106   8.335   6.422   3.083
  772   1HB   MET 106          2HB       MET 106   7.299   3.933   4.074
  773   2HB   MET 106          3HB       MET 106   6.663   4.123   2.444
  774   1HG   MET 106          2HG       MET 106   8.820   3.089   2.175
  775   2HG   MET 106          3HG       MET 106   9.057   4.774   1.743
  776   1HE   MET 106          1HE       MET 106  11.598   5.038   2.093
  777   2HE   MET 106          2HE       MET 106  12.480   4.149   3.358
  778   3HE   MET 106          3HE       MET 106  11.551   3.259   2.127
  779    H    VAL 107           H        VAL 107   4.820   6.012   3.535
  780    HA   VAL 107           HA       VAL 107   4.045   6.715   0.888
  781    HB   VAL 107           HB       VAL 107   2.663   6.870   3.588
  782   1HG1  VAL 107          1HG1      VAL 107   1.589   7.624   0.853
  783   2HG1  VAL 107          2HG1      VAL 107   0.552   7.210   2.242
  784   3HG1  VAL 107          3HG1      VAL 107   1.601   8.628   2.319
  785   1HG2  VAL 107          1HG2      VAL 107   3.111   4.614   2.554
  786   2HG2  VAL 107          2HG2      VAL 107   1.378   4.979   2.662
  787   3HG2  VAL 107          3HG2      VAL 107   2.214   5.139   1.114
  788    H    HIS 108           H        HIS 108   4.713   8.732   3.730
  789    HA   HIS 108           HA       HIS 108   3.565  11.129   2.805
  790   1HB   HIS 108          2HB       HIS 108   3.939  10.742   5.138
  791   2HB   HIS 108          3HB       HIS 108   5.672  10.484   4.891
  792    HD1  HIS 108           1HD      HIS 108   3.130  13.330   5.145
  793    HD2  HIS 108           2HD      HIS 108   7.261  12.585   4.872
  794    HE1  HIS 108           1HE      HIS 108   4.313  15.513   5.761
  795    H    SER 109           H        SER 109   6.658   9.565   2.350
  796    HA   SER 109           HA       SER 109   8.338  11.628   1.757
  797   1HB   SER 109          2HB       SER 109   8.746   9.066   1.989
  798   2HB   SER 109          3HB       SER 109   8.403   8.990   0.250
  799    HG   SER 109           HG       SER 109  10.196  10.949   0.965
  Start of MODEL    8
    1   1H    MET   1           H1       MET   1 -17.144   4.212   0.542
    2   2H    MET   1           H2       MET   1 -18.737   4.334   0.893
    3   3H    MET   1           H3       MET   1 -17.789   5.585   1.161
    4    HA   MET   1           HA       MET   1 -18.357   4.493   3.176
    5   1HB   MET   1          2HB       MET   1 -18.087   2.246   3.652
    6   2HB   MET   1          3HB       MET   1 -18.676   2.280   1.986
    7   1HG   MET   1          2HG       MET   1 -16.232   2.038   1.271
    8   2HG   MET   1          3HG       MET   1 -15.888   1.631   2.961
    9   1HE   MET   1          1HE       MET   1 -16.959  -0.506   4.172
   10   2HE   MET   1          2HE       MET   1 -18.611  -0.091   3.638
   11   3HE   MET   1          3HE       MET   1 -17.954  -1.710   3.317
   12    H    SER   2           H        SER   2 -15.181   3.906   1.543
   13    HA   SER   2           HA       SER   2 -13.870   5.209   3.855
   14   1HB   SER   2          2HB       SER   2 -12.921   2.505   2.794
   15   2HB   SER   2          3HB       SER   2 -12.227   3.487   4.099
   16    HG   SER   2           HG       SER   2 -13.547   1.855   4.907
   17    H    ILE   3           H        ILE   3 -12.305   3.458   1.209
   18    HA   ILE   3           HA       ILE   3 -11.125   6.055   0.365
   19    HB   ILE   3           HB       ILE   3  -9.207   4.922  -0.217
   20   1HG1  ILE   3          2HG1      ILE   3  -9.237   2.315   0.038
   21   2HG1  ILE   3          3HG1      ILE   3 -10.921   2.438  -0.420
   22   1HG2  ILE   3          1HG2      ILE   3  -9.660   5.033   2.253
   23   2HG2  ILE   3          2HG2      ILE   3 -10.151   3.327   2.202
   24   3HG2  ILE   3          3HG2      ILE   3  -8.507   3.780   1.761
   25   1HD1  ILE   3          1HD1      ILE   3  -8.451   3.405  -1.961
   26   2HD1  ILE   3          2HD1      ILE   3  -9.486   2.042  -2.376
   27   3HD1  ILE   3          3HD1      ILE   3 -10.110   3.665  -2.544
   28    H    THR   4           H        THR   4 -13.236   3.433  -0.711
   29    HA   THR   4           HA       THR   4 -12.740   3.566  -3.475
   30    HB   THR   4           HB       THR   4 -13.384   1.549  -2.178
   31    HG1  THR   4           1HG      THR   4 -15.183   2.692  -3.904
   32   1HG2  THR   4          1HG2      THR   4 -15.675   1.301  -1.298
   33   2HG2  THR   4          2HG2      THR   4 -14.863   2.587  -0.406
   34   3HG2  THR   4          3HG2      THR   4 -16.047   2.988  -1.667
   35    H    ASP   5           H        ASP   5 -13.830   6.004  -1.691
   36    HA   ASP   5           HA       ASP   5 -16.040   7.063  -3.250
   37   1HB   ASP   5          2HB       ASP   5 -17.158   5.236  -2.064
   38   2HB   ASP   5          3HB       ASP   5 -16.291   5.678  -0.570
   39    H    VAL   6           H        VAL   6 -13.517   7.950  -2.757
   40    HA   VAL   6           HA       VAL   6 -14.012  10.337  -1.142
   41    HB   VAL   6           HB       VAL   6 -12.959   8.433   0.322
   42   1HG1  VAL   6          1HG1      VAL   6 -11.004   7.923  -1.189
   43   2HG1  VAL   6          2HG1      VAL   6 -10.376   9.544  -0.835
   44   3HG1  VAL   6          3HG1      VAL   6 -10.557   8.365   0.462
   45   1HG2  VAL   6          1HG2      VAL   6 -11.840  11.252   0.320
   46   2HG2  VAL   6          2HG2      VAL   6 -13.341  10.696   1.101
   47   3HG2  VAL   6          3HG2      VAL   6 -11.774  10.098   1.672
   48    H    LEU   7           H        LEU   7 -11.598   8.595  -3.064
   49    HA   LEU   7           HA       LEU   7 -11.190  10.559  -5.051
   50   1HB   LEU   7          2HB       LEU   7 -10.226  12.027  -3.426
   51   2HB   LEU   7          3HB       LEU   7  -9.434  10.711  -2.579
   52    HG   LEU   7           HG       LEU   7  -8.296  10.780  -5.214
   53   1HD1  LEU   7          1HD1      LEU   7  -9.129  13.065  -5.459
   54   2HD1  LEU   7          2HD1      LEU   7  -8.364  13.519  -3.913
   55   3HD1  LEU   7          3HD1      LEU   7  -7.363  13.020  -5.292
   56   1HD2  LEU   7          1HD2      LEU   7  -6.251  11.412  -3.914
   57   2HD2  LEU   7          2HD2      LEU   7  -7.262  11.712  -2.487
   58   3HD2  LEU   7          3HD2      LEU   7  -7.102  10.069  -3.156
   59    H    SER   8           H        SER   8  -9.352   8.416  -2.868
   60    HA   SER   8           HA       SER   8  -7.505   7.365  -4.350
   61   1HB   SER   8          2HB       SER   8  -9.143   5.764  -2.404
   62   2HB   SER   8          3HB       SER   8  -7.425   5.537  -2.807
   63    HG   SER   8           HG       SER   8  -7.112   7.714  -2.056
   64    H    ALA   9           H        ALA   9 -10.882   6.261  -4.730
   65    HA   ALA   9           HA       ALA   9 -10.459   3.886  -6.154
   66   1HB   ALA   9          1HB       ALA   9 -12.546   6.051  -6.680
   67   2HB   ALA   9          2HB       ALA   9 -12.642   4.358  -7.217
   68   3HB   ALA   9          3HB       ALA   9 -12.689   4.743  -5.486
   69    H    ASP  10           H        ASP  10 -10.252   7.262  -7.403
   70    HA   ASP  10           HA       ASP  10  -9.899   6.355 -10.157
   71   1HB   ASP  10          2HB       ASP  10 -10.894   8.560  -9.472
   72   2HB   ASP  10          3HB       ASP  10  -9.298   9.065  -8.889
   73    H    ASP  11           H        ASP  11  -7.874   7.266  -7.416
   74    HA   ASP  11           HA       ASP  11  -5.361   7.525  -8.764
   75   1HB   ASP  11          2HB       ASP  11  -6.073   6.814  -5.881
   76   2HB   ASP  11          3HB       ASP  11  -4.473   7.113  -6.456
   77    H    ILE  12           H        ILE  12  -6.978   4.755  -7.057
   78    HA   ILE  12           HA       ILE  12  -4.830   3.006  -7.516
   79    HB   ILE  12           HB       ILE  12  -6.288   1.243  -7.031
   80   1HG1  ILE  12          2HG1      ILE  12  -8.538   3.180  -6.766
   81   2HG1  ILE  12          3HG1      ILE  12  -8.394   1.946  -8.029
   82   1HG2  ILE  12          1HG2      ILE  12  -6.608   3.523  -5.052
   83   2HG2  ILE  12          2HG2      ILE  12  -6.621   1.793  -4.697
   84   3HG2  ILE  12          3HG2      ILE  12  -5.141   2.553  -5.272
   85   1HD1  ILE  12          1HD1      ILE  12  -8.830   1.493  -5.058
   86   2HD1  ILE  12          2HD1      ILE  12  -9.901   1.086  -6.405
   87   3HD1  ILE  12          3HD1      ILE  12  -8.381   0.199  -6.199
   88    H    ALA  13           H        ALA  13  -7.738   3.776  -9.495
   89    HA   ALA  13           HA       ALA  13  -7.330   1.872 -11.517
   90   1HB   ALA  13          1HB       ALA  13  -8.247   4.734 -12.001
   91   2HB   ALA  13          2HB       ALA  13  -8.558   3.306 -12.995
   92   3HB   ALA  13          3HB       ALA  13  -9.277   3.427 -11.377
   93    H    ALA  14           H        ALA  14  -5.835   5.140 -11.227
   94    HA   ALA  14           HA       ALA  14  -4.086   4.962 -13.480
   95   1HB   ALA  14          1HB       ALA  14  -4.443   7.028 -12.180
   96   2HB   ALA  14          2HB       ALA  14  -3.517   6.340 -10.830
   97   3HB   ALA  14          3HB       ALA  14  -2.726   6.623 -12.388
   98    H    ALA  15           H        ALA  15  -3.251   4.132 -10.063
   99    HA   ALA  15           HA       ALA  15  -0.704   3.147 -10.560
  100   1HB   ALA  15          1HB       ALA  15  -2.674   2.007  -8.521
  101   2HB   ALA  15          2HB       ALA  15  -0.898   2.059  -8.419
  102   3HB   ALA  15          3HB       ALA  15  -1.837   3.554  -8.354
  103    H    LEU  16           H        LEU  16  -3.733   1.381 -10.556
  104    HA   LEU  16           HA       LEU  16  -2.887  -1.213 -10.994
  105   1HB   LEU  16          2HB       LEU  16  -5.407   0.305 -11.504
  106   2HB   LEU  16          3HB       LEU  16  -5.188  -1.035 -12.594
  107    HG   LEU  16           HG       LEU  16  -6.558  -1.646 -10.724
  108   1HD1  LEU  16          1HD1      LEU  16  -5.170  -3.344 -11.885
  109   2HD1  LEU  16          2HD1      LEU  16  -3.929  -3.175 -10.623
  110   3HD1  LEU  16          3HD1      LEU  16  -5.549  -3.762 -10.206
  111   1HD2  LEU  16          1HD2      LEU  16  -5.704  -0.289  -8.925
  112   2HD2  LEU  16          2HD2      LEU  16  -5.628  -1.988  -8.464
  113   3HD2  LEU  16          3HD2      LEU  16  -4.141  -1.141  -8.944
  114    H    GLN  17           H        GLN  17  -3.470   1.370 -13.445
  115    HA   GLN  17           HA       GLN  17  -2.849  -0.565 -15.583
  116   1HB   GLN  17          2HB       GLN  17  -4.591   1.069 -15.935
  117   2HB   GLN  17          3HB       GLN  17  -3.440   2.408 -15.768
  118   1HG   GLN  17          2HG       GLN  17  -2.566   2.077 -17.874
  119   2HG   GLN  17          3HG       GLN  17  -2.580   0.321 -17.715
  120   1HE2  GLN  17          1HE2      GLN  17  -5.190   2.838 -17.791
  121   2HE2  GLN  17          2HE2      GLN  17  -6.110   1.993 -19.026
  122    H    GLU  18           H        GLU  18  -1.378   2.329 -14.108
  123    HA   GLU  18           HA       GLU  18   0.906   2.645 -15.621
  124   1HB   GLU  18          2HB       GLU  18   0.165   4.142 -13.852
  125   2HB   GLU  18          3HB       GLU  18   0.453   2.908 -12.620
  126   1HG   GLU  18          2HG       GLU  18   2.129   4.643 -12.605
  127   2HG   GLU  18          3HG       GLU  18   2.865   3.068 -12.972
  128    H    CYS  19           H        CYS  19   0.486   0.396 -12.823
  129    HA   CYS  19           HA       CYS  19   3.080  -0.928 -13.558
  130   1HB   CYS  19          2HB       CYS  19   1.501  -0.933 -10.964
  131   2HB   CYS  19          3HB       CYS  19   3.036  -1.781 -11.261
  132    HG   CYS  19           HG       CYS  19   2.407   1.432 -11.550
  133    H    ARG  20           H        ARG  20   1.024  -1.546 -15.329
  134    HA   ARG  20           HA       ARG  20  -0.527  -3.779 -14.360
  135   1HB   ARG  20          2HB       ARG  20  -1.269  -4.197 -16.495
  136   2HB   ARG  20          3HB       ARG  20  -1.310  -2.458 -16.282
  137   1HG   ARG  20          2HG       ARG  20   0.966  -3.820 -17.822
  138   2HG   ARG  20          3HG       ARG  20  -0.605  -3.585 -18.530
  139   1HD   ARG  20          2HD       ARG  20  -0.432  -1.115 -18.098
  140   2HD   ARG  20          3HD       ARG  20   1.192  -1.384 -17.467
  141    HE   ARG  20           HE       ARG  20   2.021  -1.933 -19.528
  142   1HH1  ARG  20          2HH2      ARG  20  -1.480  -1.912 -19.680
  143   2HH1  ARG  20          1HH2      ARG  20  -1.643  -1.655 -21.386
  144   1HH2  ARG  20          2HH1      ARG  20   1.872  -1.278 -21.862
  145   2HH2  ARG  20          1HH1      ARG  20   0.328  -1.313 -22.665
  146    H    ASP  21           H        ASP  21   2.462  -3.348 -16.116
  147    HA   ASP  21           HA       ASP  21   2.988  -6.004 -16.805
  148   1HB   ASP  21          2HB       ASP  21   4.637  -3.449 -16.558
  149   2HB   ASP  21          3HB       ASP  21   5.304  -4.948 -17.162
  150    HA   PRO  22           HA       PRO  22   3.991  -7.591 -12.861
  151   1HB   PRO  22          2HB       PRO  22   5.534  -9.809 -13.406
  152   2HB   PRO  22          3HB       PRO  22   3.776  -9.704 -13.713
  153   1HG   PRO  22          2HG       PRO  22   6.026  -9.188 -15.675
  154   2HG   PRO  22          3HG       PRO  22   4.589 -10.230 -15.911
  155   1HD   PRO  22          2HD       PRO  22   4.648  -7.693 -16.865
  156   2HD   PRO  22          3HD       PRO  22   3.154  -8.321 -16.101
  157    H    ASP  23           H        ASP  23   5.520  -7.535 -11.190
  158    HA   ASP  23           HA       ASP  23   7.227  -7.106 -10.051
  159   1HB   ASP  23          2HB       ASP  23   8.346  -8.733 -11.655
  160   2HB   ASP  23          3HB       ASP  23   9.099  -7.325 -12.424
  161    H    THR  24           H        THR  24   6.078  -5.001 -12.255
  162    HA   THR  24           HA       THR  24   8.100  -2.937 -12.209
  163    HB   THR  24           HB       THR  24   5.182  -2.731 -13.073
  164    HG1  THR  24           1HG      THR  24   5.909  -4.310 -14.284
  165   1HG2  THR  24          1HG2      THR  24   6.232  -0.525 -13.086
  166   2HG2  THR  24          2HG2      THR  24   7.649  -1.174 -13.951
  167   3HG2  THR  24          3HG2      THR  24   6.063  -1.106 -14.746
  168    H    PHE  25           H        PHE  25   5.602  -3.754  -9.999
  169    HA   PHE  25           HA       PHE  25   4.878  -1.042  -9.448
  170   1HB   PHE  25          2HB       PHE  25   3.835  -3.501  -9.033
  171   2HB   PHE  25          3HB       PHE  25   4.285  -3.069  -7.390
  172    HD1  PHE  25           1HD      PHE  25   3.529   0.012  -7.876
  173    HD2  PHE  25           2HD      PHE  25   1.557  -3.751  -8.634
  174    HE1  PHE  25           1HE      PHE  25   1.340   1.148  -7.903
  175    HE2  PHE  25           2HE      PHE  25  -0.641  -2.621  -8.534
  176    HZ   PHE  25           HZ       PHE  25  -0.766  -0.185  -8.133
  177    H    GLU  26           H        GLU  26   6.742   0.151  -8.927
  178    HA   GLU  26           HA       GLU  26   8.356  -0.530  -6.636
  179   1HB   GLU  26          2HB       GLU  26   8.338   1.639  -8.688
  180   2HB   GLU  26          3HB       GLU  26   8.845   2.149  -7.077
  181   1HG   GLU  26          2HG       GLU  26  10.460   0.117  -7.126
  182   2HG   GLU  26          3HG       GLU  26  10.148   0.114  -8.871
  183    HA   PRO  27           HA       PRO  27   5.901   1.199  -3.545
  184   1HB   PRO  27          2HB       PRO  27   7.753   2.095  -1.644
  185   2HB   PRO  27          3HB       PRO  27   7.364   0.390  -1.978
  186   1HG   PRO  27          2HG       PRO  27   9.727   1.969  -2.980
  187   2HG   PRO  27          3HG       PRO  27   9.649   0.262  -2.452
  188   1HD   PRO  27          2HD       PRO  27   9.651   0.994  -5.072
  189   2HD   PRO  27          3HD       PRO  27   8.855  -0.479  -4.442
  190    H    GLN  28           H        GLN  28   8.643   3.593  -3.672
  191    HA   GLN  28           HA       GLN  28   7.068   5.855  -3.074
  192   1HB   GLN  28          2HB       GLN  28   9.648   5.589  -4.647
  193   2HB   GLN  28          3HB       GLN  28   8.920   7.145  -4.213
  194   1HG   GLN  28          2HG       GLN  28   9.072   6.646  -1.830
  195   2HG   GLN  28          3HG       GLN  28   9.664   5.014  -2.169
  196   1HE2  GLN  28          1HE2      GLN  28  10.660   8.357  -1.690
  197   2HE2  GLN  28          2HE2      GLN  28  12.327   8.067  -2.126
  198    H    LYS  29           H        LYS  29   7.883   4.459  -6.227
  199    HA   LYS  29           HA       LYS  29   6.508   6.073  -8.025
  200   1HB   LYS  29          2HB       LYS  29   7.855   4.088  -8.629
  201   2HB   LYS  29          3HB       LYS  29   6.671   3.058  -7.832
  202   1HG   LYS  29          2HG       LYS  29   5.970   2.713  -9.920
  203   2HG   LYS  29          3HG       LYS  29   4.976   4.132  -9.599
  204   1HD   LYS  29          2HD       LYS  29   6.833   5.532 -10.673
  205   2HD   LYS  29          3HD       LYS  29   7.635   3.996 -11.086
  206   1HE   LYS  29          2HE       LYS  29   5.438   3.279 -12.220
  207   2HE   LYS  29          3HE       LYS  29   4.839   4.920 -11.952
  208   1HZ   LYS  29          1HZ       LYS  29   7.126   4.145 -13.634
  209   2HZ   LYS  29          2HZ       LYS  29   5.628   4.656 -14.094
  210   3HZ   LYS  29          3HZ       LYS  29   6.644   5.711 -13.351
  211    H    PHE  30           H        PHE  30   5.079   3.199  -6.307
  212    HA   PHE  30           HA       PHE  30   2.428   3.660  -7.082
  213   1HB   PHE  30          2HB       PHE  30   3.080   1.558  -6.136
  214   2HB   PHE  30          3HB       PHE  30   3.667   2.311  -4.676
  215    HD1  PHE  30           1HD      PHE  30   0.325   2.659  -6.444
  216    HD2  PHE  30           2HD      PHE  30   2.467   1.574  -2.868
  217    HE1  PHE  30           1HE      PHE  30  -1.803   2.095  -5.339
  218    HE2  PHE  30           2HE      PHE  30   0.313   1.350  -1.666
  219    HZ   PHE  30           HZ       PHE  30  -1.836   1.524  -2.926
  220    H    PHE  31           H        PHE  31   4.077   4.749  -4.066
  221    HA   PHE  31           HA       PHE  31   1.824   5.986  -2.908
  222   1HB   PHE  31          2HB       PHE  31   4.688   6.921  -2.630
  223   2HB   PHE  31          3HB       PHE  31   3.380   7.125  -1.471
  224    HD1  PHE  31           1HD      PHE  31   2.373   4.088  -1.776
  225    HD2  PHE  31           2HD      PHE  31   6.172   5.965  -0.956
  226    HE1  PHE  31           1HE      PHE  31   3.164   2.030  -0.672
  227    HE2  PHE  31           2HE      PHE  31   6.994   3.854   0.018
  228    HZ   PHE  31           HZ       PHE  31   5.507   1.874   0.165
  229    H    GLN  32           H        GLN  32   4.067   7.221  -5.382
  230    HA   GLN  32           HA       GLN  32   3.019   9.937  -5.253
  231   1HB   GLN  32          2HB       GLN  32   5.345   9.304  -6.072
  232   2HB   GLN  32          3HB       GLN  32   4.572   8.624  -7.511
  233   1HG   GLN  32          2HG       GLN  32   3.397  10.995  -7.668
  234   2HG   GLN  32          3HG       GLN  32   4.681  11.511  -6.573
  235   1HE2  GLN  32          1HE2      GLN  32   6.942  11.376  -7.396
  236   2HE2  GLN  32          2HE2      GLN  32   7.199  11.326  -9.133
  237    H    THR  33           H        THR  33   2.742   7.153  -7.587
  238    HA   THR  33           HA       THR  33   1.083   8.383  -9.360
  239    HB   THR  33           HB       THR  33   2.428   6.045  -9.338
  240    HG1  THR  33           1HG      THR  33   0.172   6.764 -10.751
  241   1HG2  THR  33          1HG2      THR  33   0.695   4.870  -7.853
  242   2HG2  THR  33          2HG2      THR  33  -0.441   5.102  -9.189
  243   3HG2  THR  33          3HG2      THR  33   1.031   4.131  -9.423
  244    H    SER  34           H        SER  34   0.270   6.594  -6.398
  245    HA   SER  34           HA       SER  34  -2.535   6.733  -6.992
  246   1HB   SER  34          2HB       SER  34  -1.012   5.659  -4.604
  247   2HB   SER  34          3HB       SER  34  -2.783   5.615  -4.751
  248    HG   SER  34           HG       SER  34  -2.510   4.570  -6.768
  249    H    GLY  35           H        GLY  35  -0.446   9.141  -5.743
  250   1HA   GLY  35          1HA       GLY  35  -1.085  11.240  -5.048
  251   2HA   GLY  35          2HA       GLY  35  -2.775  10.722  -4.986
  252    H    LEU  36           H        LEU  36  -1.762   8.410  -3.216
  253    HA   LEU  36           HA       LEU  36  -2.190   9.107  -0.631
  254   1HB   LEU  36          2HB       LEU  36  -0.186   7.151  -1.819
  255   2HB   LEU  36          3HB       LEU  36  -0.664   7.156  -0.132
  256    HG   LEU  36           HG       LEU  36  -2.551   6.679  -2.487
  257   1HD1  LEU  36          1HD1      LEU  36  -0.938   4.844  -2.119
  258   2HD1  LEU  36          2HD1      LEU  36  -1.448   4.743  -0.419
  259   3HD1  LEU  36          3HD1      LEU  36  -2.595   4.364  -1.722
  260   1HD2  LEU  36          1HD2      LEU  36  -3.851   7.648  -0.689
  261   2HD2  LEU  36          2HD2      LEU  36  -4.146   5.913  -0.702
  262   3HD2  LEU  36          3HD2      LEU  36  -3.056   6.607   0.516
  263    H    SER  37           H        SER  37   0.829   9.697  -2.427
  264    HA   SER  37           HA       SER  37   2.395  10.442  -0.132
  265   1HB   SER  37          2HB       SER  37   3.607   9.980  -2.137
  266   2HB   SER  37          3HB       SER  37   2.569  11.057  -3.099
  267    HG   SER  37           HG       SER  37   4.768  11.677  -1.516
  268    H    LYS  38           H        LYS  38  -0.019  12.151  -2.031
  269    HA   LYS  38           HA       LYS  38   0.774  14.692  -0.821
  270   1HB   LYS  38          2HB       LYS  38   0.086  14.217  -3.354
  271   2HB   LYS  38          3HB       LYS  38  -1.545  14.464  -2.730
  272   1HG   LYS  38          2HG       LYS  38  -0.827  16.654  -1.769
  273   2HG   LYS  38          3HG       LYS  38   0.818  16.360  -2.384
  274   1HD   LYS  38          2HD       LYS  38  -0.072  16.327  -4.724
  275   2HD   LYS  38          3HD       LYS  38  -1.702  16.582  -4.098
  276   1HE   LYS  38          2HE       LYS  38  -0.819  18.700  -4.914
  277   2HE   LYS  38          3HE       LYS  38  -1.052  18.779  -3.162
  278   1HZ   LYS  38          1HZ       LYS  38   1.527  18.313  -4.524
  279   2HZ   LYS  38          2HZ       LYS  38   1.040  19.732  -3.851
  280   3HZ   LYS  38          3HZ       LYS  38   1.310  18.426  -2.895
  281    H    MET  39           H        MET  39  -1.719  12.244  -0.745
  282    HA   MET  39           HA       MET  39  -3.989  13.218   0.100
  283   1HB   MET  39          2HB       MET  39  -2.457  10.823   0.871
  284   2HB   MET  39          3HB       MET  39  -3.673  11.259   2.041
  285   1HG   MET  39          2HG       MET  39  -4.263  10.809  -0.897
  286   2HG   MET  39          3HG       MET  39  -4.491   9.667   0.436
  287   1HE   MET  39          1HE       MET  39  -6.844   9.085   0.766
  288   2HE   MET  39          2HE       MET  39  -8.176  10.123   0.213
  289   3HE   MET  39          3HE       MET  39  -6.917   9.598  -0.933
  290    H    SER  40           H        SER  40  -1.697  12.465   2.659
  291    HA   SER  40           HA       SER  40  -1.009  14.347   4.194
  292   1HB   SER  40          2HB       SER  40  -4.027  14.293   4.683
  293   2HB   SER  40          3HB       SER  40  -2.852  14.889   5.864
  294    HG   SER  40           HG       SER  40  -3.249  15.882   3.259
  295    H    ALA  41           H        ALA  41  -0.318  13.531   6.146
  296    HA   ALA  41           HA       ALA  41  -0.067  10.874   6.702
  297   1HB   ALA  41          1HB       ALA  41  -0.347  13.198   8.662
  298   2HB   ALA  41          2HB       ALA  41   0.274  11.596   9.084
  299   3HB   ALA  41          3HB       ALA  41   1.154  12.603   7.913
  300    H    ASN  42           H        ASN  42  -2.751  12.966   7.668
  301    HA   ASN  42           HA       ASN  42  -4.062  11.210   9.471
  302   1HB   ASN  42          2HB       ASN  42  -5.267  13.348   7.652
  303   2HB   ASN  42          3HB       ASN  42  -6.094  12.566   9.007
  304   1HD2  ASN  42          1HD2      ASN  42  -6.106  15.215   9.188
  305   2HD2  ASN  42          2HD2      ASN  42  -4.892  15.784  10.320
  306    H    GLN  43           H        GLN  43  -4.719  11.802   5.997
  307    HA   GLN  43           HA       GLN  43  -6.764   9.791   5.810
  308   1HB   GLN  43          2HB       GLN  43  -5.447  11.740   4.019
  309   2HB   GLN  43          3HB       GLN  43  -5.714  10.196   3.218
  310   1HG   GLN  43          2HG       GLN  43  -7.869  11.709   4.749
  311   2HG   GLN  43          3HG       GLN  43  -7.625  11.824   3.001
  312   1HE2  GLN  43          1HE2      GLN  43 -10.073  10.868   4.301
  313   2HE2  GLN  43          2HE2      GLN  43 -10.241   9.186   3.833
  314    H    VAL  44           H        VAL  44  -3.297   9.858   4.726
  315    HA   VAL  44           HA       VAL  44  -3.146   7.229   3.820
  316    HB   VAL  44           HB       VAL  44  -1.175   9.061   5.279
  317   1HG1  VAL  44          1HG1      VAL  44  -0.266   6.860   5.503
  318   2HG1  VAL  44          2HG1      VAL  44  -0.578   6.494   3.775
  319   3HG1  VAL  44          3HG1      VAL  44   0.631   7.717   4.241
  320   1HG2  VAL  44          1HG2      VAL  44  -1.497   8.391   2.319
  321   2HG2  VAL  44          2HG2      VAL  44  -2.058   9.885   3.083
  322   3HG2  VAL  44          3HG2      VAL  44  -0.333   9.532   3.034
  323    H    LYS  45           H        LYS  45  -2.775   8.386   7.226
  324    HA   LYS  45           HA       LYS  45  -2.245   5.805   8.308
  325   1HB   LYS  45          2HB       LYS  45  -1.688   7.864   9.398
  326   2HB   LYS  45          3HB       LYS  45  -3.378   8.334   9.566
  327   1HG   LYS  45          2HG       LYS  45  -2.423   5.699  10.739
  328   2HG   LYS  45          3HG       LYS  45  -1.937   7.230  11.474
  329   1HD   LYS  45          2HD       LYS  45  -4.545   7.797  11.355
  330   2HD   LYS  45          3HD       LYS  45  -4.722   6.050  11.285
  331   1HE   LYS  45          2HE       LYS  45  -3.376   7.761  13.439
  332   2HE   LYS  45          3HE       LYS  45  -4.873   6.838  13.606
  333   1HZ   LYS  45          1HZ       LYS  45  -3.020   5.723  14.629
  334   2HZ   LYS  45          2HZ       LYS  45  -3.546   4.819  13.356
  335   3HZ   LYS  45          3HZ       LYS  45  -2.170   5.709  13.228
  336    H    ASP  46           H        ASP  46  -5.359   7.610   7.899
  337    HA   ASP  46           HA       ASP  46  -7.023   5.654   9.109
  338   1HB   ASP  46          2HB       ASP  46  -7.862   7.873   8.530
  339   2HB   ASP  46          3HB       ASP  46  -7.640   7.543   6.800
  340    H    VAL  47           H        VAL  47  -6.103   6.019   5.623
  341    HA   VAL  47           HA       VAL  47  -7.413   3.655   4.839
  342    HB   VAL  47           HB       VAL  47  -6.329   3.654   2.816
  343   1HG1  VAL  47          1HG1      VAL  47  -6.806   5.750   1.945
  344   2HG1  VAL  47          2HG1      VAL  47  -7.779   5.701   3.431
  345   3HG1  VAL  47          3HG1      VAL  47  -6.258   6.602   3.385
  346   1HG2  VAL  47          1HG2      VAL  47  -4.131   5.406   3.717
  347   2HG2  VAL  47          2HG2      VAL  47  -3.981   3.667   3.403
  348   3HG2  VAL  47          3HG2      VAL  47  -4.395   4.786   2.093
  349    H    PHE  48           H        PHE  48  -4.045   4.038   6.162
  350    HA   PHE  48           HA       PHE  48  -3.493   1.255   5.881
  351   1HB   PHE  48          2HB       PHE  48  -2.390   3.276   7.844
  352   2HB   PHE  48          3HB       PHE  48  -1.822   1.611   7.725
  353    HD1  PHE  48           1HD      PHE  48  -1.562   0.950   4.938
  354    HD2  PHE  48           2HD      PHE  48  -0.574   4.601   7.023
  355    HE1  PHE  48           1HE      PHE  48   0.034   1.549   3.156
  356    HE2  PHE  48           2HE      PHE  48   1.126   5.091   5.286
  357    HZ   PHE  48           HZ       PHE  48   1.373   3.596   3.333
  358    H    ARG  49           H        ARG  49  -5.240   2.969   8.511
  359    HA   ARG  49           HA       ARG  49  -5.483   0.597  10.138
  360   1HB   ARG  49          2HB       ARG  49  -7.495   2.874   9.870
  361   2HB   ARG  49          3HB       ARG  49  -7.509   1.570  11.055
  362   1HG   ARG  49          2HG       ARG  49  -5.052   2.427  11.624
  363   2HG   ARG  49          3HG       ARG  49  -5.625   3.897  10.817
  364   1HD   ARG  49          2HD       ARG  49  -6.134   4.206  13.130
  365   2HD   ARG  49          3HD       ARG  49  -7.674   3.803  12.340
  366    HE   ARG  49           HE       ARG  49  -6.468   1.387  13.248
  367   1HH1  ARG  49          2HH2      ARG  49  -8.028   4.259  14.545
  368   2HH1  ARG  49          1HH2      ARG  49  -8.391   3.568  16.097
  369   1HH2  ARG  49          2HH1      ARG  49  -7.407   0.356  15.172
  370   2HH2  ARG  49          1HH1      ARG  49  -7.703   1.345  16.549
  371    H    PHE  50           H        PHE  50  -7.438   1.825   7.352
  372    HA   PHE  50           HA       PHE  50  -9.370  -0.254   7.513
  373   1HB   PHE  50          2HB       PHE  50  -9.487   1.865   6.128
  374   2HB   PHE  50          3HB       PHE  50  -8.427   1.088   4.959
  375    HD1  PHE  50           1HD      PHE  50  -9.449  -0.144   3.187
  376    HD2  PHE  50           2HD      PHE  50 -11.645   0.497   6.841
  377    HE1  PHE  50           1HE      PHE  50 -11.473  -1.136   2.147
  378    HE2  PHE  50           2HE      PHE  50 -13.638  -0.574   5.823
  379    HZ   PHE  50           HZ       PHE  50 -13.564  -1.354   3.460
  380    H    ILE  51           H        ILE  51  -6.214  -0.127   5.789
  381    HA   ILE  51           HA       ILE  51  -6.363  -2.773   4.707
  382    HB   ILE  51           HB       ILE  51  -4.036  -0.953   5.336
  383   1HG1  ILE  51          2HG1      ILE  51  -3.698  -1.557   2.773
  384   2HG1  ILE  51          3HG1      ILE  51  -5.386  -2.045   2.817
  385   1HG2  ILE  51          1HG2      ILE  51  -3.213  -3.245   5.800
  386   2HG2  ILE  51          2HG2      ILE  51  -3.808  -3.763   4.207
  387   3HG2  ILE  51          3HG2      ILE  51  -2.534  -2.526   4.354
  388   1HD1  ILE  51          1HD1      ILE  51  -6.030   0.228   3.378
  389   2HD1  ILE  51          2HD1      ILE  51  -4.321   0.695   3.641
  390   3HD1  ILE  51          3HD1      ILE  51  -4.874   0.263   2.025
  391    H    ASP  52           H        ASP  52  -5.031  -1.688   7.885
  392    HA   ASP  52           HA       ASP  52  -4.124  -4.319   8.608
  393   1HB   ASP  52          2HB       ASP  52  -3.229  -2.116   9.488
  394   2HB   ASP  52          3HB       ASP  52  -4.682  -1.982  10.480
  395    H    ASN  53           H        ASN  53  -6.148  -5.303   7.929
  396    HA   ASN  53           HA       ASN  53  -8.685  -4.845   8.903
  397   1HB   ASN  53          2HB       ASN  53  -8.090  -6.069   6.879
  398   2HB   ASN  53          3HB       ASN  53  -7.427  -7.407   7.830
  399   1HD2  ASN  53          1HD2      ASN  53  -8.845  -9.058   8.468
  400   2HD2  ASN  53          2HD2      ASN  53 -10.572  -8.980   8.173
  401    H    ASP  54           H        ASP  54  -6.208  -7.017  10.217
  402    HA   ASP  54           HA       ASP  54  -7.818  -8.240  12.309
  403   1HB   ASP  54          2HB       ASP  54  -5.551  -8.964  13.064
  404   2HB   ASP  54          3HB       ASP  54  -5.804  -9.316  11.343
  405    H    GLN  55           H        GLN  55  -6.061  -5.235  11.813
  406    HA   GLN  55           HA       GLN  55  -5.581  -3.484  13.033
  407   1HB   GLN  55          2HB       GLN  55  -8.145  -4.452  14.200
  408   2HB   GLN  55          3HB       GLN  55  -7.252  -3.357  15.245
  409   1HG   GLN  55          2HG       GLN  55  -7.007  -1.776  13.301
  410   2HG   GLN  55          3HG       GLN  55  -8.122  -2.806  12.386
  411   1HE2  GLN  55          1HE2      GLN  55 -10.236  -3.336  13.714
  412   2HE2  GLN  55          2HE2      GLN  55 -10.932  -1.981  14.584
  413    H    SER  56           H        SER  56  -3.921  -5.817  13.523
  414    HA   SER  56           HA       SER  56  -3.074  -5.854  16.209
  415   1HB   SER  56          2HB       SER  56  -0.854  -6.434  15.248
  416   2HB   SER  56          3HB       SER  56  -2.176  -7.358  14.530
  417    HG   SER  56           HG       SER  56  -0.725  -5.168  13.451
  418    H    GLY  57           H        GLY  57  -2.642  -3.312  13.727
  419   1HA   GLY  57          1HA       GLY  57  -1.860  -1.137  14.058
  420   2HA   GLY  57          2HA       GLY  57  -1.124  -1.577  15.611
  421    H    TYR  58           H        TYR  58  -1.053  -3.223  12.449
  422    HA   TYR  58           HA       TYR  58   1.637  -2.648  11.711
  423   1HB   TYR  58          2HB       TYR  58   1.246  -5.206  13.325
  424   2HB   TYR  58          3HB       TYR  58   2.347  -5.175  11.971
  425    HD1  TYR  58           HD1      TYR  58   2.069  -4.451  15.473
  426    HD2  TYR  58           HD2      TYR  58   4.236  -3.529  11.874
  427    HE1  TYR  58           HE1      TYR  58   3.973  -3.638  16.828
  428    HE2  TYR  58           HE2      TYR  58   6.122  -2.640  13.227
  429    HH   TYR  58           HH       TYR  58   6.065  -2.669  16.803
  430    H    LEU  59           H        LEU  59   1.932  -3.035   9.715
  431    HA   LEU  59           HA       LEU  59  -0.004  -4.689   8.222
  432   1HB   LEU  59          2HB       LEU  59   1.720  -2.353   7.634
  433   2HB   LEU  59          3HB       LEU  59   1.965  -3.642   6.463
  434    HG   LEU  59           HG       LEU  59   0.228  -2.170   5.752
  435   1HD1  LEU  59          1HD1      LEU  59  -0.987  -3.928   4.850
  436   2HD1  LEU  59          2HD1      LEU  59   0.190  -4.910   5.685
  437   3HD1  LEU  59          3HD1      LEU  59  -1.381  -4.615   6.435
  438   1HD2  LEU  59          1HD2      LEU  59  -1.849  -1.793   6.896
  439   2HD2  LEU  59          2HD2      LEU  59  -1.419  -2.932   8.185
  440   3HD2  LEU  59          3HD2      LEU  59  -0.521  -1.416   7.995
  441    H    ASP  60           H        ASP  60   0.626  -6.473   9.436
  442    HA   ASP  60           HA       ASP  60   3.230  -7.623   9.177
  443   1HB   ASP  60          2HB       ASP  60   0.723  -9.237   9.663
  444   2HB   ASP  60          3HB       ASP  60   2.377  -9.478  10.270
  445    H    GLU  61           H        GLU  61   3.763  -9.599   7.987
  446    HA   GLU  61           HA       GLU  61   3.749  -9.115   5.301
  447   1HB   GLU  61          2HB       GLU  61   4.167 -11.773   6.737
  448   2HB   GLU  61          3HB       GLU  61   4.634 -11.450   5.062
  449   1HG   GLU  61          2HG       GLU  61   6.205  -9.742   5.734
  450   2HG   GLU  61          3HG       GLU  61   5.696  -9.824   7.424
  451    H    GLU  62           H        GLU  62   1.696 -11.583   6.900
  452    HA   GLU  62           HA       GLU  62   0.659 -12.637   4.494
  453   1HB   GLU  62          2HB       GLU  62   0.615 -13.486   7.005
  454   2HB   GLU  62          3HB       GLU  62  -0.954 -12.681   7.080
  455   1HG   GLU  62          2HG       GLU  62  -0.166 -14.793   5.006
  456   2HG   GLU  62          3HG       GLU  62  -0.912 -15.172   6.561
  457    H    GLU  63           H        GLU  63  -0.685 -10.127   6.665
  458    HA   GLU  63           HA       GLU  63  -3.074  -9.568   5.275
  459   1HB   GLU  63          2HB       GLU  63  -1.178  -7.710   6.739
  460   2HB   GLU  63          3HB       GLU  63  -2.866  -7.337   6.387
  461   1HG   GLU  63          2HG       GLU  63  -3.697  -8.871   7.942
  462   2HG   GLU  63          3HG       GLU  63  -2.252  -9.887   7.951
  463    H    LEU  64           H        LEU  64   0.275  -8.465   4.730
  464    HA   LEU  64           HA       LEU  64  -0.280  -6.491   2.840
  465   1HB   LEU  64          2HB       LEU  64   1.968  -7.341   4.025
  466   2HB   LEU  64          3HB       LEU  64   2.159  -8.215   2.502
  467    HG   LEU  64           HG       LEU  64   2.025  -6.025   1.283
  468   1HD1  LEU  64          1HD1      LEU  64   2.031  -4.856   4.116
  469   2HD1  LEU  64          2HD1      LEU  64   2.370  -3.932   2.642
  470   3HD1  LEU  64          3HD1      LEU  64   0.765  -4.609   2.894
  471   1HD2  LEU  64          1HD2      LEU  64   4.190  -7.050   2.049
  472   2HD2  LEU  64          2HD2      LEU  64   4.256  -5.278   1.965
  473   3HD2  LEU  64          3HD2      LEU  64   4.089  -6.092   3.536
  474    H    LYS  65           H        LYS  65  -0.235 -10.006   2.497
  475    HA   LYS  65           HA       LYS  65  -0.335 -10.216  -0.357
  476   1HB   LYS  65          2HB       LYS  65   0.101 -12.001   1.484
  477   2HB   LYS  65          3HB       LYS  65  -1.679 -11.995   1.632
  478   1HG   LYS  65          2HG       LYS  65  -1.943 -12.824  -0.627
  479   2HG   LYS  65          3HG       LYS  65  -0.201 -12.708  -0.915
  480   1HD   LYS  65          2HD       LYS  65  -0.995 -15.031  -0.366
  481   2HD   LYS  65          3HD       LYS  65   0.258 -14.426   0.737
  482   1HE   LYS  65          2HE       LYS  65  -1.411 -13.904   2.461
  483   2HE   LYS  65          3HE       LYS  65  -2.744 -14.315   1.369
  484   1HZ   LYS  65          1HZ       LYS  65  -0.707 -16.158   2.436
  485   2HZ   LYS  65          2HZ       LYS  65  -2.201 -15.896   3.036
  486   3HZ   LYS  65          3HZ       LYS  65  -2.040 -16.597   1.540
  487    H    PHE  66           H        PHE  66  -2.630  -8.927   1.864
  488    HA   PHE  66           HA       PHE  66  -4.808  -9.042  -0.169
  489   1HB   PHE  66          2HB       PHE  66  -4.775  -9.738   2.741
  490   2HB   PHE  66          3HB       PHE  66  -6.065  -8.663   2.282
  491    HD1  PHE  66           1HD      PHE  66  -4.522 -11.931   1.307
  492    HD2  PHE  66           2HD      PHE  66  -8.053  -9.455   1.242
  493    HE1  PHE  66           1HE      PHE  66  -5.849 -13.817   0.384
  494    HE2  PHE  66           2HE      PHE  66  -9.368 -11.350   0.376
  495    HZ   PHE  66           HZ       PHE  66  -8.273 -13.527  -0.074
  496    H    PHE  67           H        PHE  67  -2.492  -7.089   0.586
  497    HA   PHE  67           HA       PHE  67  -3.342  -4.896   2.002
  498   1HB   PHE  67          2HB       PHE  67  -1.075  -5.181   1.262
  499   2HB   PHE  67          3HB       PHE  67  -1.513  -5.120  -0.426
  500    HD1  PHE  67           1HD      PHE  67  -1.136  -3.148   2.696
  501    HD2  PHE  67           2HD      PHE  67  -1.579  -2.997  -1.581
  502    HE1  PHE  67           1HE      PHE  67  -0.643  -0.722   2.733
  503    HE2  PHE  67           2HE      PHE  67  -1.127  -0.581  -1.548
  504    HZ   PHE  67           HZ       PHE  67  -0.657   0.582   0.612
  505    H    LEU  68           H        LEU  68  -3.339  -4.863  -1.591
  506    HA   LEU  68           HA       LEU  68  -5.040  -2.544  -1.680
  507   1HB   LEU  68          2HB       LEU  68  -3.116  -3.601  -3.271
  508   2HB   LEU  68          3HB       LEU  68  -4.515  -4.357  -3.989
  509    HG   LEU  68           HG       LEU  68  -3.826  -2.421  -5.238
  510   1HD1  LEU  68          1HD1      LEU  68  -6.286  -2.829  -5.029
  511   2HD1  LEU  68          2HD1      LEU  68  -6.310  -1.616  -3.736
  512   3HD1  LEU  68          3HD1      LEU  68  -5.863  -1.141  -5.384
  513   1HD2  LEU  68          1HD2      LEU  68  -4.179  -0.743  -2.716
  514   2HD2  LEU  68          2HD2      LEU  68  -2.637  -1.206  -3.468
  515   3HD2  LEU  68          3HD2      LEU  68  -3.767  -0.153  -4.334
  516    H    GLN  69           H        GLN  69  -5.525  -5.948  -1.560
  517    HA   GLN  69           HA       GLN  69  -8.098  -6.138  -2.676
  518   1HB   GLN  69          2HB       GLN  69  -6.145  -7.937  -1.840
  519   2HB   GLN  69          3HB       GLN  69  -7.395  -8.189  -0.640
  520   1HG   GLN  69          2HG       GLN  69  -8.988  -8.779  -2.333
  521   2HG   GLN  69          3HG       GLN  69  -7.972  -8.111  -3.622
  522   1HE2  GLN  69          1HE2      GLN  69  -6.226  -9.306  -4.517
  523   2HE2  GLN  69          2HE2      GLN  69  -6.074 -11.007  -4.172
  524    H    LYS  70           H        LYS  70  -7.318  -4.463   0.103
  525    HA   LYS  70           HA       LYS  70  -9.951  -4.865   1.385
  526   1HB   LYS  70          2HB       LYS  70  -7.523  -3.247   1.916
  527   2HB   LYS  70          3HB       LYS  70  -9.007  -2.311   2.043
  528   1HG   LYS  70          2HG       LYS  70  -8.546  -3.203   4.185
  529   2HG   LYS  70          3HG       LYS  70  -9.994  -3.968   3.568
  530   1HD   LYS  70          2HD       LYS  70  -7.687  -5.554   2.754
  531   2HD   LYS  70          3HD       LYS  70  -7.510  -5.160   4.469
  532   1HE   LYS  70          2HE       LYS  70  -9.795  -6.035   4.927
  533   2HE   LYS  70          3HE       LYS  70 -10.013  -6.406   3.208
  534   1HZ   LYS  70          1HZ       LYS  70  -7.955  -7.613   4.929
  535   2HZ   LYS  70          2HZ       LYS  70  -9.369  -8.328   4.475
  536   3HZ   LYS  70          3HZ       LYS  70  -8.229  -7.962   3.344
  537    H    PHE  71           H        PHE  71  -8.520  -3.013  -1.238
  538    HA   PHE  71           HA       PHE  71 -10.827  -1.163  -1.411
  539   1HB   PHE  71          2HB       PHE  71  -8.357  -1.315  -3.145
  540   2HB   PHE  71          3HB       PHE  71  -9.498  -0.016  -3.020
  541    HD1  PHE  71           1HD      PHE  71  -6.665   0.495  -2.967
  542    HD2  PHE  71           2HD      PHE  71  -9.235  -0.518   0.341
  543    HE1  PHE  71           1HE      PHE  71  -5.280   1.884  -1.462
  544    HE2  PHE  71           2HE      PHE  71  -7.749   0.735   1.860
  545    HZ   PHE  71           HZ       PHE  71  -5.868   2.065   0.942
  546    H    GLU  72           H        GLU  72  -8.912  -3.371  -3.463
  547    HA   GLU  72           HA       GLU  72 -11.147  -3.624  -5.420
  548   1HB   GLU  72          2HB       GLU  72  -8.511  -3.059  -5.857
  549   2HB   GLU  72          3HB       GLU  72  -8.422  -4.821  -5.866
  550   1HG   GLU  72          2HG       GLU  72  -8.718  -4.102  -8.125
  551   2HG   GLU  72          3HG       GLU  72 -10.321  -4.688  -7.676
  552    H    SER  73           H        SER  73 -10.687  -6.085  -6.416
  553    HA   SER  73           HA       SER  73 -10.461  -8.027  -4.179
  554   1HB   SER  73          2HB       SER  73 -12.688  -8.044  -6.268
  555   2HB   SER  73          3HB       SER  73 -12.456  -9.222  -4.962
  556    HG   SER  73           HG       SER  73 -14.023  -7.546  -4.488
  557    H    GLY  74           H        GLY  74  -8.388  -7.481  -5.813
  558   1HA   GLY  74          1HA       GLY  74  -7.221  -9.669  -6.696
  559   2HA   GLY  74          2HA       GLY  74  -8.389  -9.485  -8.016
  560    H    ALA  75           H        ALA  75  -6.114  -7.383  -6.131
  561    HA   ALA  75           HA       ALA  75  -5.616  -5.771  -8.569
  562   1HB   ALA  75          1HB       ALA  75  -6.139  -4.665  -6.453
  563   2HB   ALA  75          2HB       ALA  75  -4.769  -5.446  -5.680
  564   3HB   ALA  75          3HB       ALA  75  -4.482  -4.270  -6.981
  565    H    ARG  76           H        ARG  76  -3.074  -6.263  -6.189
  566    HA   ARG  76           HA       ARG  76  -1.617  -8.128  -7.939
  567   1HB   ARG  76          2HB       ARG  76  -1.209  -5.454  -8.423
  568   2HB   ARG  76          3HB       ARG  76  -0.144  -5.650  -7.034
  569   1HG   ARG  76          2HG       ARG  76   1.260  -6.201  -8.720
  570   2HG   ARG  76          3HG       ARG  76   0.722  -7.800  -8.284
  571   1HD   ARG  76          2HD       ARG  76  -0.148  -8.121 -10.428
  572   2HD   ARG  76          3HD       ARG  76  -1.225  -6.770 -10.203
  573    HE   ARG  76           HE       ARG  76   0.134  -5.433 -11.524
  574   1HH1  ARG  76          2HH2      ARG  76   1.857  -8.270 -10.505
  575   2HH1  ARG  76          1HH2      ARG  76   3.446  -7.595 -10.617
  576   1HH2  ARG  76          2HH1      ARG  76   2.239  -4.509 -12.014
  577   2HH2  ARG  76          1HH1      ARG  76   3.644  -5.311 -11.322
  578    H    GLU  77           H        GLU  77  -2.821  -8.196  -5.292
  579    HA   GLU  77           HA       GLU  77  -0.856  -7.744  -3.247
  580   1HB   GLU  77          2HB       GLU  77  -3.366  -9.376  -2.930
  581   2HB   GLU  77          3HB       GLU  77  -2.525  -8.287  -1.808
  582   1HG   GLU  77          2HG       GLU  77  -4.267  -6.993  -2.357
  583   2HG   GLU  77          3HG       GLU  77  -3.170  -6.418  -3.596
  584    H    LEU  78           H        LEU  78  -2.175 -10.391  -5.059
  585    HA   LEU  78           HA       LEU  78  -1.174 -12.668  -3.920
  586   1HB   LEU  78          2HB       LEU  78  -1.144 -12.374  -6.942
  587   2HB   LEU  78          3HB       LEU  78  -1.473 -13.779  -5.949
  588    HG   LEU  78           HG       LEU  78  -3.511 -13.326  -6.765
  589   1HD1  LEU  78          1HD1      LEU  78  -3.600 -13.299  -4.245
  590   2HD1  LEU  78          2HD1      LEU  78  -3.778 -11.532  -4.328
  591   3HD1  LEU  78          3HD1      LEU  78  -4.987 -12.578  -5.081
  592   1HD2  LEU  78          1HD2      LEU  78  -4.521 -11.255  -7.328
  593   2HD2  LEU  78          2HD2      LEU  78  -3.286 -10.305  -6.514
  594   3HD2  LEU  78          3HD2      LEU  78  -2.858 -11.223  -7.952
  595    H    THR  79           H        THR  79   0.528 -10.772  -6.517
  596    HA   THR  79           HA       THR  79   2.730 -12.494  -6.698
  597    HB   THR  79           HB       THR  79   2.683  -9.496  -7.177
  598    HG1  THR  79           1HG      THR  79   2.626 -10.670  -9.391
  599   1HG2  THR  79          1HG2      THR  79   4.408 -11.718  -8.423
  600   2HG2  THR  79          2HG2      THR  79   4.557  -9.977  -8.749
  601   3HG2  THR  79          3HG2      THR  79   5.000 -10.636  -7.171
  602    H    GLU  80           H        GLU  80   4.134 -13.008  -5.157
  603    HA   GLU  80           HA       GLU  80   4.344 -11.547  -2.729
  604   1HB   GLU  80          2HB       GLU  80   6.481 -13.491  -3.633
  605   2HB   GLU  80          3HB       GLU  80   5.899 -13.073  -2.006
  606   1HG   GLU  80          2HG       GLU  80   4.854 -15.095  -2.251
  607   2HG   GLU  80          3HG       GLU  80   3.593 -14.083  -2.960
  608    H    SER  81           H        SER  81   6.568 -11.724  -5.594
  609    HA   SER  81           HA       SER  81   8.612 -10.108  -4.718
  610   1HB   SER  81          2HB       SER  81   7.478  -9.915  -7.541
  611   2HB   SER  81          3HB       SER  81   9.158  -9.865  -7.014
  612    HG   SER  81           HG       SER  81   8.515 -11.931  -7.852
  613    H    GLU  82           H        GLU  82   5.750  -8.982  -6.567
  614    HA   GLU  82           HA       GLU  82   6.191  -6.266  -6.330
  615   1HB   GLU  82          2HB       GLU  82   4.163  -7.979  -7.361
  616   2HB   GLU  82          3HB       GLU  82   3.324  -6.952  -6.214
  617   1HG   GLU  82          2HG       GLU  82   3.170  -5.555  -7.940
  618   2HG   GLU  82          3HG       GLU  82   4.814  -5.089  -7.489
  619    H    THR  83           H        THR  83   4.205  -8.381  -4.160
  620    HA   THR  83           HA       THR  83   3.449  -6.286  -2.508
  621    HB   THR  83           HB       THR  83   2.958  -8.993  -2.522
  622    HG1  THR  83           1HG      THR  83   1.747  -8.293  -0.524
  623   1HG2  THR  83          1HG2      THR  83   4.126  -8.406   0.228
  624   2HG2  THR  83          2HG2      THR  83   3.230  -9.849  -0.261
  625   3HG2  THR  83          3HG2      THR  83   4.825  -9.543  -0.945
  626    H    LYS  84           H        LYS  84   6.402  -8.264  -2.540
  627    HA   LYS  84           HA       LYS  84   7.546  -7.217  -0.127
  628   1HB   LYS  84          2HB       LYS  84   8.688  -8.818  -2.418
  629   2HB   LYS  84          3HB       LYS  84   9.673  -8.244  -1.068
  630   1HG   LYS  84          2HG       LYS  84   8.420  -9.463   0.551
  631   2HG   LYS  84          3HG       LYS  84   7.121  -9.816  -0.594
  632   1HD   LYS  84          2HD       LYS  84   8.637 -11.187  -1.961
  633   2HD   LYS  84          3HD       LYS  84   9.974 -10.856  -0.835
  634   1HE   LYS  84          2HE       LYS  84   8.740 -11.963   1.002
  635   2HE   LYS  84          3HE       LYS  84   7.332 -12.198  -0.044
  636   1HZ   LYS  84          1HZ       LYS  84   9.971 -13.433  -0.464
  637   2HZ   LYS  84          2HZ       LYS  84   8.638 -14.181   0.144
  638   3HZ   LYS  84          3HZ       LYS  84   8.641 -13.656  -1.413
  639    H    SER  85           H        SER  85   7.593  -6.125  -3.528
  640    HA   SER  85           HA       SER  85   9.571  -4.133  -3.247
  641   1HB   SER  85          2HB       SER  85   6.996  -3.823  -4.846
  642   2HB   SER  85          3HB       SER  85   8.535  -3.000  -5.095
  643    HG   SER  85           HG       SER  85   8.280  -4.820  -6.486
  644    H    LEU  86           H        LEU  86   6.061  -4.039  -2.420
  645    HA   LEU  86           HA       LEU  86   6.194  -1.401  -1.201
  646   1HB   LEU  86          2HB       LEU  86   4.225  -3.702  -0.876
  647   2HB   LEU  86          3HB       LEU  86   4.221  -2.289   0.162
  648    HG   LEU  86           HG       LEU  86   4.271  -1.050  -2.293
  649   1HD1  LEU  86          1HD1      LEU  86   4.009  -3.213  -3.504
  650   2HD1  LEU  86          2HD1      LEU  86   2.511  -3.526  -2.595
  651   3HD1  LEU  86          3HD1      LEU  86   2.605  -2.151  -3.714
  652   1HD2  LEU  86          1HD2      LEU  86   1.883  -1.960  -0.634
  653   2HD2  LEU  86          2HD2      LEU  86   2.821  -0.461  -0.443
  654   3HD2  LEU  86          3HD2      LEU  86   1.834  -0.711  -1.891
  655    H    MET  87           H        MET  87   6.152  -4.685   0.301
  656    HA   MET  87           HA       MET  87   6.536  -3.986   2.864
  657   1HB   MET  87          2HB       MET  87   6.426  -6.375   1.851
  658   2HB   MET  87          3HB       MET  87   8.180  -6.251   1.704
  659   1HG   MET  87          2HG       MET  87   8.191  -5.678   4.233
  660   2HG   MET  87          3HG       MET  87   6.510  -6.204   4.224
  661   1HE   MET  87          1HE       MET  87  10.206  -8.901   3.618
  662   2HE   MET  87          2HE       MET  87   9.776  -7.697   2.386
  663   3HE   MET  87          3HE       MET  87  10.256  -7.170   4.018
  664    H    ALA  88           H        ALA  88   9.183  -4.525   0.594
  665    HA   ALA  88           HA       ALA  88  11.445  -4.300   2.120
  666   1HB   ALA  88          1HB       ALA  88  12.509  -3.576  -0.080
  667   2HB   ALA  88          2HB       ALA  88  11.478  -5.017  -0.199
  668   3HB   ALA  88          3HB       ALA  88  10.868  -3.471  -0.773
  669    H    ALA  89           H        ALA  89  10.062  -1.585   0.195
  670    HA   ALA  89           HA       ALA  89  11.766   0.369   1.466
  671   1HB   ALA  89          1HB       ALA  89   9.203   0.682  -0.133
  672   2HB   ALA  89          2HB       ALA  89  10.258   2.023   0.382
  673   3HB   ALA  89          3HB       ALA  89  10.891   0.796  -0.724
  674    H    ALA  90           H        ALA  90   8.267  -0.488   1.887
  675    HA   ALA  90           HA       ALA  90   7.620   1.503   3.763
  676   1HB   ALA  90          1HB       ALA  90   5.997  -0.048   2.674
  677   2HB   ALA  90          2HB       ALA  90   6.638  -1.374   3.680
  678   3HB   ALA  90          3HB       ALA  90   5.821   0.007   4.442
  679    H    ASP  91           H        ASP  91   9.173  -1.647   4.289
  680    HA   ASP  91           HA       ASP  91   9.161  -1.485   7.147
  681   1HB   ASP  91          2HB       ASP  91   9.290  -3.642   5.994
  682   2HB   ASP  91          3HB       ASP  91  10.802  -3.176   5.194
  683    H    ASN  92           H        ASN  92  11.739  -1.163   4.675
  684    HA   ASN  92           HA       ASN  92  13.874  -0.490   4.796
  685   1HB   ASN  92          2HB       ASN  92  14.223   1.850   5.251
  686   2HB   ASN  92          3HB       ASN  92  12.717   1.611   4.392
  687   1HD2  ASN  92          1HD2      ASN  92  13.899   1.836   7.824
  688   2HD2  ASN  92          2HD2      ASN  92  12.547   2.823   8.359
  689    H    ASP  93           H        ASP  93  13.111  -2.125   7.217
  690    HA   ASP  93           HA       ASP  93  15.282  -1.177   9.083
  691   1HB   ASP  93          2HB       ASP  93  12.960  -3.101   9.535
  692   2HB   ASP  93          3HB       ASP  93  14.236  -2.732  10.691
  693    H    GLY  94           H        GLY  94  13.854  -3.935   7.395
  694   1HA   GLY  94          1HA       GLY  94  15.006  -5.851   6.537
  695   2HA   GLY  94          2HA       GLY  94  16.301  -5.611   7.723
  696    H    ASP  95           H        ASP  95  12.723  -5.340   8.231
  697    HA   ASP  95           HA       ASP  95  12.831  -7.886   9.782
  698   1HB   ASP  95          2HB       ASP  95  11.791  -7.151  11.650
  699   2HB   ASP  95          3HB       ASP  95  12.949  -5.857  11.334
  700    H    GLY  96           H        GLY  96  10.535  -5.502   8.332
  701   1HA   GLY  96          1HA       GLY  96   9.365  -6.256   6.351
  702   2HA   GLY  96          2HA       GLY  96   9.150  -7.856   7.063
  703    H    LYS  97           H        LYS  97   8.582  -6.427   9.784
  704    HA   LYS  97           HA       LYS  97   5.691  -6.098   9.375
  705   1HB   LYS  97          2HB       LYS  97   7.445  -6.033  11.853
  706   2HB   LYS  97          3HB       LYS  97   5.689  -5.901  11.855
  707   1HG   LYS  97          2HG       LYS  97   5.358  -8.123  11.500
  708   2HG   LYS  97          3HG       LYS  97   6.651  -8.243  10.304
  709   1HD   LYS  97          2HD       LYS  97   8.349  -8.144  12.135
  710   2HD   LYS  97          3HD       LYS  97   7.017  -8.221  13.319
  711   1HE   LYS  97          2HE       LYS  97   6.281 -10.397  12.330
  712   2HE   LYS  97          3HE       LYS  97   7.561 -10.289  11.109
  713   1HZ   LYS  97          1HZ       LYS  97   9.180 -10.399  12.861
  714   2HZ   LYS  97          2HZ       LYS  97   8.000 -10.526  14.007
  715   3HZ   LYS  97          3HZ       LYS  97   8.196 -11.717  12.885
  716    H    ILE  98           H        ILE  98   4.758  -4.201   9.258
  717    HA   ILE  98           HA       ILE  98   6.425  -1.719   9.258
  718    HB   ILE  98           HB       ILE  98   4.252  -2.820   7.462
  719   1HG1  ILE  98          2HG1      ILE  98   6.895  -1.810   6.478
  720   2HG1  ILE  98          3HG1      ILE  98   6.939  -3.336   7.347
  721   1HG2  ILE  98          1HG2      ILE  98   5.538  -0.055   7.410
  722   2HG2  ILE  98          2HG2      ILE  98   4.557  -0.766   6.113
  723   3HG2  ILE  98          3HG2      ILE  98   3.822  -0.443   7.682
  724   1HD1  ILE  98          1HD1      ILE  98   5.233  -4.295   5.855
  725   2HD1  ILE  98          2HD1      ILE  98   5.201  -2.782   4.919
  726   3HD1  ILE  98          3HD1      ILE  98   6.697  -3.752   5.015
  727    H    GLY  99           H        GLY  99   5.848  -0.664  11.155
  728   1HA   GLY  99          1HA       GLY  99   3.174  -0.479  12.185
  729   2HA   GLY  99          2HA       GLY  99   4.521   0.643  12.468
  730    H    ALA 100           H        ALA 100   1.852   1.531  12.091
  731    HA   ALA 100           HA       ALA 100   1.277   2.349   9.417
  732   1HB   ALA 100          1HB       ALA 100   0.548   3.685  12.057
  733   2HB   ALA 100          2HB       ALA 100  -0.183   4.015  10.469
  734   3HB   ALA 100          3HB       ALA 100  -0.392   2.419  11.222
  735    H    GLU 101           H        GLU 101   3.295   3.738  12.016
  736    HA   GLU 101           HA       GLU 101   3.774   6.201  10.725
  737   1HB   GLU 101          2HB       GLU 101   5.399   4.773  12.871
  738   2HB   GLU 101          3HB       GLU 101   5.589   6.461  12.370
  739   1HG   GLU 101          2HG       GLU 101   3.185   6.886  12.930
  740   2HG   GLU 101          3HG       GLU 101   3.051   5.236  13.568
  741    H    GLU 102           H        GLU 102   5.745   3.165  10.773
  742    HA   GLU 102           HA       GLU 102   7.840   3.889   9.036
  743   1HB   GLU 102          2HB       GLU 102   6.245   1.300   9.299
  744   2HB   GLU 102          3HB       GLU 102   7.671   1.466   8.287
  745   1HG   GLU 102          2HG       GLU 102   9.109   1.835  10.133
  746   2HG   GLU 102          3HG       GLU 102   7.758   2.019  11.266
  747    H    PHE 103           H        PHE 103   4.574   2.617   8.228
  748    HA   PHE 103           HA       PHE 103   5.090   2.731   5.447
  749   1HB   PHE 103          2HB       PHE 103   3.197   1.573   7.010
  750   2HB   PHE 103          3HB       PHE 103   2.234   2.845   6.336
  751    HD1  PHE 103           1HD      PHE 103   3.876   2.694   3.503
  752    HD2  PHE 103           2HD      PHE 103   1.848  -0.163   6.035
  753    HE1  PHE 103           1HE      PHE 103   3.589   1.185   1.588
  754    HE2  PHE 103           2HE      PHE 103   1.678  -1.718   4.102
  755    HZ   PHE 103           HZ       PHE 103   2.495  -1.033   1.879
  756    H    GLN 104           H        GLN 104   3.378   5.017   7.577
  757    HA   GLN 104           HA       GLN 104   2.556   7.063   5.742
  758   1HB   GLN 104          2HB       GLN 104   1.956   6.904   8.149
  759   2HB   GLN 104          3HB       GLN 104   3.624   7.331   8.576
  760   1HG   GLN 104          2HG       GLN 104   3.302   9.467   7.182
  761   2HG   GLN 104          3HG       GLN 104   1.588   9.040   7.098
  762   1HE2  GLN 104          1HE2      GLN 104   1.245   8.012   9.774
  763   2HE2  GLN 104          2HE2      GLN 104   1.503   9.352  10.882
  764    H    GLU 105           H        GLU 105   5.697   6.739   7.586
  765    HA   GLU 105           HA       GLU 105   7.003   8.932   6.457
  766   1HB   GLU 105          2HB       GLU 105   7.831   6.345   7.712
  767   2HB   GLU 105          3HB       GLU 105   9.032   7.035   6.631
  768   1HG   GLU 105          2HG       GLU 105   7.726   8.690   8.820
  769   2HG   GLU 105          3HG       GLU 105   9.211   7.748   9.049
  770    H    MET 106           H        MET 106   6.929   5.559   5.196
  771    HA   MET 106           HA       MET 106   8.504   6.247   2.954
  772   1HB   MET 106          2HB       MET 106   7.518   3.876   3.975
  773   2HB   MET 106          3HB       MET 106   6.581   4.029   2.484
  774   1HG   MET 106          2HG       MET 106   8.609   2.855   1.979
  775   2HG   MET 106          3HG       MET 106   8.807   4.462   1.282
  776   1HE   MET 106          1HE       MET 106  10.592   6.244   2.100
  777   2HE   MET 106          2HE       MET 106  12.130   5.499   2.582
  778   3HE   MET 106          3HE       MET 106  11.296   4.932   1.117
  779    H    VAL 107           H        VAL 107   4.955   6.119   3.287
  780    HA   VAL 107           HA       VAL 107   4.360   6.956   0.620
  781    HB   VAL 107           HB       VAL 107   2.834   7.124   3.235
  782   1HG1  VAL 107          1HG1      VAL 107   0.835   7.658   1.796
  783   2HG1  VAL 107          2HG1      VAL 107   1.984   8.990   1.941
  784   3HG1  VAL 107          3HG1      VAL 107   1.947   7.999   0.460
  785   1HG2  VAL 107          1HG2      VAL 107   3.133   4.871   2.175
  786   2HG2  VAL 107          2HG2      VAL 107   1.439   5.423   2.123
  787   3HG2  VAL 107          3HG2      VAL 107   2.436   5.514   0.674
  788    H    HIS 108           H        HIS 108   5.325   8.805   3.484
  789    HA   HIS 108           HA       HIS 108   4.239  11.277   2.711
  790   1HB   HIS 108          2HB       HIS 108   4.752  10.701   5.008
  791   2HB   HIS 108          3HB       HIS 108   6.472  10.536   4.636
  792    HD1  HIS 108           1HD      HIS 108   4.935  13.645   3.199
  793    HD2  HIS 108           2HD      HIS 108   6.892  12.297   6.667
  794    HE1  HIS 108           1HE      HIS 108   5.559  15.733   4.550
  795    H    SER 109           H        SER 109   7.020   9.496   1.735
  796    HA   SER 109           HA       SER 109   8.803  11.467   0.939
  797   1HB   SER 109          2HB       SER 109   9.324   9.030   1.046
  798   2HB   SER 109          3HB       SER 109   8.231   8.773  -0.338
  799    HG   SER 109           HG       SER 109   9.654  10.521  -1.312
  Start of MODEL    9
    1   1H    MET   1           H1       MET   1 -17.357   6.113   5.070
    2   2H    MET   1           H2       MET   1 -18.463   7.328   4.784
    3   3H    MET   1           H3       MET   1 -18.656   5.809   4.120
    4    HA   MET   1           HA       MET   1 -17.680   6.787   2.312
    5   1HB   MET   1          2HB       MET   1 -15.837   8.371   4.167
    6   2HB   MET   1          3HB       MET   1 -16.094   8.572   2.428
    7   1HG   MET   1          2HG       MET   1 -17.306  10.347   3.403
    8   2HG   MET   1          3HG       MET   1 -18.530   9.143   2.997
    9   1HE   MET   1          1HE       MET   1 -20.260  10.356   6.196
   10   2HE   MET   1          2HE       MET   1 -19.670  11.215   4.753
   11   3HE   MET   1          3HE       MET   1 -20.486   9.639   4.584
   12    H    SER   2           H        SER   2 -15.374   6.439   1.394
   13    HA   SER   2           HA       SER   2 -13.510   5.035   3.035
   14   1HB   SER   2          2HB       SER   2 -15.116   3.139   2.512
   15   2HB   SER   2          3HB       SER   2 -14.844   3.450   0.788
   16    HG   SER   2           HG       SER   2 -13.052   2.477   2.747
   17    H    ILE   3           H        ILE   3 -11.824   4.178   1.312
   18    HA   ILE   3           HA       ILE   3 -10.757   6.560   0.174
   19    HB   ILE   3           HB       ILE   3  -8.888   5.264  -0.403
   20   1HG1  ILE   3          2HG1      ILE   3  -9.296   2.596  -0.083
   21   2HG1  ILE   3          3HG1      ILE   3 -10.842   2.990  -0.771
   22   1HG2  ILE   3          1HG2      ILE   3  -9.594   5.403   2.046
   23   2HG2  ILE   3          2HG2      ILE   3 -10.014   3.683   1.931
   24   3HG2  ILE   3          3HG2      ILE   3  -8.357   4.204   1.615
   25   1HD1  ILE   3          1HD1      ILE   3  -9.146   2.335  -2.461
   26   2HD1  ILE   3          2HD1      ILE   3  -9.665   4.008  -2.752
   27   3HD1  ILE   3          3HD1      ILE   3  -8.107   3.681  -1.966
   28    H    THR   4           H        THR   4 -12.798   4.048  -1.084
   29    HA   THR   4           HA       THR   4 -12.427   4.440  -3.826
   30    HB   THR   4           HB       THR   4 -13.402   2.495  -2.308
   31    HG1  THR   4           1HG      THR   4 -12.958   2.631  -4.483
   32   1HG2  THR   4          1HG2      THR   4 -16.022   3.721  -3.234
   33   2HG2  THR   4          2HG2      THR   4 -15.761   2.251  -2.279
   34   3HG2  THR   4          3HG2      THR   4 -15.436   3.842  -1.559
   35    H    ASP   5           H        ASP   5 -13.875   6.459  -1.499
   36    HA   ASP   5           HA       ASP   5 -15.497   7.919  -3.514
   37   1HB   ASP   5          2HB       ASP   5 -16.800   6.328  -1.986
   38   2HB   ASP   5          3HB       ASP   5 -16.237   7.306  -0.618
   39    H    VAL   6           H        VAL   6 -12.733   8.354  -2.529
   40    HA   VAL   6           HA       VAL   6 -13.248  11.135  -1.501
   41    HB   VAL   6           HB       VAL   6 -11.365  11.242  -0.152
   42   1HG1  VAL   6          1HG1      VAL   6 -12.008   9.972   1.686
   43   2HG1  VAL   6          2HG1      VAL   6 -13.499  10.083   0.732
   44   3HG1  VAL   6          3HG1      VAL   6 -12.515   8.603   0.694
   45   1HG2  VAL   6          1HG2      VAL   6  -9.986   9.176   0.421
   46   2HG2  VAL   6          2HG2      VAL   6 -10.592   8.470  -1.086
   47   3HG2  VAL   6          3HG2      VAL   6  -9.628   9.963  -1.115
   48    H    LEU   7           H        LEU   7 -10.752   9.163  -3.108
   49    HA   LEU   7           HA       LEU   7 -10.341  10.984  -5.279
   50   1HB   LEU   7          2HB       LEU   7  -9.286  12.405  -3.508
   51   2HB   LEU   7          3HB       LEU   7  -8.310  11.034  -2.990
   52    HG   LEU   7           HG       LEU   7  -7.323  11.032  -5.386
   53   1HD1  LEU   7          1HD1      LEU   7  -9.020  12.482  -6.460
   54   2HD1  LEU   7          2HD1      LEU   7  -8.545  13.822  -5.393
   55   3HD1  LEU   7          3HD1      LEU   7  -7.395  13.168  -6.580
   56   1HD2  LEU   7          1HD2      LEU   7  -5.709  12.777  -4.825
   57   2HD2  LEU   7          2HD2      LEU   7  -6.786  13.385  -3.546
   58   3HD2  LEU   7          3HD2      LEU   7  -6.071  11.760  -3.425
   59    H    SER   8           H        SER   8  -8.459   8.909  -3.040
   60    HA   SER   8           HA       SER   8  -6.791   7.619  -4.596
   61   1HB   SER   8          2HB       SER   8  -8.414   6.307  -2.414
   62   2HB   SER   8          3HB       SER   8  -6.829   5.769  -3.020
   63    HG   SER   8           HG       SER   8  -5.977   7.781  -2.391
   64    H    ALA   9           H        ALA   9 -10.264   6.728  -4.520
   65    HA   ALA   9           HA       ALA   9 -10.321   4.399  -5.951
   66   1HB   ALA   9          1HB       ALA   9 -12.040   6.758  -6.842
   67   2HB   ALA   9          2HB       ALA   9 -12.518   5.061  -6.614
   68   3HB   ALA   9          3HB       ALA   9 -12.208   6.121  -5.216
   69    H    ASP  10           H        ASP  10  -9.671   7.628  -7.395
   70    HA   ASP  10           HA       ASP  10  -9.617   6.602 -10.122
   71   1HB   ASP  10          2HB       ASP  10 -10.171   8.970  -9.410
   72   2HB   ASP  10          3HB       ASP  10  -8.457   9.194  -9.017
   73    H    ASP  11           H        ASP  11  -7.274   7.373  -7.556
   74    HA   ASP  11           HA       ASP  11  -4.907   7.145  -9.101
   75   1HB   ASP  11          2HB       ASP  11  -5.279   6.740  -6.100
   76   2HB   ASP  11          3HB       ASP  11  -3.792   7.066  -6.981
   77    H    ILE  12           H        ILE  12  -6.657   4.781  -6.989
   78    HA   ILE  12           HA       ILE  12  -4.855   2.693  -7.282
   79    HB   ILE  12           HB       ILE  12  -6.550   1.245  -6.551
   80   1HG1  ILE  12          2HG1      ILE  12  -8.473   3.520  -6.625
   81   2HG1  ILE  12          3HG1      ILE  12  -8.529   2.114  -7.694
   82   1HG2  ILE  12          1HG2      ILE  12  -6.403   3.834  -4.969
   83   2HG2  ILE  12          2HG2      ILE  12  -6.908   2.269  -4.333
   84   3HG2  ILE  12          3HG2      ILE  12  -5.256   2.490  -4.929
   85   1HD1  ILE  12          1HD1      ILE  12 -10.154   1.696  -6.054
   86   2HD1  ILE  12          2HD1      ILE  12  -8.775   0.675  -5.608
   87   3HD1  ILE  12          3HD1      ILE  12  -9.097   2.191  -4.729
   88    H    ALA  13           H        ALA  13  -7.678   3.643  -9.280
   89    HA   ALA  13           HA       ALA  13  -7.622   1.446 -11.041
   90   1HB   ALA  13          1HB       ALA  13  -8.346   4.321 -11.756
   91   2HB   ALA  13          2HB       ALA  13  -8.856   2.842 -12.584
   92   3HB   ALA  13          3HB       ALA  13  -9.419   3.170 -10.933
   93    H    ALA  14           H        ALA  14  -5.826   4.582 -11.223
   94    HA   ALA  14           HA       ALA  14  -4.346   3.913 -13.589
   95   1HB   ALA  14          1HB       ALA  14  -2.691   5.556 -12.841
   96   2HB   ALA  14          2HB       ALA  14  -4.351   6.200 -12.708
   97   3HB   ALA  14          3HB       ALA  14  -3.475   5.663 -11.256
   98    H    ALA  15           H        ALA  15  -3.504   3.505 -10.119
   99    HA   ALA  15           HA       ALA  15  -0.990   2.444 -10.392
  100   1HB   ALA  15          1HB       ALA  15  -2.304   3.149  -8.259
  101   2HB   ALA  15          2HB       ALA  15  -2.920   1.488  -8.249
  102   3HB   ALA  15          3HB       ALA  15  -1.173   1.798  -8.165
  103    H    LEU  16           H        LEU  16  -4.085   0.752 -10.400
  104    HA   LEU  16           HA       LEU  16  -3.195  -1.898 -10.524
  105   1HB   LEU  16          2HB       LEU  16  -5.542  -0.991 -10.170
  106   2HB   LEU  16          3HB       LEU  16  -5.641  -0.685 -11.897
  107    HG   LEU  16           HG       LEU  16  -6.863  -2.636 -11.230
  108   1HD1  LEU  16          1HD1      LEU  16  -6.224  -4.184 -12.869
  109   2HD1  LEU  16          2HD1      LEU  16  -5.673  -2.614 -13.485
  110   3HD1  LEU  16          3HD1      LEU  16  -4.515  -3.765 -12.768
  111   1HD2  LEU  16          1HD2      LEU  16  -5.883  -4.647 -10.311
  112   2HD2  LEU  16          2HD2      LEU  16  -4.265  -3.924 -10.304
  113   3HD2  LEU  16          3HD2      LEU  16  -5.536  -3.274  -9.243
  114    H    GLN  17           H        GLN  17  -3.552   0.609 -13.045
  115    HA   GLN  17           HA       GLN  17  -3.054  -1.290 -15.228
  116   1HB   GLN  17          2HB       GLN  17  -3.656   1.660 -15.071
  117   2HB   GLN  17          3HB       GLN  17  -3.059   0.909 -16.569
  118   1HG   GLN  17          2HG       GLN  17  -4.883  -0.660 -16.633
  119   2HG   GLN  17          3HG       GLN  17  -5.430  -0.209 -15.012
  120   1HE2  GLN  17          1HE2      GLN  17  -4.455   2.465 -17.079
  121   2HE2  GLN  17          2HE2      GLN  17  -6.093   2.963 -17.462
  122    H    GLU  18           H        GLU  18  -1.222   1.236 -13.460
  123    HA   GLU  18           HA       GLU  18   1.029   1.043 -15.233
  124   1HB   GLU  18          2HB       GLU  18   2.039   2.643 -13.935
  125   2HB   GLU  18          3HB       GLU  18   0.343   2.933 -13.689
  126   1HG   GLU  18          2HG       GLU  18   1.134   3.201 -11.592
  127   2HG   GLU  18          3HG       GLU  18   0.641   1.507 -11.509
  128    H    CYS  19           H        CYS  19   0.201  -0.570 -12.150
  129    HA   CYS  19           HA       CYS  19   2.536  -2.365 -12.292
  130   1HB   CYS  19          2HB       CYS  19   0.154  -2.275 -10.393
  131   2HB   CYS  19          3HB       CYS  19   1.586  -3.309 -10.223
  132    HG   CYS  19           HG       CYS  19   1.667  -0.022 -10.461
  133    H    ARG  20           H        ARG  20   0.988  -2.624 -14.656
  134    HA   ARG  20           HA       ARG  20  -0.877  -4.902 -14.274
  135   1HB   ARG  20          2HB       ARG  20  -0.193  -3.076 -16.510
  136   2HB   ARG  20          3HB       ARG  20  -0.325  -4.758 -16.999
  137   1HG   ARG  20          2HG       ARG  20  -2.512  -5.019 -16.114
  138   2HG   ARG  20          3HG       ARG  20  -2.477  -3.431 -15.331
  139   1HD   ARG  20          2HD       ARG  20  -2.424  -2.293 -17.468
  140   2HD   ARG  20          3HD       ARG  20  -2.178  -3.831 -18.334
  141    HE   ARG  20           HE       ARG  20  -4.583  -4.022 -16.840
  142   1HH1  ARG  20          2HH2      ARG  20  -3.298  -2.260 -19.591
  143   2HH1  ARG  20          1HH2      ARG  20  -4.775  -2.234 -20.506
  144   1HH2  ARG  20          2HH1      ARG  20  -6.585  -4.064 -18.028
  145   2HH2  ARG  20          1HH1      ARG  20  -6.703  -3.287 -19.572
  146    H    ASP  21           H        ASP  21   2.253  -4.263 -15.885
  147    HA   ASP  21           HA       ASP  21   2.661  -7.001 -16.559
  148   1HB   ASP  21          2HB       ASP  21   4.259  -4.435 -16.688
  149   2HB   ASP  21          3HB       ASP  21   5.094  -5.964 -16.881
  150    HA   PRO  22           HA       PRO  22   4.043  -8.429 -12.662
  151   1HB   PRO  22          2HB       PRO  22   5.696 -10.540 -13.311
  152   2HB   PRO  22          3HB       PRO  22   3.919 -10.593 -13.439
  153   1HG   PRO  22          2HG       PRO  22   5.932 -10.012 -15.620
  154   2HG   PRO  22          3HG       PRO  22   4.521 -11.109 -15.701
  155   1HD   PRO  22          2HD       PRO  22   4.458  -8.574 -16.711
  156   2HD   PRO  22          3HD       PRO  22   3.021  -9.269 -15.906
  157    H    ASP  23           H        ASP  23   5.542  -8.010 -11.233
  158    HA   ASP  23           HA       ASP  23   7.235  -7.240 -10.188
  159   1HB   ASP  23          2HB       ASP  23   8.312  -9.281 -11.251
  160   2HB   ASP  23          3HB       ASP  23   9.051  -8.197 -12.440
  161    H    THR  24           H        THR  24   5.869  -5.392 -11.739
  162    HA   THR  24           HA       THR  24   7.916  -3.437 -12.776
  163    HB   THR  24           HB       THR  24   4.894  -3.382 -13.136
  164    HG1  THR  24           1HG      THR  24   5.581  -5.084 -14.227
  165   1HG2  THR  24          1HG2      THR  24   5.924  -1.161 -13.462
  166   2HG2  THR  24          2HG2      THR  24   7.150  -1.877 -14.541
  167   3HG2  THR  24          3HG2      THR  24   5.439  -1.855 -15.015
  168    H    PHE  25           H        PHE  25   5.479  -4.063 -10.341
  169    HA   PHE  25           HA       PHE  25   4.828  -1.525  -9.422
  170   1HB   PHE  25          2HB       PHE  25   3.958  -3.871  -8.957
  171   2HB   PHE  25          3HB       PHE  25   5.243  -4.049  -7.767
  172    HD1  PHE  25           1HD      PHE  25   1.953  -3.989  -7.916
  173    HD2  PHE  25           2HD      PHE  25   5.044  -1.480  -6.227
  174    HE1  PHE  25           1HE      PHE  25   0.360  -3.146  -6.239
  175    HE2  PHE  25           2HE      PHE  25   3.380  -0.520  -4.687
  176    HZ   PHE  25           HZ       PHE  25   1.063  -1.407  -4.625
  177    H    GLU  26           H        GLU  26   5.965   0.016  -8.367
  178    HA   GLU  26           HA       GLU  26   8.476  -0.681  -6.909
  179   1HB   GLU  26          2HB       GLU  26   7.907   1.444  -8.899
  180   2HB   GLU  26          3HB       GLU  26   8.704   2.002  -7.436
  181   1HG   GLU  26          2HG       GLU  26  10.481   0.255  -7.790
  182   2HG   GLU  26          3HG       GLU  26   9.776  -0.043  -9.391
  183    HA   PRO  27           HA       PRO  27   6.275   1.120  -3.510
  184   1HB   PRO  27          2HB       PRO  27   8.322   2.264  -2.049
  185   2HB   PRO  27          3HB       PRO  27   7.933   0.526  -2.075
  186   1HG   PRO  27          2HG       PRO  27  10.153   1.945  -3.534
  187   2HG   PRO  27          3HG       PRO  27  10.140   0.304  -2.836
  188   1HD   PRO  27          2HD       PRO  27   9.811   0.834  -5.514
  189   2HD   PRO  27          3HD       PRO  27   9.181  -0.616  -4.689
  190    H    GLN  28           H        GLN  28   8.975   3.397  -4.309
  191    HA   GLN  28           HA       GLN  28   7.489   5.696  -3.641
  192   1HB   GLN  28          2HB       GLN  28   9.967   5.366  -5.356
  193   2HB   GLN  28          3HB       GLN  28   9.291   6.931  -4.868
  194   1HG   GLN  28          2HG       GLN  28   9.481   6.325  -2.488
  195   2HG   GLN  28          3HG       GLN  28  10.186   4.759  -2.911
  196   1HE2  GLN  28          1HE2      GLN  28  12.194   5.029  -4.537
  197   2HE2  GLN  28          2HE2      GLN  28  13.317   6.273  -4.017
  198    H    LYS  29           H        LYS  29   7.846   4.031  -6.756
  199    HA   LYS  29           HA       LYS  29   6.488   5.930  -8.380
  200   1HB   LYS  29          2HB       LYS  29   7.796   3.859  -9.139
  201   2HB   LYS  29          3HB       LYS  29   6.363   2.914  -8.665
  202   1HG   LYS  29          2HG       LYS  29   5.047   4.521 -10.194
  203   2HG   LYS  29          3HG       LYS  29   6.605   4.989 -10.874
  204   1HD   LYS  29          2HD       LYS  29   5.534   2.103 -10.745
  205   2HD   LYS  29          3HD       LYS  29   5.172   3.239 -12.020
  206   1HE   LYS  29          2HE       LYS  29   6.777   2.024 -13.019
  207   2HE   LYS  29          3HE       LYS  29   7.698   3.434 -12.476
  208   1HZ   LYS  29          1HZ       LYS  29   7.622   0.796 -11.094
  209   2HZ   LYS  29          2HZ       LYS  29   8.800   1.308 -12.106
  210   3HZ   LYS  29          3HZ       LYS  29   8.615   2.090 -10.728
  211    H    PHE  30           H        PHE  30   5.172   2.882  -6.897
  212    HA   PHE  30           HA       PHE  30   2.502   3.356  -7.562
  213   1HB   PHE  30          2HB       PHE  30   3.315   1.193  -6.859
  214   2HB   PHE  30          3HB       PHE  30   3.726   1.814  -5.256
  215    HD1  PHE  30           1HD      PHE  30   1.000   0.655  -7.439
  216    HD2  PHE  30           2HD      PHE  30   1.995   2.274  -3.564
  217    HE1  PHE  30           1HE      PHE  30  -1.251   0.057  -6.598
  218    HE2  PHE  30           2HE      PHE  30  -0.285   1.749  -2.758
  219    HZ   PHE  30           HZ       PHE  30  -1.944   0.721  -4.310
  220    H    PHE  31           H        PHE  31   4.280   4.161  -4.634
  221    HA   PHE  31           HA       PHE  31   2.452   5.161  -2.860
  222   1HB   PHE  31          2HB       PHE  31   4.750   4.993  -2.283
  223   2HB   PHE  31          3HB       PHE  31   5.244   5.927  -3.690
  224    HD1  PHE  31           1HD      PHE  31   2.745   6.685  -1.035
  225    HD2  PHE  31           2HD      PHE  31   6.400   7.856  -3.018
  226    HE1  PHE  31           1HE      PHE  31   2.739   8.795   0.143
  227    HE2  PHE  31           2HE      PHE  31   6.588   9.811  -1.490
  228    HZ   PHE  31           HZ       PHE  31   4.804  10.254   0.172
  229    H    GLN  32           H        GLN  32   4.056   7.062  -5.486
  230    HA   GLN  32           HA       GLN  32   2.330   9.358  -4.974
  231   1HB   GLN  32          2HB       GLN  32   4.629   8.733  -6.779
  232   2HB   GLN  32          3HB       GLN  32   3.446   9.909  -7.383
  233   1HG   GLN  32          2HG       GLN  32   3.677  11.300  -5.422
  234   2HG   GLN  32          3HG       GLN  32   4.671  10.087  -4.599
  235   1HE2  GLN  32          1HE2      GLN  32   4.780  11.570  -7.920
  236   2HE2  GLN  32          2HE2      GLN  32   6.450  12.088  -7.757
  237    H    THR  33           H        THR  33   2.459   6.719  -7.454
  238    HA   THR  33           HA       THR  33   0.431   7.736  -9.048
  239    HB   THR  33           HB       THR  33   2.094   5.479  -9.079
  240    HG1  THR  33           1HG      THR  33  -0.132   6.235 -10.554
  241   1HG2  THR  33          1HG2      THR  33   0.786   3.537  -9.368
  242   2HG2  THR  33          2HG2      THR  33   0.287   4.146  -7.796
  243   3HG2  THR  33          3HG2      THR  33  -0.734   4.443  -9.216
  244    H    SER  34           H        SER  34   0.239   6.112  -6.001
  245    HA   SER  34           HA       SER  34  -2.564   5.443  -6.171
  246   1HB   SER  34          2HB       SER  34  -0.854   3.989  -5.186
  247   2HB   SER  34          3HB       SER  34  -0.574   5.173  -3.898
  248    HG   SER  34           HG       SER  34  -2.057   3.389  -3.431
  249    H    GLY  35           H        GLY  35  -0.763   8.276  -5.345
  250   1HA   GLY  35          1HA       GLY  35  -1.645  10.351  -4.878
  251   2HA   GLY  35          2HA       GLY  35  -3.234   9.641  -4.555
  252    H    LEU  36           H        LEU  36  -1.061   7.805  -2.884
  253    HA   LEU  36           HA       LEU  36  -2.012   8.599  -0.348
  254   1HB   LEU  36          2HB       LEU  36   0.362   6.877  -1.146
  255   2HB   LEU  36          3HB       LEU  36  -0.434   6.918   0.431
  256    HG   LEU  36           HG       LEU  36  -1.835   6.006  -2.079
  257   1HD1  LEU  36          1HD1      LEU  36   0.026   4.503  -1.456
  258   2HD1  LEU  36          2HD1      LEU  36  -0.583   4.428   0.211
  259   3HD1  LEU  36          3HD1      LEU  36  -1.541   3.743  -1.119
  260   1HD2  LEU  36          1HD2      LEU  36  -3.424   6.838  -0.417
  261   2HD2  LEU  36          2HD2      LEU  36  -3.471   5.075  -0.450
  262   3HD2  LEU  36          3HD2      LEU  36  -2.618   5.906   0.866
  263    H    SER  37           H        SER  37   0.827   9.560  -2.251
  264    HA   SER  37           HA       SER  37   2.289  10.936  -0.183
  265   1HB   SER  37          2HB       SER  37   3.289  12.083  -2.161
  266   2HB   SER  37          3HB       SER  37   3.233  10.331  -2.408
  267    HG   SER  37           HG       SER  37   1.463  12.242  -3.503
  268    H    LYS  38           H        LYS  38  -0.606  11.736  -2.054
  269    HA   LYS  38           HA       LYS  38  -0.272  14.588  -1.438
  270   1HB   LYS  38          2HB       LYS  38  -1.353  13.342  -3.629
  271   2HB   LYS  38          3HB       LYS  38  -2.805  13.558  -2.681
  272   1HG   LYS  38          2HG       LYS  38  -1.397  16.050  -2.499
  273   2HG   LYS  38          3HG       LYS  38  -1.227  15.526  -4.179
  274   1HD   LYS  38          2HD       LYS  38  -3.680  15.339  -4.369
  275   2HD   LYS  38          3HD       LYS  38  -3.853  15.702  -2.633
  276   1HE   LYS  38          2HE       LYS  38  -2.761  17.929  -2.996
  277   2HE   LYS  38          3HE       LYS  38  -2.661  17.590  -4.731
  278   1HZ   LYS  38          1HZ       LYS  38  -5.147  17.804  -3.161
  279   2HZ   LYS  38          2HZ       LYS  38  -4.545  18.951  -4.172
  280   3HZ   LYS  38          3HZ       LYS  38  -5.062  17.513  -4.781
  281    H    MET  39           H        MET  39  -2.068  11.682  -0.505
  282    HA   MET  39           HA       MET  39  -4.003  12.955   1.109
  283   1HB   MET  39          2HB       MET  39  -2.711  10.229   1.033
  284   2HB   MET  39          3HB       MET  39  -3.602  10.665   2.471
  285   1HG   MET  39          2HG       MET  39  -5.587  11.219   1.142
  286   2HG   MET  39          3HG       MET  39  -4.750  10.702  -0.334
  287   1HE   MET  39          1HE       MET  39  -7.626   9.687   1.262
  288   2HE   MET  39          2HE       MET  39  -7.168   9.470  -0.440
  289   3HE   MET  39          3HE       MET  39  -7.591   8.053   0.557
  290    H    SER  40           H        SER  40  -3.772  14.206   2.944
  291    HA   SER  40           HA       SER  40  -1.325  14.635   4.283
  292   1HB   SER  40          2HB       SER  40  -4.144  14.882   5.423
  293   2HB   SER  40          3HB       SER  40  -2.711  15.812   5.902
  294    HG   SER  40           HG       SER  40  -2.715  16.629   3.699
  295    H    ALA  41           H        ALA  41  -0.703  13.951   6.453
  296    HA   ALA  41           HA       ALA  41  -0.640  11.306   7.103
  297   1HB   ALA  41          1HB       ALA  41  -0.784  13.649   9.044
  298   2HB   ALA  41          2HB       ALA  41  -0.219  12.011   9.433
  299   3HB   ALA  41          3HB       ALA  41   0.677  12.996   8.272
  300    H    ASN  42           H        ASN  42  -3.186  13.612   7.986
  301    HA   ASN  42           HA       ASN  42  -4.850  12.147   9.652
  302   1HB   ASN  42          2HB       ASN  42  -5.845  13.828   7.314
  303   2HB   ASN  42          3HB       ASN  42  -6.697  13.467   8.816
  304   1HD2  ASN  42          1HD2      ASN  42  -5.686  16.051   7.421
  305   2HD2  ASN  42          2HD2      ASN  42  -4.808  16.870   8.701
  306    H    GLN  43           H        GLN  43  -4.902  12.169   6.056
  307    HA   GLN  43           HA       GLN  43  -7.017  10.170   5.932
  308   1HB   GLN  43          2HB       GLN  43  -5.244  11.418   3.793
  309   2HB   GLN  43          3HB       GLN  43  -6.570  10.289   3.479
  310   1HG   GLN  43          2HG       GLN  43  -6.799  13.062   4.730
  311   2HG   GLN  43          3HG       GLN  43  -7.282  12.605   3.094
  312   1HE2  GLN  43          1HE2      GLN  43  -8.865  10.505   3.146
  313   2HE2  GLN  43          2HE2      GLN  43 -10.164  10.677   4.312
  314    H    VAL  44           H        VAL  44  -3.416  10.228   5.455
  315    HA   VAL  44           HA       VAL  44  -3.193   7.574   4.493
  316    HB   VAL  44           HB       VAL  44  -1.343   9.302   6.206
  317   1HG1  VAL  44          1HG1      VAL  44  -0.574   6.994   6.361
  318   2HG1  VAL  44          2HG1      VAL  44  -0.750   6.796   4.603
  319   3HG1  VAL  44          3HG1      VAL  44   0.474   7.913   5.268
  320   1HG2  VAL  44          1HG2      VAL  44  -0.271   9.886   4.082
  321   2HG2  VAL  44          2HG2      VAL  44  -1.407   8.839   3.189
  322   3HG2  VAL  44          3HG2      VAL  44  -1.971  10.299   3.998
  323    H    LYS  45           H        LYS  45  -3.208   8.879   7.833
  324    HA   LYS  45           HA       LYS  45  -2.875   6.383   9.160
  325   1HB   LYS  45          2HB       LYS  45  -2.597   8.760  10.077
  326   2HB   LYS  45          3HB       LYS  45  -4.359   8.800  10.215
  327   1HG   LYS  45          2HG       LYS  45  -3.622   6.371  11.469
  328   2HG   LYS  45          3HG       LYS  45  -2.271   7.450  11.827
  329   1HD   LYS  45          2HD       LYS  45  -4.186   9.171  12.464
  330   2HD   LYS  45          3HD       LYS  45  -5.202   7.714  12.541
  331   1HE   LYS  45          2HE       LYS  45  -3.532   6.726  14.182
  332   2HE   LYS  45          3HE       LYS  45  -2.603   8.234  14.089
  333   1HZ   LYS  45          1HZ       LYS  45  -4.550   9.390  14.941
  334   2HZ   LYS  45          2HZ       LYS  45  -5.344   7.958  15.120
  335   3HZ   LYS  45          3HZ       LYS  45  -3.985   8.262  15.993
  336    H    ASP  46           H        ASP  46  -5.798   8.275   8.125
  337    HA   ASP  46           HA       ASP  46  -7.618   6.529   9.334
  338   1HB   ASP  46          2HB       ASP  46  -8.049   8.862   8.311
  339   2HB   ASP  46          3HB       ASP  46  -8.253   8.034   6.761
  340    H    VAL  47           H        VAL  47  -6.555   6.586   5.898
  341    HA   VAL  47           HA       VAL  47  -7.870   4.230   5.101
  342    HB   VAL  47           HB       VAL  47  -6.417   4.134   3.203
  343   1HG1  VAL  47          1HG1      VAL  47  -7.025   6.136   2.186
  344   2HG1  VAL  47          2HG1      VAL  47  -8.164   6.052   3.554
  345   3HG1  VAL  47          3HG1      VAL  47  -6.752   7.102   3.632
  346   1HG2  VAL  47          1HG2      VAL  47  -4.550   5.625   2.803
  347   2HG2  VAL  47          2HG2      VAL  47  -4.663   6.116   4.499
  348   3HG2  VAL  47          3HG2      VAL  47  -4.219   4.447   4.087
  349    H    PHE  48           H        PHE  48  -4.585   4.609   6.556
  350    HA   PHE  48           HA       PHE  48  -3.787   1.944   6.629
  351   1HB   PHE  48          2HB       PHE  48  -2.201   3.270   7.549
  352   2HB   PHE  48          3HB       PHE  48  -3.345   4.291   8.377
  353    HD1  PHE  48           1HD      PHE  48  -3.674   4.110  10.700
  354    HD2  PHE  48           2HD      PHE  48  -2.035   0.777   8.520
  355    HE1  PHE  48           1HE      PHE  48  -3.739   2.745  12.755
  356    HE2  PHE  48           2HE      PHE  48  -2.205  -0.618  10.563
  357    HZ   PHE  48           HZ       PHE  48  -3.094   0.354  12.670
  358    H    ARG  49           H        ARG  49  -6.188   3.473   8.878
  359    HA   ARG  49           HA       ARG  49  -6.595   1.080  10.399
  360   1HB   ARG  49          2HB       ARG  49  -8.563   3.339   9.881
  361   2HB   ARG  49          3HB       ARG  49  -8.727   2.072  11.093
  362   1HG   ARG  49          2HG       ARG  49  -6.626   2.799  12.186
  363   2HG   ARG  49          3HG       ARG  49  -6.497   4.148  11.050
  364   1HD   ARG  49          2HD       ARG  49  -8.783   3.615  12.986
  365   2HD   ARG  49          3HD       ARG  49  -7.516   4.848  13.182
  366    HE   ARG  49           HE       ARG  49  -8.792   5.325  10.676
  367   1HH1  ARG  49          2HH2      ARG  49  -9.660   5.334  14.091
  368   2HH1  ARG  49          1HH2      ARG  49 -10.878   6.565  13.937
  369   1HH2  ARG  49          2HH1      ARG  49 -10.421   6.864  10.423
  370   2HH2  ARG  49          1HH1      ARG  49 -11.266   7.549  11.780
  371    H    PHE  50           H        PHE  50  -7.854   2.030   7.214
  372    HA   PHE  50           HA       PHE  50  -9.886  -0.099   7.198
  373   1HB   PHE  50          2HB       PHE  50  -8.862   1.857   5.149
  374   2HB   PHE  50          3HB       PHE  50  -9.597   0.365   4.618
  375    HD1  PHE  50           1HD      PHE  50 -11.945  -0.122   4.896
  376    HD2  PHE  50           2HD      PHE  50 -10.268   3.526   6.480
  377    HE1  PHE  50           1HE      PHE  50 -14.219   0.841   5.089
  378    HE2  PHE  50           2HE      PHE  50 -12.544   4.493   6.643
  379    HZ   PHE  50           HZ       PHE  50 -14.523   3.168   5.918
  380    H    ILE  51           H        ILE  51  -6.433   0.221   6.369
  381    HA   ILE  51           HA       ILE  51  -6.416  -2.408   5.055
  382    HB   ILE  51           HB       ILE  51  -4.006  -0.719   5.797
  383   1HG1  ILE  51          2HG1      ILE  51  -5.419   0.728   4.434
  384   2HG1  ILE  51          3HG1      ILE  51  -4.068   0.167   3.499
  385   1HG2  ILE  51          1HG2      ILE  51  -3.044  -2.684   4.966
  386   2HG2  ILE  51          2HG2      ILE  51  -4.459  -3.105   3.987
  387   3HG2  ILE  51          3HG2      ILE  51  -3.329  -1.865   3.461
  388   1HD1  ILE  51          1HD1      ILE  51  -6.980  -0.551   3.237
  389   2HD1  ILE  51          2HD1      ILE  51  -5.764  -0.138   2.003
  390   3HD1  ILE  51          3HD1      ILE  51  -5.776  -1.743   2.702
  391    H    ASP  52           H        ASP  52  -4.198  -3.694   6.066
  392    HA   ASP  52           HA       ASP  52  -3.355  -5.012   7.652
  393   1HB   ASP  52          2HB       ASP  52  -3.324  -2.923   9.086
  394   2HB   ASP  52          3HB       ASP  52  -4.852  -3.444   9.783
  395    H    ASN  53           H        ASN  53  -6.677  -4.233   8.504
  396    HA   ASN  53           HA       ASN  53  -8.574  -5.488   8.168
  397   1HB   ASN  53          2HB       ASN  53  -7.264  -7.269   6.821
  398   2HB   ASN  53          3HB       ASN  53  -7.070  -8.131   8.352
  399   1HD2  ASN  53          1HD2      ASN  53  -8.772  -9.485   8.946
  400   2HD2  ASN  53          2HD2      ASN  53 -10.355  -9.440   8.193
  401    H    ASP  54           H        ASP  54  -6.139  -7.141  10.265
  402    HA   ASP  54           HA       ASP  54  -7.714  -7.452  12.529
  403   1HB   ASP  54          2HB       ASP  54  -5.108  -6.656  13.406
  404   2HB   ASP  54          3HB       ASP  54  -5.808  -8.261  13.384
  405    H    GLN  55           H        GLN  55  -6.188  -4.542  11.320
  406    HA   GLN  55           HA       GLN  55  -5.848  -2.479  12.140
  407   1HB   GLN  55          2HB       GLN  55  -8.424  -3.048  13.671
  408   2HB   GLN  55          3HB       GLN  55  -7.488  -1.580  13.950
  409   1HG   GLN  55          2HG       GLN  55  -7.650  -0.941  11.624
  410   2HG   GLN  55          3HG       GLN  55  -8.591  -2.399  11.250
  411   1HE2  GLN  55          1HE2      GLN  55  -9.882  -0.279  10.508
  412   2HE2  GLN  55          2HE2      GLN  55 -11.131   0.223  11.656
  413    H    SER  56           H        SER  56  -4.089  -4.250  12.898
  414    HA   SER  56           HA       SER  56  -3.763  -4.136  15.861
  415   1HB   SER  56          2HB       SER  56  -1.841  -5.629  15.485
  416   2HB   SER  56          3HB       SER  56  -3.388  -6.342  15.018
  417    HG   SER  56           HG       SER  56  -2.878  -6.186  12.938
  418    H    GLY  57           H        GLY  57  -2.234  -3.251  12.747
  419   1HA   GLY  57          1HA       GLY  57  -1.218  -0.983  12.650
  420   2HA   GLY  57          2HA       GLY  57  -0.499  -1.247  14.235
  421    H    TYR  58           H        TYR  58   0.194  -4.042  13.720
  422    HA   TYR  58           HA       TYR  58   2.629  -3.770  12.033
  423   1HB   TYR  58          2HB       TYR  58   1.369  -6.036  13.609
  424   2HB   TYR  58          3HB       TYR  58   2.704  -6.235  12.481
  425    HD1  TYR  58           HD1      TYR  58   4.806  -6.400  13.432
  426    HD2  TYR  58           HD2      TYR  58   1.872  -3.889  15.360
  427    HE1  TYR  58           HE1      TYR  58   6.491  -5.700  15.101
  428    HE2  TYR  58           HE2      TYR  58   3.574  -3.160  16.991
  429    HH   TYR  58           HH       TYR  58   6.951  -4.303  16.892
  430    H    LEU  59           H        LEU  59   2.256  -3.504   9.962
  431    HA   LEU  59           HA       LEU  59   0.230  -5.132   8.543
  432   1HB   LEU  59          2HB       LEU  59   2.113  -2.876   7.769
  433   2HB   LEU  59          3HB       LEU  59   1.445  -3.959   6.544
  434    HG   LEU  59           HG       LEU  59   0.155  -1.843   6.822
  435   1HD1  LEU  59          1HD1      LEU  59  -0.888  -3.707   5.752
  436   2HD1  LEU  59          2HD1      LEU  59  -1.309  -4.450   7.301
  437   3HD1  LEU  59          3HD1      LEU  59  -2.049  -2.914   6.846
  438   1HD2  LEU  59          1HD2      LEU  59   0.320  -1.590   9.271
  439   2HD2  LEU  59          2HD2      LEU  59  -1.339  -1.520   8.650
  440   3HD2  LEU  59          3HD2      LEU  59  -0.780  -2.981   9.478
  441    H    ASP  60           H        ASP  60   1.027  -7.034   9.252
  442    HA   ASP  60           HA       ASP  60   3.763  -7.863   8.873
  443   1HB   ASP  60          2HB       ASP  60   1.377  -9.698   9.239
  444   2HB   ASP  60          3HB       ASP  60   3.073  -9.926   9.719
  445    H    GLU  61           H        GLU  61   4.517  -9.415   7.318
  446    HA   GLU  61           HA       GLU  61   4.152  -8.720   4.714
  447   1HB   GLU  61          2HB       GLU  61   5.000 -11.459   5.758
  448   2HB   GLU  61          3HB       GLU  61   5.290 -10.852   4.126
  449   1HG   GLU  61          2HG       GLU  61   6.714  -9.059   4.971
  450   2HG   GLU  61          3HG       GLU  61   6.389  -9.502   6.646
  451    H    GLU  62           H        GLU  62   2.544 -11.471   6.312
  452    HA   GLU  62           HA       GLU  62   1.243 -12.516   4.054
  453   1HB   GLU  62          2HB       GLU  62   1.494 -13.428   6.532
  454   2HB   GLU  62          3HB       GLU  62  -0.005 -12.536   6.830
  455   1HG   GLU  62          2HG       GLU  62  -0.692 -14.731   6.316
  456   2HG   GLU  62          3HG       GLU  62  -0.950 -13.870   4.791
  457    H    GLU  63           H        GLU  63   0.254  -9.798   6.199
  458    HA   GLU  63           HA       GLU  63  -2.448  -9.657   5.100
  459   1HB   GLU  63          2HB       GLU  63  -0.742  -7.694   6.631
  460   2HB   GLU  63          3HB       GLU  63  -2.468  -7.479   6.327
  461   1HG   GLU  63          2HG       GLU  63  -3.139  -9.077   7.810
  462   2HG   GLU  63          3HG       GLU  63  -1.772 -10.156   7.529
  463    H    LEU  64           H        LEU  64   0.744  -8.358   4.331
  464    HA   LEU  64           HA       LEU  64  -0.109  -6.409   2.478
  465   1HB   LEU  64          2HB       LEU  64   2.360  -7.443   3.345
  466   2HB   LEU  64          3HB       LEU  64   2.362  -7.695   1.599
  467    HG   LEU  64           HG       LEU  64   1.596  -5.035   2.898
  468   1HD1  LEU  64          1HD1      LEU  64   3.930  -4.301   2.538
  469   2HD1  LEU  64          2HD1      LEU  64   3.807  -5.596   3.742
  470   3HD1  LEU  64          3HD1      LEU  64   4.372  -5.967   2.099
  471   1HD2  LEU  64          1HD2      LEU  64   2.170  -4.070   0.750
  472   2HD2  LEU  64          2HD2      LEU  64   2.821  -5.611   0.164
  473   3HD2  LEU  64          3HD2      LEU  64   1.078  -5.427   0.429
  474    H    LYS  65           H        LYS  65  -0.074  -9.934   2.279
  475    HA   LYS  65           HA       LYS  65  -0.480 -10.228  -0.519
  476   1HB   LYS  65          2HB       LYS  65   0.029 -11.990   1.300
  477   2HB   LYS  65          3HB       LYS  65  -1.728 -11.958   1.606
  478   1HG   LYS  65          2HG       LYS  65  -2.232 -12.808  -0.573
  479   2HG   LYS  65          3HG       LYS  65  -0.560 -12.568  -1.110
  480   1HD   LYS  65          2HD       LYS  65  -0.925 -14.924  -0.631
  481   2HD   LYS  65          3HD       LYS  65   0.239 -14.238   0.514
  482   1HE   LYS  65          2HE       LYS  65  -1.611 -14.040   2.224
  483   2HE   LYS  65          3HE       LYS  65  -2.717 -14.820   1.074
  484   1HZ   LYS  65          1HZ       LYS  65  -1.152 -16.749   1.195
  485   2HZ   LYS  65          2HZ       LYS  65  -0.283 -15.896   2.322
  486   3HZ   LYS  65          3HZ       LYS  65  -1.790 -16.345   2.670
  487    H    PHE  66           H        PHE  66  -2.540  -8.689   1.783
  488    HA   PHE  66           HA       PHE  66  -4.682  -8.648  -0.255
  489   1HB   PHE  66          2HB       PHE  66  -4.943  -9.239   2.716
  490   2HB   PHE  66          3HB       PHE  66  -6.257  -8.455   1.871
  491    HD1  PHE  66           1HD      PHE  66  -4.229 -11.588   1.881
  492    HD2  PHE  66           2HD      PHE  66  -7.839  -9.621   0.570
  493    HE1  PHE  66           1HE      PHE  66  -5.063 -13.725   0.931
  494    HE2  PHE  66           2HE      PHE  66  -8.663 -11.754  -0.367
  495    HZ   PHE  66           HZ       PHE  66  -7.267 -13.806  -0.218
  496    H    PHE  67           H        PHE  67  -2.362  -6.815   0.541
  497    HA   PHE  67           HA       PHE  67  -3.298  -4.593   2.004
  498   1HB   PHE  67          2HB       PHE  67  -1.009  -4.724   1.576
  499   2HB   PHE  67          3HB       PHE  67  -1.215  -4.954  -0.152
  500    HD1  PHE  67           1HD      PHE  67  -1.111  -3.097  -1.626
  501    HD2  PHE  67           2HD      PHE  67  -1.304  -2.466   2.627
  502    HE1  PHE  67           1HE      PHE  67  -0.849  -0.671  -1.982
  503    HE2  PHE  67           2HE      PHE  67  -1.056  -0.023   2.277
  504    HZ   PHE  67           HZ       PHE  67  -0.835   0.887  -0.030
  505    H    LEU  68           H        LEU  68  -3.050  -4.689  -1.589
  506    HA   LEU  68           HA       LEU  68  -4.919  -2.512  -1.776
  507   1HB   LEU  68          2HB       LEU  68  -2.811  -3.042  -3.189
  508   2HB   LEU  68          3HB       LEU  68  -3.871  -4.166  -4.050
  509    HG   LEU  68           HG       LEU  68  -5.232  -2.369  -4.885
  510   1HD1  LEU  68          1HD1      LEU  68  -4.469   0.011  -4.465
  511   2HD1  LEU  68          2HD1      LEU  68  -5.138  -0.794  -3.039
  512   3HD1  LEU  68          3HD1      LEU  68  -3.391  -0.614  -3.186
  513   1HD2  LEU  68          1HD2      LEU  68  -3.550  -1.371  -6.344
  514   2HD2  LEU  68          2HD2      LEU  68  -2.269  -1.671  -5.145
  515   3HD2  LEU  68          3HD2      LEU  68  -3.008  -3.021  -5.992
  516    H    GLN  69           H        GLN  69  -5.329  -5.916  -1.642
  517    HA   GLN  69           HA       GLN  69  -7.591  -6.352  -3.309
  518   1HB   GLN  69          2HB       GLN  69  -6.901  -7.529  -0.574
  519   2HB   GLN  69          3HB       GLN  69  -8.278  -8.053  -1.539
  520   1HG   GLN  69          2HG       GLN  69  -5.376  -8.224  -2.408
  521   2HG   GLN  69          3HG       GLN  69  -6.349  -9.567  -1.808
  522   1HE2  GLN  69          1HE2      GLN  69  -4.994  -9.147  -4.465
  523   2HE2  GLN  69          2HE2      GLN  69  -6.264  -9.416  -5.631
  524    H    LYS  70           H        LYS  70  -7.487  -5.364   0.148
  525    HA   LYS  70           HA       LYS  70 -10.332  -4.694   0.118
  526   1HB   LYS  70          2HB       LYS  70 -10.019  -4.191   2.450
  527   2HB   LYS  70          3HB       LYS  70  -9.199  -5.705   2.012
  528   1HG   LYS  70          2HG       LYS  70  -7.110  -4.007   1.693
  529   2HG   LYS  70          3HG       LYS  70  -8.030  -3.049   2.838
  530   1HD   LYS  70          2HD       LYS  70  -7.030  -5.923   3.215
  531   2HD   LYS  70          3HD       LYS  70  -6.341  -4.467   3.897
  532   1HE   LYS  70          2HE       LYS  70  -7.562  -5.298   5.687
  533   2HE   LYS  70          3HE       LYS  70  -8.629  -4.057   5.036
  534   1HZ   LYS  70          1HZ       LYS  70  -9.696  -6.217   5.585
  535   2HZ   LYS  70          2HZ       LYS  70  -9.968  -5.675   4.047
  536   3HZ   LYS  70          3HZ       LYS  70  -8.893  -6.891   4.342
  537    H    PHE  71           H        PHE  71  -9.165  -3.281  -1.884
  538    HA   PHE  71           HA       PHE  71  -9.642  -0.469  -1.209
  539   1HB   PHE  71          2HB       PHE  71  -6.954  -1.526  -1.534
  540   2HB   PHE  71          3HB       PHE  71  -7.357  -0.566  -2.951
  541    HD1  PHE  71           1HD      PHE  71  -5.856   1.250  -2.714
  542    HD2  PHE  71           2HD      PHE  71  -8.212   0.047   0.689
  543    HE1  PHE  71           1HE      PHE  71  -4.987   3.160  -1.448
  544    HE2  PHE  71           2HE      PHE  71  -7.334   1.965   1.958
  545    HZ   PHE  71           HZ       PHE  71  -5.725   3.546   0.894
  546    H    GLU  72           H        GLU  72  -8.388  -2.708  -3.739
  547    HA   GLU  72           HA       GLU  72 -10.277  -1.528  -5.722
  548   1HB   GLU  72          2HB       GLU  72  -7.799  -1.518  -6.157
  549   2HB   GLU  72          3HB       GLU  72  -7.833  -3.287  -6.142
  550   1HG   GLU  72          2HG       GLU  72  -7.877  -2.627  -8.419
  551   2HG   GLU  72          3HG       GLU  72  -9.535  -3.127  -8.076
  552    H    SER  73           H        SER  73  -9.205  -4.690  -4.385
  553    HA   SER  73           HA       SER  73 -10.142  -6.698  -4.306
  554   1HB   SER  73          2HB       SER  73 -12.540  -5.761  -5.915
  555   2HB   SER  73          3HB       SER  73 -12.335  -7.277  -5.048
  556    HG   SER  73           HG       SER  73 -13.194  -4.984  -4.059
  557    H    GLY  74           H        GLY  74  -8.844  -7.970  -5.361
  558   1HA   GLY  74          1HA       GLY  74  -8.193  -9.417  -7.073
  559   2HA   GLY  74          2HA       GLY  74  -9.206  -8.551  -8.238
  560    H    ALA  75           H        ALA  75  -6.747  -7.285  -5.992
  561    HA   ALA  75           HA       ALA  75  -5.314  -5.932  -8.172
  562   1HB   ALA  75          1HB       ALA  75  -4.912  -5.881  -5.168
  563   2HB   ALA  75          2HB       ALA  75  -4.183  -4.792  -6.379
  564   3HB   ALA  75          3HB       ALA  75  -5.923  -4.752  -6.095
  565    H    ARG  76           H        ARG  76  -2.710  -6.162  -6.480
  566    HA   ARG  76           HA       ARG  76  -1.883  -8.396  -8.255
  567   1HB   ARG  76          2HB       ARG  76  -1.215  -5.884  -8.617
  568   2HB   ARG  76          3HB       ARG  76  -0.135  -6.122  -7.242
  569   1HG   ARG  76          2HG       ARG  76   0.992  -6.395  -9.393
  570   2HG   ARG  76          3HG       ARG  76   1.060  -7.908  -8.488
  571   1HD   ARG  76          2HD       ARG  76  -0.555  -8.963  -9.913
  572   2HD   ARG  76          3HD       ARG  76  -1.232  -7.414 -10.419
  573    HE   ARG  76           HE       ARG  76   0.633  -6.972 -11.826
  574   1HH1  ARG  76          2HH2      ARG  76   1.209 -10.100 -10.295
  575   2HH1  ARG  76          1HH2      ARG  76   1.696 -10.886 -11.768
  576   1HH2  ARG  76          2HH1      ARG  76   1.283  -8.005 -13.775
  577   2HH2  ARG  76          1HH1      ARG  76   2.017  -9.580 -13.724
  578    H    GLU  77           H        GLU  77  -2.110  -7.491  -5.092
  579    HA   GLU  77           HA       GLU  77  -0.096  -7.936  -3.604
  580   1HB   GLU  77          2HB       GLU  77  -2.638  -9.365  -2.819
  581   2HB   GLU  77          3HB       GLU  77  -1.542  -8.370  -1.837
  582   1HG   GLU  77          2HG       GLU  77  -3.699  -7.510  -3.780
  583   2HG   GLU  77          3HG       GLU  77  -3.467  -7.067  -2.083
  584    H    LEU  78           H        LEU  78  -1.922 -10.628  -4.883
  585    HA   LEU  78           HA       LEU  78  -0.716 -12.828  -3.694
  586   1HB   LEU  78          2HB       LEU  78  -1.462 -12.790  -6.636
  587   2HB   LEU  78          3HB       LEU  78  -1.404 -14.147  -5.523
  588    HG   LEU  78           HG       LEU  78  -3.624 -13.842  -5.764
  589   1HD1  LEU  78          1HD1      LEU  78  -3.162 -12.067  -3.333
  590   2HD1  LEU  78          2HD1      LEU  78  -4.603 -13.019  -3.715
  591   3HD1  LEU  78          3HD1      LEU  78  -3.075 -13.843  -3.350
  592   1HD2  LEU  78          1HD2      LEU  78  -3.445 -11.672  -7.049
  593   2HD2  LEU  78          2HD2      LEU  78  -4.896 -11.918  -6.072
  594   3HD2  LEU  78          3HD2      LEU  78  -3.642 -10.823  -5.503
  595    H    THR  79           H        THR  79   0.588 -10.898  -6.472
  596    HA   THR  79           HA       THR  79   2.878 -12.638  -6.833
  597    HB   THR  79           HB       THR  79   2.705  -9.675  -7.479
  598    HG1  THR  79           1HG      THR  79   2.806 -11.056  -9.607
  599   1HG2  THR  79          1HG2      THR  79   4.623 -10.311  -9.032
  600   2HG2  THR  79          2HG2      THR  79   5.032 -10.697  -7.366
  601   3HG2  THR  79          3HG2      THR  79   4.507 -11.975  -8.453
  602    H    GLU  80           H        GLU  80   4.131 -12.998  -5.140
  603    HA   GLU  80           HA       GLU  80   4.501 -11.343  -2.905
  604   1HB   GLU  80          2HB       GLU  80   6.462 -12.687  -2.387
  605   2HB   GLU  80          3HB       GLU  80   5.053 -13.653  -2.815
  606   1HG   GLU  80          2HG       GLU  80   6.025 -13.954  -5.148
  607   2HG   GLU  80          3HG       GLU  80   7.484 -13.114  -4.585
  608    H    SER  81           H        SER  81   6.596 -11.507  -5.899
  609    HA   SER  81           HA       SER  81   8.433  -9.618  -5.263
  610   1HB   SER  81          2HB       SER  81   7.188  -9.593  -8.025
  611   2HB   SER  81          3HB       SER  81   8.874  -9.456  -7.533
  612    HG   SER  81           HG       SER  81   8.512 -11.538  -8.275
  613    H    GLU  82           H        GLU  82   5.273  -8.830  -6.869
  614    HA   GLU  82           HA       GLU  82   5.812  -6.068  -6.935
  615   1HB   GLU  82          2HB       GLU  82   3.081  -7.390  -7.038
  616   2HB   GLU  82          3HB       GLU  82   3.516  -5.812  -7.665
  617   1HG   GLU  82          2HG       GLU  82   5.312  -7.748  -8.880
  618   2HG   GLU  82          3HG       GLU  82   3.649  -8.345  -8.986
  619    H    THR  83           H        THR  83   4.044  -8.101  -4.551
  620    HA   THR  83           HA       THR  83   3.214  -5.895  -2.934
  621    HB   THR  83           HB       THR  83   2.871  -8.673  -2.863
  622    HG1  THR  83           1HG      THR  83   1.763  -7.874  -0.787
  623   1HG2  THR  83          1HG2      THR  83   4.806  -9.066  -1.357
  624   2HG2  THR  83          2HG2      THR  83   4.154  -7.862  -0.218
  625   3HG2  THR  83          3HG2      THR  83   3.268  -9.358  -0.556
  626    H    LYS  84           H        LYS  84   6.107  -7.920  -3.018
  627    HA   LYS  84           HA       LYS  84   7.369  -6.943  -0.704
  628   1HB   LYS  84          2HB       LYS  84   7.983  -9.044  -1.500
  629   2HB   LYS  84          3HB       LYS  84   8.351  -8.473  -3.122
  630   1HG   LYS  84          2HG       LYS  84   9.951  -7.602  -0.697
  631   2HG   LYS  84          3HG       LYS  84  10.287  -9.068  -1.628
  632   1HD   LYS  84          2HD       LYS  84  10.000  -7.094  -3.621
  633   2HD   LYS  84          3HD       LYS  84  10.860  -6.254  -2.325
  634   1HE   LYS  84          2HE       LYS  84  12.647  -7.893  -2.356
  635   2HE   LYS  84          3HE       LYS  84  11.739  -8.933  -3.473
  636   1HZ   LYS  84          1HZ       LYS  84  12.698  -6.225  -4.117
  637   2HZ   LYS  84          2HZ       LYS  84  13.381  -7.633  -4.629
  638   3HZ   LYS  84          3HZ       LYS  84  11.869  -7.223  -5.128
  639    H    SER  85           H        SER  85   7.392  -5.742  -4.083
  640    HA   SER  85           HA       SER  85   9.357  -3.784  -3.818
  641   1HB   SER  85          2HB       SER  85   6.686  -3.518  -5.256
  642   2HB   SER  85          3HB       SER  85   8.127  -2.525  -5.493
  643    HG   SER  85           HG       SER  85   8.120  -4.137  -7.011
  644    H    LEU  86           H        LEU  86   5.953  -3.684  -2.585
  645    HA   LEU  86           HA       LEU  86   6.309  -1.002  -1.484
  646   1HB   LEU  86          2HB       LEU  86   4.212  -3.149  -1.237
  647   2HB   LEU  86          3HB       LEU  86   4.335  -1.976   0.071
  648    HG   LEU  86           HG       LEU  86   4.234  -1.075  -2.794
  649   1HD1  LEU  86          1HD1      LEU  86   1.885  -1.709  -0.947
  650   2HD1  LEU  86          2HD1      LEU  86   1.749  -0.798  -2.465
  651   3HD1  LEU  86          3HD1      LEU  86   2.262  -2.500  -2.492
  652   1HD2  LEU  86          1HD2      LEU  86   3.324   0.989  -1.824
  653   2HD2  LEU  86          2HD2      LEU  86   3.302   0.258  -0.209
  654   3HD2  LEU  86          3HD2      LEU  86   4.846   0.606  -1.011
  655    H    MET  87           H        MET  87   6.237  -4.318  -0.086
  656    HA   MET  87           HA       MET  87   6.862  -3.757   2.464
  657   1HB   MET  87          2HB       MET  87   6.627  -6.078   1.389
  658   2HB   MET  87          3HB       MET  87   8.360  -5.960   1.028
  659   1HG   MET  87          2HG       MET  87   8.418  -5.373   3.686
  660   2HG   MET  87          3HG       MET  87   6.989  -6.401   3.637
  661   1HE   MET  87          1HE       MET  87   8.637  -9.736   2.253
  662   2HE   MET  87          2HE       MET  87   7.110  -8.924   2.650
  663   3HE   MET  87          3HE       MET  87   8.016  -8.450   1.193
  664    H    ALA  88           H        ALA  88   9.226  -3.976  -0.118
  665    HA   ALA  88           HA       ALA  88  11.652  -3.895   1.201
  666   1HB   ALA  88          1HB       ALA  88  10.740  -3.026  -1.574
  667   2HB   ALA  88          2HB       ALA  88  12.453  -2.989  -1.080
  668   3HB   ALA  88          3HB       ALA  88  11.545  -4.513  -1.082
  669    H    ALA  89           H        ALA  89   9.721  -1.086   0.045
  670    HA   ALA  89           HA       ALA  89  11.778   0.785   1.131
  671   1HB   ALA  89          1HB       ALA  89  10.282   2.535   0.248
  672   2HB   ALA  89          2HB       ALA  89  10.770   1.368  -0.993
  673   3HB   ALA  89          3HB       ALA  89   9.139   1.267  -0.248
  674    H    ALA  90           H        ALA  90   8.411  -0.300   1.710
  675    HA   ALA  90           HA       ALA  90   7.712   1.578   3.712
  676   1HB   ALA  90          1HB       ALA  90   6.086   0.089   2.641
  677   2HB   ALA  90          2HB       ALA  90   6.900  -1.327   3.348
  678   3HB   ALA  90          3HB       ALA  90   6.079  -0.157   4.407
  679    H    ASP  91           H        ASP  91   9.329  -1.633   3.979
  680    HA   ASP  91           HA       ASP  91   9.571  -1.381   6.825
  681   1HB   ASP  91          2HB       ASP  91   9.461  -3.606   5.692
  682   2HB   ASP  91          3HB       ASP  91  11.069  -3.307   5.024
  683    H    ASN  92           H        ASN  92  10.495   0.763   6.831
  684    HA   ASN  92           HA       ASN  92  13.226   1.177   5.863
  685   1HB   ASN  92          2HB       ASN  92  13.040   3.382   6.909
  686   2HB   ASN  92          3HB       ASN  92  11.688   3.000   5.837
  687   1HD2  ASN  92          1HD2      ASN  92  10.601   4.819   7.006
  688   2HD2  ASN  92          2HD2      ASN  92   9.813   4.439   8.526
  689    H    ASP  93           H        ASP  93  13.227  -1.089   7.381
  690    HA   ASP  93           HA       ASP  93  14.906  -0.425   9.773
  691   1HB   ASP  93          2HB       ASP  93  12.748  -2.554   9.436
  692   2HB   ASP  93          3HB       ASP  93  14.024  -2.674  10.644
  693    H    GLY  94           H        GLY  94  13.791  -3.079   7.621
  694   1HA   GLY  94          1HA       GLY  94  15.237  -4.475   6.295
  695   2HA   GLY  94          2HA       GLY  94  16.570  -4.180   7.422
  696    H    ASP  95           H        ASP  95  13.100  -4.918   7.963
  697    HA   ASP  95           HA       ASP  95  13.808  -7.544   9.151
  698   1HB   ASP  95          2HB       ASP  95  12.259  -7.330  10.939
  699   2HB   ASP  95          3HB       ASP  95  13.459  -6.039  11.034
  700    H    GLY  96           H        GLY  96  10.799  -5.701   8.267
  701   1HA   GLY  96          1HA       GLY  96   9.856  -6.457   6.014
  702   2HA   GLY  96          2HA       GLY  96   9.898  -8.091   6.687
  703    H    LYS  97           H        LYS  97   9.279  -6.870   9.440
  704    HA   LYS  97           HA       LYS  97   6.346  -6.887   9.276
  705   1HB   LYS  97          2HB       LYS  97   8.240  -6.625  11.655
  706   2HB   LYS  97          3HB       LYS  97   6.476  -6.762  11.693
  707   1HG   LYS  97          2HG       LYS  97   6.913  -8.975  10.292
  708   2HG   LYS  97          3HG       LYS  97   8.553  -8.829  10.952
  709   1HD   LYS  97          2HD       LYS  97   7.466  -8.701  13.287
  710   2HD   LYS  97          3HD       LYS  97   5.903  -8.937  12.492
  711   1HE   LYS  97          2HE       LYS  97   6.509 -11.080  13.304
  712   2HE   LYS  97          3HE       LYS  97   6.745 -11.127  11.552
  713   1HZ   LYS  97          1HZ       LYS  97   8.575 -12.129  12.698
  714   2HZ   LYS  97          2HZ       LYS  97   9.111 -10.764  11.956
  715   3HZ   LYS  97          3HZ       LYS  97   8.856 -10.773  13.584
  716    H    ILE  98           H        ILE  98   5.561  -5.018   8.523
  717    HA   ILE  98           HA       ILE  98   6.993  -2.463   8.931
  718    HB   ILE  98           HB       ILE  98   4.834  -3.508   7.112
  719   1HG1  ILE  98          2HG1      ILE  98   7.395  -2.084   6.385
  720   2HG1  ILE  98          3HG1      ILE  98   7.499  -3.763   6.912
  721   1HG2  ILE  98          1HG2      ILE  98   4.700  -1.337   6.034
  722   2HG2  ILE  98          2HG2      ILE  98   4.223  -1.159   7.723
  723   3HG2  ILE  98          3HG2      ILE  98   5.827  -0.626   7.192
  724   1HD1  ILE  98          1HD1      ILE  98   5.711  -2.859   4.629
  725   2HD1  ILE  98          2HD1      ILE  98   7.363  -3.512   4.505
  726   3HD1  ILE  98          3HD1      ILE  98   6.054  -4.525   5.158
  727    H    GLY  99           H        GLY  99   6.445  -1.372  10.820
  728   1HA   GLY  99          1HA       GLY  99   3.858  -1.643  12.081
  729   2HA   GLY  99          2HA       GLY  99   5.062  -0.391  12.392
  730    H    ALA 100           H        ALA 100   2.282   0.117  12.371
  731    HA   ALA 100           HA       ALA 100   1.305   1.394  10.040
  732   1HB   ALA 100          1HB       ALA 100   0.903   2.193  12.959
  733   2HB   ALA 100          2HB       ALA 100  -0.104   2.676  11.575
  734   3HB   ALA 100          3HB       ALA 100  -0.046   0.978  12.075
  735    H    GLU 101           H        GLU 101   3.468   2.424  12.656
  736    HA   GLU 101           HA       GLU 101   4.005   5.039  11.919
  737   1HB   GLU 101          2HB       GLU 101   6.129   4.736  13.151
  738   2HB   GLU 101          3HB       GLU 101   4.686   4.175  14.003
  739   1HG   GLU 101          2HG       GLU 101   5.364   1.831  12.881
  740   2HG   GLU 101          3HG       GLU 101   6.962   2.589  12.878
  741    H    GLU 102           H        GLU 102   5.857   2.106  10.930
  742    HA   GLU 102           HA       GLU 102   7.552   3.274   9.057
  743   1HB   GLU 102          2HB       GLU 102   6.278   0.511   9.011
  744   2HB   GLU 102          3HB       GLU 102   7.675   1.014   8.055
  745   1HG   GLU 102          2HG       GLU 102   8.935   1.462  10.144
  746   2HG   GLU 102          3HG       GLU 102   7.560   0.914  11.107
  747    H    PHE 103           H        PHE 103   4.251   1.957   8.503
  748    HA   PHE 103           HA       PHE 103   4.090   2.640   5.763
  749   1HB   PHE 103          2HB       PHE 103   2.185   1.818   7.825
  750   2HB   PHE 103          3HB       PHE 103   1.472   3.012   6.762
  751    HD1  PHE 103           1HD      PHE 103   1.706   2.676   4.190
  752    HD2  PHE 103           2HD      PHE 103   2.251  -0.452   7.094
  753    HE1  PHE 103           1HE      PHE 103   1.494   0.973   2.395
  754    HE2  PHE 103           2HE      PHE 103   2.223  -2.141   5.266
  755    HZ   PHE 103           HZ       PHE 103   1.763  -1.439   2.931
  756    H    GLN 104           H        GLN 104   2.838   4.654   8.507
  757    HA   GLN 104           HA       GLN 104   2.055   6.870   6.819
  758   1HB   GLN 104          2HB       GLN 104   1.351   6.380   9.256
  759   2HB   GLN 104          3HB       GLN 104   2.901   7.115   9.714
  760   1HG   GLN 104          2HG       GLN 104   2.154   9.106   8.168
  761   2HG   GLN 104          3HG       GLN 104   0.552   8.371   8.220
  762   1HE2  GLN 104          1HE2      GLN 104  -0.166   7.848  10.629
  763   2HE2  GLN 104          2HE2      GLN 104   0.180   9.152  11.767
  764    H    GLU 105           H        GLU 105   5.202   6.053   8.418
  765    HA   GLU 105           HA       GLU 105   6.505   8.502   7.805
  766   1HB   GLU 105          2HB       GLU 105   7.407   5.644   8.251
  767   2HB   GLU 105          3HB       GLU 105   8.561   6.802   7.601
  768   1HG   GLU 105          2HG       GLU 105   6.973   7.380  10.129
  769   2HG   GLU 105          3HG       GLU 105   8.532   6.542  10.139
  770    H    MET 106           H        MET 106   6.471   5.408   5.927
  771    HA   MET 106           HA       MET 106   7.915   6.462   3.733
  772   1HB   MET 106          2HB       MET 106   7.455   4.044   4.255
  773   2HB   MET 106          3HB       MET 106   5.810   4.237   3.632
  774   1HG   MET 106          2HG       MET 106   8.325   4.878   2.045
  775   2HG   MET 106          3HG       MET 106   7.587   3.284   2.035
  776   1HE   MET 106          1HE       MET 106   7.943   6.435   0.163
  777   2HE   MET 106          2HE       MET 106   8.318   4.835  -0.537
  778   3HE   MET 106          3HE       MET 106   7.044   5.849  -1.251
  779    H    VAL 107           H        VAL 107   4.418   6.150   4.281
  780    HA   VAL 107           HA       VAL 107   3.727   7.261   1.767
  781    HB   VAL 107           HB       VAL 107   2.083   6.658   4.236
  782   1HG1  VAL 107          1HG1      VAL 107   0.167   6.774   2.570
  783   2HG1  VAL 107          2HG1      VAL 107   0.898   8.343   2.950
  784   3HG1  VAL 107          3HG1      VAL 107   1.322   7.533   1.442
  785   1HG2  VAL 107          1HG2      VAL 107   1.347   4.723   2.896
  786   2HG2  VAL 107          2HG2      VAL 107   2.375   5.233   1.544
  787   3HG2  VAL 107          3HG2      VAL 107   3.109   4.676   3.058
  788    H    HIS 108           H        HIS 108   4.245   8.831   4.942
  789    HA   HIS 108           HA       HIS 108   3.079  11.315   3.835
  790   1HB   HIS 108          2HB       HIS 108   2.533  10.469   6.147
  791   2HB   HIS 108          3HB       HIS 108   4.158  10.975   6.622
  792    HD1  HIS 108           1HD      HIS 108   1.530  12.828   4.410
  793    HD2  HIS 108           2HD      HIS 108   3.809  13.227   7.929
  794    HE1  HIS 108           1HE      HIS 108   1.109  15.188   5.297
  795    H    SER 109           H        SER 109   5.798   9.884   3.130
  796    HA   SER 109           HA       SER 109   7.800  11.746   3.996
  797   1HB   SER 109          2HB       SER 109   8.080   9.264   3.348
  798   2HB   SER 109          3HB       SER 109   7.946   9.792   1.661
  799    HG   SER 109           HG       SER 109   9.830  10.754   3.568
  Start of MODEL   10
    1   1H    MET   1           H1       MET   1 -17.958   5.411   3.671
    2   2H    MET   1           H2       MET   1 -18.329   6.687   2.675
    3   3H    MET   1           H3       MET   1 -17.805   5.255   2.043
    4    HA   MET   1           HA       MET   1 -16.000   6.810   2.014
    5   1HB   MET   1          2HB       MET   1 -16.523   6.883   5.022
    6   2HB   MET   1          3HB       MET   1 -15.078   7.521   4.229
    7   1HG   MET   1          2HG       MET   1 -16.422   9.165   3.000
    8   2HG   MET   1          3HG       MET   1 -17.914   8.482   3.658
    9   1HE   MET   1          1HE       MET   1 -14.522   9.278   5.652
   10   2HE   MET   1          2HE       MET   1 -14.709  10.581   4.446
   11   3HE   MET   1          3HE       MET   1 -14.927  10.924   6.177
   12    H    SER   2           H        SER   2 -14.428   5.348   1.479
   13    HA   SER   2           HA       SER   2 -13.063   3.747   3.362
   14   1HB   SER   2          2HB       SER   2 -15.141   2.271   3.195
   15   2HB   SER   2          3HB       SER   2 -14.785   2.079   1.465
   16    HG   SER   2           HG       SER   2 -13.861   0.403   2.712
   17    H    ILE   3           H        ILE   3 -12.216   5.628   1.696
   18    HA   ILE   3           HA       ILE   3 -10.828   6.250   0.136
   19    HB   ILE   3           HB       ILE   3  -8.977   5.150  -0.207
   20   1HG1  ILE   3          2HG1      ILE   3  -8.875   2.542  -0.355
   21   2HG1  ILE   3          3HG1      ILE   3 -10.501   2.672  -1.001
   22   1HG2  ILE   3          1HG2      ILE   3  -9.645   4.861   2.198
   23   2HG2  ILE   3          2HG2      ILE   3 -10.031   3.169   1.829
   24   3HG2  ILE   3          3HG2      ILE   3  -8.393   3.762   1.605
   25   1HD1  ILE   3          1HD1      ILE   3  -7.954   3.999  -2.023
   26   2HD1  ILE   3          2HD1      ILE   3  -8.843   2.681  -2.790
   27   3HD1  ILE   3          3HD1      ILE   3  -9.558   4.304  -2.732
   28    H    THR   4           H        THR   4 -12.516   3.395  -1.090
   29    HA   THR   4           HA       THR   4 -12.694   3.430  -3.628
   30    HB   THR   4           HB       THR   4 -13.693   1.923  -1.873
   31    HG1  THR   4           1HG      THR   4 -14.133   2.106  -4.161
   32   1HG2  THR   4          1HG2      THR   4 -14.991   3.660  -0.579
   33   2HG2  THR   4          2HG2      THR   4 -16.107   3.794  -1.958
   34   3HG2  THR   4          3HG2      THR   4 -15.957   2.261  -1.088
   35    H    ASP   5           H        ASP   5 -14.260   5.928  -1.690
   36    HA   ASP   5           HA       ASP   5 -14.664   7.362  -4.151
   37   1HB   ASP   5          2HB       ASP   5 -16.869   6.224  -3.894
   38   2HB   ASP   5          3HB       ASP   5 -17.054   6.954  -2.285
   39    H    VAL   6           H        VAL   6 -12.733   7.768  -2.592
   40    HA   VAL   6           HA       VAL   6 -13.401  10.297  -1.074
   41    HB   VAL   6           HB       VAL   6 -11.060   8.381  -0.715
   42   1HG1  VAL   6          1HG1      VAL   6 -10.310  10.676  -0.310
   43   2HG1  VAL   6          2HG1      VAL   6 -11.724  10.983   0.722
   44   3HG1  VAL   6          3HG1      VAL   6 -10.479   9.821   1.225
   45   1HG2  VAL   6          1HG2      VAL   6 -13.176   7.517   0.259
   46   2HG2  VAL   6          2HG2      VAL   6 -12.058   8.022   1.536
   47   3HG2  VAL   6          3HG2      VAL   6 -13.425   9.063   1.094
   48    H    LEU   7           H        LEU   7 -10.784   8.766  -2.929
   49    HA   LEU   7           HA       LEU   7 -10.507  10.861  -4.868
   50   1HB   LEU   7          2HB       LEU   7  -9.469  12.218  -3.184
   51   2HB   LEU   7          3HB       LEU   7  -8.635  10.839  -2.465
   52    HG   LEU   7           HG       LEU   7  -7.126  10.677  -4.421
   53   1HD1  LEU   7          1HD1      LEU   7  -8.572  13.164  -5.435
   54   2HD1  LEU   7          2HD1      LEU   7  -7.080  12.467  -6.106
   55   3HD1  LEU   7          3HD1      LEU   7  -8.589  11.560  -6.205
   56   1HD2  LEU   7          1HD2      LEU   7  -5.861  12.724  -4.008
   57   2HD2  LEU   7          2HD2      LEU   7  -7.270  13.444  -3.190
   58   3HD2  LEU   7          3HD2      LEU   7  -6.473  12.003  -2.514
   59    H    SER   8           H        SER   8  -8.536   8.609  -2.887
   60    HA   SER   8           HA       SER   8  -6.787   7.778  -4.791
   61   1HB   SER   8          2HB       SER   8  -6.800   5.680  -3.115
   62   2HB   SER   8          3HB       SER   8  -6.060   7.243  -2.769
   63    HG   SER   8           HG       SER   8  -7.472   6.587  -1.073
   64    H    ALA   9           H        ALA   9 -10.117   6.793  -4.592
   65    HA   ALA   9           HA       ALA   9 -10.118   4.343  -5.946
   66   1HB   ALA   9          1HB       ALA   9 -12.047   5.577  -4.975
   67   2HB   ALA   9          2HB       ALA   9 -11.995   6.718  -6.333
   68   3HB   ALA   9          3HB       ALA   9 -12.373   5.004  -6.632
   69    H    ASP  10           H        ASP  10  -9.682   7.663  -7.303
   70    HA   ASP  10           HA       ASP  10  -9.722   6.701 -10.071
   71   1HB   ASP  10          2HB       ASP  10 -10.299   9.036  -9.403
   72   2HB   ASP  10          3HB       ASP  10  -8.613   9.291  -8.911
   73    H    ASP  11           H        ASP  11  -7.323   7.434  -7.554
   74    HA   ASP  11           HA       ASP  11  -5.030   7.331  -9.208
   75   1HB   ASP  11          2HB       ASP  11  -5.242   6.887  -6.201
   76   2HB   ASP  11          3HB       ASP  11  -3.810   7.300  -7.145
   77    H    ILE  12           H        ILE  12  -6.601   4.812  -7.118
   78    HA   ILE  12           HA       ILE  12  -4.732   2.798  -7.617
   79    HB   ILE  12           HB       ILE  12  -6.434   1.255  -7.019
   80   1HG1  ILE  12          2HG1      ILE  12  -8.331   3.542  -6.894
   81   2HG1  ILE  12          3HG1      ILE  12  -8.414   2.189  -8.028
   82   1HG2  ILE  12          1HG2      ILE  12  -6.692   1.969  -4.683
   83   2HG2  ILE  12          2HG2      ILE  12  -5.080   2.320  -5.308
   84   3HG2  ILE  12          3HG2      ILE  12  -6.260   3.624  -5.135
   85   1HD1  ILE  12          1HD1      ILE  12  -8.923   2.123  -5.060
   86   2HD1  ILE  12          2HD1      ILE  12 -10.034   1.748  -6.383
   87   3HD1  ILE  12          3HD1      ILE  12  -8.682   0.650  -6.047
   88    H    ALA  13           H        ALA  13  -7.560   3.881  -9.536
   89    HA   ALA  13           HA       ALA  13  -7.502   1.742 -11.423
   90   1HB   ALA  13          1HB       ALA  13  -9.380   3.349 -11.197
   91   2HB   ALA  13          2HB       ALA  13  -8.376   4.612 -11.933
   92   3HB   ALA  13          3HB       ALA  13  -8.801   3.173 -12.862
   93    H    ALA  14           H        ALA  14  -5.790   4.898 -11.298
   94    HA   ALA  14           HA       ALA  14  -4.303   4.531 -13.713
   95   1HB   ALA  14          1HB       ALA  14  -2.811   6.224 -12.886
   96   2HB   ALA  14          2HB       ALA  14  -4.467   6.678 -12.445
   97   3HB   ALA  14          3HB       ALA  14  -3.367   6.018 -11.224
   98    H    ALA  15           H        ALA  15  -3.379   3.808 -10.315
   99    HA   ALA  15           HA       ALA  15  -0.853   2.739 -10.709
  100   1HB   ALA  15          1HB       ALA  15  -1.115   1.678  -8.560
  101   2HB   ALA  15          2HB       ALA  15  -1.961   3.241  -8.487
  102   3HB   ALA  15          3HB       ALA  15  -2.882   1.740  -8.671
  103    H    LEU  16           H        LEU  16  -3.952   1.084 -10.793
  104    HA   LEU  16           HA       LEU  16  -3.113  -1.558 -11.101
  105   1HB   LEU  16          2HB       LEU  16  -5.544   0.010 -11.956
  106   2HB   LEU  16          3HB       LEU  16  -5.317  -1.559 -12.713
  107    HG   LEU  16           HG       LEU  16  -5.407  -1.195  -9.698
  108   1HD1  LEU  16          1HD1      LEU  16  -7.584  -1.990 -11.694
  109   2HD1  LEU  16          2HD1      LEU  16  -7.722  -2.096  -9.927
  110   3HD1  LEU  16          3HD1      LEU  16  -7.549  -0.515 -10.701
  111   1HD2  LEU  16          1HD2      LEU  16  -5.885  -3.652  -9.768
  112   2HD2  LEU  16          2HD2      LEU  16  -5.647  -3.646 -11.524
  113   3HD2  LEU  16          3HD2      LEU  16  -4.288  -3.306 -10.436
  114    H    GLN  17           H        GLN  17  -3.349   1.063 -13.515
  115    HA   GLN  17           HA       GLN  17  -2.796  -0.806 -15.744
  116   1HB   GLN  17          2HB       GLN  17  -3.921   1.902 -15.469
  117   2HB   GLN  17          3HB       GLN  17  -2.611   1.840 -16.646
  118   1HG   GLN  17          2HG       GLN  17  -4.517   1.415 -17.894
  119   2HG   GLN  17          3HG       GLN  17  -3.754  -0.161 -17.725
  120   1HE2  GLN  17          1HE2      GLN  17  -4.738  -0.793 -15.027
  121   2HE2  GLN  17          2HE2      GLN  17  -6.474  -0.981 -15.177
  122    H    GLU  18           H        GLU  18  -1.211   1.858 -13.966
  123    HA   GLU  18           HA       GLU  18   0.987   1.872 -15.774
  124   1HB   GLU  18          2HB       GLU  18   1.782   3.658 -14.622
  125   2HB   GLU  18          3HB       GLU  18   0.047   3.722 -14.328
  126   1HG   GLU  18          2HG       GLU  18   0.583   4.056 -12.203
  127   2HG   GLU  18          3HG       GLU  18   0.842   2.305 -12.119
  128    H    CYS  19           H        CYS  19   0.400   0.012 -12.841
  129    HA   CYS  19           HA       CYS  19   3.009  -1.445 -13.221
  130   1HB   CYS  19          2HB       CYS  19   1.312  -0.975 -10.778
  131   2HB   CYS  19          3HB       CYS  19   2.581  -2.219 -10.910
  132    HG   CYS  19           HG       CYS  19   2.931   1.067 -11.393
  133    H    ARG  20           H        ARG  20   1.067  -1.960 -15.140
  134    HA   ARG  20           HA       ARG  20  -0.707  -4.142 -14.302
  135   1HB   ARG  20          2HB       ARG  20  -0.210  -2.586 -16.770
  136   2HB   ARG  20          3HB       ARG  20  -0.216  -4.282 -17.136
  137   1HG   ARG  20          2HG       ARG  20  -2.446  -2.976 -15.557
  138   2HG   ARG  20          3HG       ARG  20  -2.458  -3.082 -17.310
  139   1HD   ARG  20          2HD       ARG  20  -2.258  -5.463 -15.415
  140   2HD   ARG  20          3HD       ARG  20  -3.766  -4.846 -16.127
  141    HE   ARG  20           HE       ARG  20  -1.936  -5.259 -18.237
  142   1HH1  ARG  20          2HH2      ARG  20  -3.723  -7.174 -15.892
  143   2HH1  ARG  20          1HH2      ARG  20  -3.851  -8.596 -16.882
  144   1HH2  ARG  20          2HH1      ARG  20  -2.104  -7.102 -19.615
  145   2HH2  ARG  20          1HH1      ARG  20  -2.912  -8.537 -19.078
  146    H    ASP  21           H        ASP  21   2.548  -3.769 -15.555
  147    HA   ASP  21           HA       ASP  21   2.801  -6.505 -16.441
  148   1HB   ASP  21          2HB       ASP  21   4.557  -4.024 -16.386
  149   2HB   ASP  21          3HB       ASP  21   5.186  -5.591 -16.859
  150    HA   PRO  22           HA       PRO  22   3.900  -8.170 -12.604
  151   1HB   PRO  22          2HB       PRO  22   5.684 -10.172 -13.173
  152   2HB   PRO  22          3HB       PRO  22   3.936 -10.252 -13.533
  153   1HG   PRO  22          2HG       PRO  22   6.169  -9.438 -15.409
  154   2HG   PRO  22          3HG       PRO  22   4.855 -10.612 -15.724
  155   1HD   PRO  22          2HD       PRO  22   4.679  -8.054 -16.604
  156   2HD   PRO  22          3HD       PRO  22   3.237  -8.849 -15.900
  157    H    ASP  23           H        ASP  23   5.419  -8.179 -10.987
  158    HA   ASP  23           HA       ASP  23   6.924  -7.159  -9.716
  159   1HB   ASP  23          2HB       ASP  23   8.632  -8.389 -11.914
  160   2HB   ASP  23          3HB       ASP  23   9.208  -7.952 -10.304
  161    H    THR  24           H        THR  24   5.775  -5.158 -11.149
  162    HA   THR  24           HA       THR  24   8.021  -3.334 -11.909
  163    HB   THR  24           HB       THR  24   5.099  -3.079 -12.778
  164    HG1  THR  24           1HG      THR  24   5.792  -4.888 -13.711
  165   1HG2  THR  24          1HG2      THR  24   7.661  -1.859 -13.911
  166   2HG2  THR  24          2HG2      THR  24   6.027  -1.651 -14.573
  167   3HG2  THR  24          3HG2      THR  24   6.423  -0.972 -12.988
  168    H    PHE  25           H        PHE  25   5.403  -3.818  -9.737
  169    HA   PHE  25           HA       PHE  25   4.813  -1.226  -9.037
  170   1HB   PHE  25          2HB       PHE  25   4.587  -3.918  -7.887
  171   2HB   PHE  25          3HB       PHE  25   4.818  -2.728  -6.665
  172    HD1  PHE  25           1HD      PHE  25   2.383  -4.279  -8.785
  173    HD2  PHE  25           2HD      PHE  25   3.339  -0.478  -7.020
  174    HE1  PHE  25           1HE      PHE  25   0.049  -3.549  -9.112
  175    HE2  PHE  25           2HE      PHE  25   1.044   0.304  -7.515
  176    HZ   PHE  25           HZ       PHE  25  -0.630  -1.243  -8.477
  177    H    GLU  26           H        GLU  26   6.164   0.408  -8.487
  178    HA   GLU  26           HA       GLU  26   8.493  -0.107  -6.712
  179   1HB   GLU  26          2HB       GLU  26   8.018   1.747  -8.972
  180   2HB   GLU  26          3HB       GLU  26   8.509   2.583  -7.502
  181   1HG   GLU  26          2HG       GLU  26  10.419   0.657  -7.511
  182   2HG   GLU  26          3HG       GLU  26  10.109   0.822  -9.242
  183    HA   PRO  27           HA       PRO  27   6.427   1.744  -3.354
  184   1HB   PRO  27          2HB       PRO  27   8.420   2.985  -1.916
  185   2HB   PRO  27          3HB       PRO  27   8.212   1.224  -2.110
  186   1HG   PRO  27          2HG       PRO  27  10.095   3.023  -3.680
  187   2HG   PRO  27          3HG       PRO  27  10.457   1.465  -2.917
  188   1HD   PRO  27          2HD       PRO  27   9.856   1.689  -5.542
  189   2HD   PRO  27          3HD       PRO  27   9.361   0.259  -4.588
  190    H    GLN  28           H        GLN  28   8.768   4.415  -3.881
  191    HA   GLN  28           HA       GLN  28   7.000   6.502  -3.354
  192   1HB   GLN  28          2HB       GLN  28   9.472   6.428  -5.116
  193   2HB   GLN  28          3HB       GLN  28   8.619   7.912  -4.649
  194   1HG   GLN  28          2HG       GLN  28   8.975   7.444  -2.272
  195   2HG   GLN  28          3HG       GLN  28   9.797   5.924  -2.649
  196   1HE2  GLN  28          1HE2      GLN  28  11.915   6.032  -3.784
  197   2HE2  GLN  28          2HE2      GLN  28  12.850   7.509  -3.621
  198    H    LYS  29           H        LYS  29   7.734   5.010  -6.467
  199    HA   LYS  29           HA       LYS  29   6.119   6.404  -8.221
  200   1HB   LYS  29          2HB       LYS  29   7.638   4.517  -8.774
  201   2HB   LYS  29          3HB       LYS  29   6.522   3.414  -7.955
  202   1HG   LYS  29          2HG       LYS  29   6.329   3.148 -10.284
  203   2HG   LYS  29          3HG       LYS  29   4.811   3.757  -9.671
  204   1HD   LYS  29          2HD       LYS  29   6.953   5.569 -10.923
  205   2HD   LYS  29          3HD       LYS  29   5.793   4.633 -11.876
  206   1HE   LYS  29          2HE       LYS  29   4.044   5.820 -10.178
  207   2HE   LYS  29          3HE       LYS  29   5.286   7.086 -10.214
  208   1HZ   LYS  29          1HZ       LYS  29   5.034   7.046 -12.644
  209   2HZ   LYS  29          2HZ       LYS  29   3.926   5.838 -12.498
  210   3HZ   LYS  29          3HZ       LYS  29   3.566   7.312 -11.909
  211    H    PHE  30           H        PHE  30   5.053   3.470  -6.308
  212    HA   PHE  30           HA       PHE  30   2.351   3.814  -7.046
  213   1HB   PHE  30          2HB       PHE  30   3.336   1.699  -6.238
  214   2HB   PHE  30          3HB       PHE  30   3.505   2.392  -4.628
  215    HD1  PHE  30           1HD      PHE  30   0.413   2.921  -6.695
  216    HD2  PHE  30           2HD      PHE  30   2.263   0.441  -3.713
  217    HE1  PHE  30           1HE      PHE  30  -1.779   1.958  -6.139
  218    HE2  PHE  30           2HE      PHE  30   0.072  -0.594  -3.231
  219    HZ   PHE  30           HZ       PHE  30  -1.964   0.198  -4.409
  220    H    PHE  31           H        PHE  31   4.180   4.986  -4.174
  221    HA   PHE  31           HA       PHE  31   1.988   5.935  -2.683
  222   1HB   PHE  31          2HB       PHE  31   4.683   7.301  -2.851
  223   2HB   PHE  31          3HB       PHE  31   3.528   7.353  -1.524
  224    HD1  PHE  31           1HD      PHE  31   6.403   6.799  -1.135
  225    HD2  PHE  31           2HD      PHE  31   3.041   4.146  -1.674
  226    HE1  PHE  31           1HE      PHE  31   7.688   4.963  -0.126
  227    HE2  PHE  31           2HE      PHE  31   4.253   2.395  -0.429
  228    HZ   PHE  31           HZ       PHE  31   6.613   2.744   0.255
  229    H    GLN  32           H        GLN  32   3.718   7.489  -5.428
  230    HA   GLN  32           HA       GLN  32   2.028   9.891  -5.236
  231   1HB   GLN  32          2HB       GLN  32   4.339   9.968  -6.101
  232   2HB   GLN  32          3HB       GLN  32   3.819   9.023  -7.513
  233   1HG   GLN  32          2HG       GLN  32   2.239  10.800  -8.155
  234   2HG   GLN  32          3HG       GLN  32   2.501  11.641  -6.621
  235   1HE2  GLN  32          1HE2      GLN  32   4.887  10.257  -8.963
  236   2HE2  GLN  32          2HE2      GLN  32   5.699  11.796  -9.214
  237    H    THR  33           H        THR  33   2.190   7.039  -7.440
  238    HA   THR  33           HA       THR  33   0.055   7.990  -9.005
  239    HB   THR  33           HB       THR  33   2.032   5.953  -9.137
  240    HG1  THR  33           1HG      THR  33  -0.064   6.673 -10.802
  241   1HG2  THR  33          1HG2      THR  33  -0.648   4.735  -9.733
  242   2HG2  THR  33          2HG2      THR  33   0.967   3.988  -9.855
  243   3HG2  THR  33          3HG2      THR  33   0.287   4.356  -8.268
  244    H    SER  34           H        SER  34   0.003   6.381  -5.977
  245    HA   SER  34           HA       SER  34  -2.787   5.520  -6.241
  246   1HB   SER  34          2HB       SER  34  -0.888   4.236  -5.108
  247   2HB   SER  34          3HB       SER  34  -1.065   5.348  -3.757
  248    HG   SER  34           HG       SER  34  -2.302   3.355  -3.638
  249    H    GLY  35           H        GLY  35  -1.187   8.442  -5.568
  250   1HA   GLY  35          1HA       GLY  35  -2.060  10.432  -4.836
  251   2HA   GLY  35          2HA       GLY  35  -3.566   9.628  -4.379
  252    H    LEU  36           H        LEU  36  -1.948   7.652  -2.753
  253    HA   LEU  36           HA       LEU  36  -2.201   8.430  -0.238
  254   1HB   LEU  36          2HB       LEU  36  -0.385   6.547  -1.682
  255   2HB   LEU  36          3HB       LEU  36   0.099   6.907  -0.044
  256    HG   LEU  36           HG       LEU  36  -1.280   4.896  -0.231
  257   1HD1  LEU  36          1HD1      LEU  36  -1.124   6.374   1.838
  258   2HD1  LEU  36          2HD1      LEU  36  -2.749   6.968   1.433
  259   3HD1  LEU  36          3HD1      LEU  36  -2.478   5.244   1.760
  260   1HD2  LEU  36          1HD2      LEU  36  -2.862   5.553  -1.989
  261   2HD2  LEU  36          2HD2      LEU  36  -3.713   5.031  -0.529
  262   3HD2  LEU  36          3HD2      LEU  36  -3.609   6.754  -0.918
  263    H    SER  37           H        SER  37   0.808   9.212  -2.064
  264    HA   SER  37           HA       SER  37   2.060  10.466   0.234
  265   1HB   SER  37          2HB       SER  37   3.626  11.417  -1.465
  266   2HB   SER  37          3HB       SER  37   3.465   9.666  -1.582
  267    HG   SER  37           HG       SER  37   1.993   9.943  -3.278
  268    H    LYS  38           H        LYS  38  -0.384  11.544  -1.992
  269    HA   LYS  38           HA       LYS  38   0.234  14.382  -1.600
  270   1HB   LYS  38          2HB       LYS  38  -0.930  13.147  -3.717
  271   2HB   LYS  38          3HB       LYS  38  -2.378  13.434  -2.761
  272   1HG   LYS  38          2HG       LYS  38  -1.310  15.882  -2.502
  273   2HG   LYS  38          3HG       LYS  38  -0.443  15.409  -3.976
  274   1HD   LYS  38          2HD       LYS  38  -2.694  14.890  -5.029
  275   2HD   LYS  38          3HD       LYS  38  -3.463  15.460  -3.529
  276   1HE   LYS  38          2HE       LYS  38  -2.185  17.679  -3.871
  277   2HE   LYS  38          3HE       LYS  38  -1.758  17.084  -5.484
  278   1HZ   LYS  38          1HZ       LYS  38  -4.487  17.530  -4.455
  279   2HZ   LYS  38          2HZ       LYS  38  -3.691  18.475  -5.537
  280   3HZ   LYS  38          3HZ       LYS  38  -4.132  16.945  -5.954
  281    H    MET  39           H        MET  39  -1.924  11.749  -0.596
  282    HA   MET  39           HA       MET  39  -3.662  13.361   0.976
  283   1HB   MET  39          2HB       MET  39  -2.938  10.416   0.996
  284   2HB   MET  39          3HB       MET  39  -4.097  11.083   2.115
  285   1HG   MET  39          2HG       MET  39  -4.407  11.342  -0.906
  286   2HG   MET  39          3HG       MET  39  -4.976   9.970   0.032
  287   1HE   MET  39          1HE       MET  39  -5.525  13.637  -0.926
  288   2HE   MET  39          2HE       MET  39  -7.100  14.012  -0.196
  289   3HE   MET  39          3HE       MET  39  -5.652  14.062   0.806
  290    H    SER  40           H        SER  40  -3.601  13.885   3.189
  291    HA   SER  40           HA       SER  40  -0.903  14.173   4.246
  292   1HB   SER  40          2HB       SER  40  -2.131  15.319   6.114
  293   2HB   SER  40          3HB       SER  40  -2.465  15.989   4.511
  294    HG   SER  40           HG       SER  40  -4.489  15.453   4.774
  295    H    ALA  41           H        ALA  41  -0.326  13.460   6.410
  296    HA   ALA  41           HA       ALA  41  -0.446  10.791   6.957
  297   1HB   ALA  41          1HB       ALA  41  -0.321  13.037   9.011
  298   2HB   ALA  41          2HB       ALA  41   0.214  11.361   9.253
  299   3HB   ALA  41          3HB       ALA  41   1.056  12.397   8.087
  300    H    ASN  42           H        ASN  42  -2.884  13.190   7.878
  301    HA   ASN  42           HA       ASN  42  -4.513  11.663   9.623
  302   1HB   ASN  42          2HB       ASN  42  -4.819  14.060   7.895
  303   2HB   ASN  42          3HB       ASN  42  -6.285  13.095   7.963
  304   1HD2  ASN  42          1HD2      ASN  42  -3.805  14.531  10.174
  305   2HD2  ASN  42          2HD2      ASN  42  -4.976  14.855  11.438
  306    H    GLN  43           H        GLN  43  -4.677  11.912   6.027
  307    HA   GLN  43           HA       GLN  43  -6.791   9.904   5.952
  308   1HB   GLN  43          2HB       GLN  43  -5.444  11.693   3.986
  309   2HB   GLN  43          3HB       GLN  43  -5.906  10.115   3.349
  310   1HG   GLN  43          2HG       GLN  43  -7.784  12.023   4.802
  311   2HG   GLN  43          3HG       GLN  43  -7.691  11.829   3.049
  312   1HE2  GLN  43          1HE2      GLN  43  -7.586   9.056   2.677
  313   2HE2  GLN  43          2HE2      GLN  43  -9.021   8.335   3.386
  314    H    VAL  44           H        VAL  44  -3.203   9.950   5.308
  315    HA   VAL  44           HA       VAL  44  -3.193   7.286   4.336
  316    HB   VAL  44           HB       VAL  44  -1.022   8.799   5.843
  317   1HG1  VAL  44          1HG1      VAL  44   0.458   7.194   4.460
  318   2HG1  VAL  44          2HG1      VAL  44  -0.407   6.492   5.828
  319   3HG1  VAL  44          3HG1      VAL  44  -1.016   6.270   4.162
  320   1HG2  VAL  44          1HG2      VAL  44  -0.167   9.236   3.497
  321   2HG2  VAL  44          2HG2      VAL  44  -1.691   8.588   2.871
  322   3HG2  VAL  44          3HG2      VAL  44  -1.673  10.057   3.855
  323    H    LYS  45           H        LYS  45  -3.121   8.569   7.706
  324    HA   LYS  45           HA       LYS  45  -2.780   6.040   8.968
  325   1HB   LYS  45          2HB       LYS  45  -2.476   8.234  10.075
  326   2HB   LYS  45          3HB       LYS  45  -4.234   8.474  10.050
  327   1HG   LYS  45          2HG       LYS  45  -4.484   6.359  11.394
  328   2HG   LYS  45          3HG       LYS  45  -2.713   6.201  11.395
  329   1HD   LYS  45          2HD       LYS  45  -2.597   8.484  12.531
  330   2HD   LYS  45          3HD       LYS  45  -4.361   8.506  12.546
  331   1HE   LYS  45          2HE       LYS  45  -3.640   7.821  14.731
  332   2HE   LYS  45          3HE       LYS  45  -4.373   6.421  13.943
  333   1HZ   LYS  45          1HZ       LYS  45  -2.140   5.623  13.460
  334   2HZ   LYS  45          2HZ       LYS  45  -1.468   6.940  14.177
  335   3HZ   LYS  45          3HZ       LYS  45  -2.325   5.866  15.072
  336    H    ASP  46           H        ASP  46  -5.748   7.934   8.096
  337    HA   ASP  46           HA       ASP  46  -7.628   6.114   9.124
  338   1HB   ASP  46          2HB       ASP  46  -8.179   8.391   8.319
  339   2HB   ASP  46          3HB       ASP  46  -7.944   7.858   6.645
  340    H    VAL  47           H        VAL  47  -6.480   6.322   5.707
  341    HA   VAL  47           HA       VAL  47  -7.751   3.921   4.910
  342    HB   VAL  47           HB       VAL  47  -6.449   3.921   2.942
  343   1HG1  VAL  47          1HG1      VAL  47  -8.095   5.899   3.437
  344   2HG1  VAL  47          2HG1      VAL  47  -6.624   6.877   3.476
  345   3HG1  VAL  47          3HG1      VAL  47  -7.025   5.973   2.018
  346   1HG2  VAL  47          1HG2      VAL  47  -4.493   5.671   4.291
  347   2HG2  VAL  47          2HG2      VAL  47  -4.213   4.071   3.575
  348   3HG2  VAL  47          3HG2      VAL  47  -4.579   5.459   2.530
  349    H    PHE  48           H        PHE  48  -4.416   4.451   6.182
  350    HA   PHE  48           HA       PHE  48  -3.403   1.877   6.066
  351   1HB   PHE  48          2HB       PHE  48  -1.988   3.588   6.848
  352   2HB   PHE  48          3HB       PHE  48  -3.061   3.984   8.182
  353    HD1  PHE  48           1HD      PHE  48  -3.287   2.538  10.169
  354    HD2  PHE  48           2HD      PHE  48  -0.470   1.644   7.023
  355    HE1  PHE  48           1HE      PHE  48  -2.340   0.684  11.523
  356    HE2  PHE  48           2HE      PHE  48   0.653   0.014   8.506
  357    HZ   PHE  48           HZ       PHE  48  -0.340  -0.519  10.745
  358    H    ARG  49           H        ARG  49  -5.619   3.164   8.654
  359    HA   ARG  49           HA       ARG  49  -5.682   0.734  10.138
  360   1HB   ARG  49          2HB       ARG  49  -7.880   2.806   9.734
  361   2HB   ARG  49          3HB       ARG  49  -7.983   1.419  10.818
  362   1HG   ARG  49          2HG       ARG  49  -5.888   2.245  11.996
  363   2HG   ARG  49          3HG       ARG  49  -5.975   3.702  10.992
  364   1HD   ARG  49          2HD       ARG  49  -7.056   4.156  13.128
  365   2HD   ARG  49          3HD       ARG  49  -8.265   4.135  11.821
  366    HE   ARG  49           HE       ARG  49  -7.894   1.550  13.118
  367   1HH1  ARG  49          2HH2      ARG  49  -9.604   4.618  13.397
  368   2HH1  ARG  49          1HH2      ARG  49 -10.935   3.987  14.314
  369   1HH2  ARG  49          2HH1      ARG  49  -9.652   0.658  14.317
  370   2HH2  ARG  49          1HH1      ARG  49 -10.947   1.669  14.861
  371    H    PHE  50           H        PHE  50  -7.473   1.653   7.167
  372    HA   PHE  50           HA       PHE  50  -9.177  -0.673   7.230
  373   1HB   PHE  50          2HB       PHE  50  -9.145   1.667   5.776
  374   2HB   PHE  50          3HB       PHE  50  -8.532   0.533   4.588
  375    HD1  PHE  50           1HD      PHE  50  -9.940  -1.665   4.230
  376    HD2  PHE  50           2HD      PHE  50 -11.448   1.814   6.289
  377    HE1  PHE  50           1HE      PHE  50 -12.250  -2.525   3.998
  378    HE2  PHE  50           2HE      PHE  50 -13.749   0.932   6.085
  379    HZ   PHE  50           HZ       PHE  50 -14.156  -1.255   4.972
  380    H    ILE  51           H        ILE  51  -5.960   0.086   5.823
  381    HA   ILE  51           HA       ILE  51  -5.728  -2.485   4.511
  382    HB   ILE  51           HB       ILE  51  -3.555  -0.497   5.209
  383   1HG1  ILE  51          2HG1      ILE  51  -3.436  -0.345   2.680
  384   2HG1  ILE  51          3HG1      ILE  51  -4.946  -1.256   2.570
  385   1HG2  ILE  51          1HG2      ILE  51  -2.142  -1.852   3.673
  386   2HG2  ILE  51          2HG2      ILE  51  -2.623  -2.787   5.067
  387   3HG2  ILE  51          3HG2      ILE  51  -3.451  -3.047   3.535
  388   1HD1  ILE  51          1HD1      ILE  51  -5.072   1.264   2.324
  389   2HD1  ILE  51          2HD1      ILE  51  -6.132   0.610   3.578
  390   3HD1  ILE  51          3HD1      ILE  51  -4.567   1.394   4.001
  391    H    ASP  52           H        ASP  52  -4.787  -1.346   7.779
  392    HA   ASP  52           HA       ASP  52  -3.554  -3.867   8.525
  393   1HB   ASP  52          2HB       ASP  52  -2.954  -1.590   9.479
  394   2HB   ASP  52          3HB       ASP  52  -4.486  -1.608  10.331
  395    H    ASN  53           H        ASN  53  -5.630  -4.881   7.603
  396    HA   ASN  53           HA       ASN  53  -8.013  -5.225   9.126
  397   1HB   ASN  53          2HB       ASN  53  -6.425  -6.973   7.256
  398   2HB   ASN  53          3HB       ASN  53  -7.454  -7.809   8.411
  399   1HD2  ASN  53          1HD2      ASN  53  -9.067  -8.604   7.069
  400   2HD2  ASN  53          2HD2      ASN  53 -10.120  -7.537   6.158
  401    H    ASP  54           H        ASP  54  -8.480  -6.435  10.926
  402    HA   ASP  54           HA       ASP  54  -8.223  -7.466  12.888
  403   1HB   ASP  54          2HB       ASP  54  -6.862  -9.184  13.066
  404   2HB   ASP  54          3HB       ASP  54  -6.198  -8.794  11.488
  405    H    GLN  55           H        GLN  55  -5.813  -5.066  11.903
  406    HA   GLN  55           HA       GLN  55  -4.749  -3.456  12.971
  407   1HB   GLN  55          2HB       GLN  55  -7.060  -3.405  14.906
  408   2HB   GLN  55          3HB       GLN  55  -5.866  -2.149  14.585
  409   1HG   GLN  55          2HG       GLN  55  -7.719  -1.418  13.406
  410   2HG   GLN  55          3HG       GLN  55  -6.649  -2.066  12.177
  411   1HE2  GLN  55          1HE2      GLN  55  -9.015  -3.661  14.443
  412   2HE2  GLN  55          2HE2      GLN  55 -10.032  -4.288  13.158
  413    H    SER  56           H        SER  56  -3.966  -6.110  13.615
  414    HA   SER  56           HA       SER  56  -3.256  -6.752  16.112
  415   1HB   SER  56          2HB       SER  56  -1.042  -7.571  15.158
  416   2HB   SER  56          3HB       SER  56  -2.481  -8.183  14.378
  417    HG   SER  56           HG       SER  56  -0.673  -7.402  12.972
  418    H    GLY  57           H        GLY  57  -2.001  -3.984  14.368
  419   1HA   GLY  57          1HA       GLY  57  -0.802  -2.205  15.606
  420   2HA   GLY  57          2HA       GLY  57   0.087  -3.477  16.462
  421    H    TYR  58           H        TYR  58  -0.161  -5.064  13.693
  422    HA   TYR  58           HA       TYR  58   1.912  -3.572  12.210
  423   1HB   TYR  58          2HB       TYR  58   2.150  -6.443  13.165
  424   2HB   TYR  58          3HB       TYR  58   3.187  -5.702  11.954
  425    HD1  TYR  58           HD1      TYR  58   4.568  -3.631  12.574
  426    HD2  TYR  58           HD2      TYR  58   2.634  -6.129  15.510
  427    HE1  TYR  58           HE1      TYR  58   5.986  -2.646  14.341
  428    HE2  TYR  58           HE2      TYR  58   4.062  -5.139  17.281
  429    HH   TYR  58           HH       TYR  58   6.427  -2.550  16.608
  430    H    LEU  59           H        LEU  59   2.279  -4.218  10.166
  431    HA   LEU  59           HA       LEU  59   0.128  -5.725   8.746
  432   1HB   LEU  59          2HB       LEU  59   2.237  -3.710   7.868
  433   2HB   LEU  59          3HB       LEU  59   1.453  -4.815   6.728
  434    HG   LEU  59           HG       LEU  59   0.463  -2.523   6.832
  435   1HD1  LEU  59          1HD1      LEU  59  -1.903  -3.370   6.931
  436   2HD1  LEU  59          2HD1      LEU  59  -0.831  -4.261   5.814
  437   3HD1  LEU  59          3HD1      LEU  59  -1.303  -4.955   7.373
  438   1HD2  LEU  59          1HD2      LEU  59   0.565  -2.278   9.339
  439   2HD2  LEU  59          2HD2      LEU  59  -1.004  -1.918   8.580
  440   3HD2  LEU  59          3HD2      LEU  59  -0.790  -3.435   9.446
  441    H    ASP  60           H        ASP  60   1.015  -7.445  10.047
  442    HA   ASP  60           HA       ASP  60   3.485  -8.667   9.625
  443   1HB   ASP  60          2HB       ASP  60   0.795 -10.057   9.927
  444   2HB   ASP  60          3HB       ASP  60   2.392 -10.606  10.481
  445    H    GLU  61           H        GLU  61   4.193 -10.241   8.033
  446    HA   GLU  61           HA       GLU  61   4.012  -9.236   5.623
  447   1HB   GLU  61          2HB       GLU  61   5.565 -11.157   6.712
  448   2HB   GLU  61          3HB       GLU  61   4.571 -12.205   5.701
  449   1HG   GLU  61          2HG       GLU  61   5.251 -10.043   4.030
  450   2HG   GLU  61          3HG       GLU  61   6.709 -10.310   5.000
  451    H    GLU  62           H        GLU  62   2.248 -12.292   6.381
  452    HA   GLU  62           HA       GLU  62   0.973 -12.622   3.904
  453   1HB   GLU  62          2HB       GLU  62   0.047 -13.346   6.719
  454   2HB   GLU  62          3HB       GLU  62  -0.761 -13.870   5.239
  455   1HG   GLU  62          2HG       GLU  62   1.325 -14.978   4.470
  456   2HG   GLU  62          3HG       GLU  62   2.145 -14.488   5.961
  457    H    GLU  63           H        GLU  63   0.225 -10.340   6.489
  458    HA   GLU  63           HA       GLU  63  -2.448  -9.706   5.544
  459   1HB   GLU  63          2HB       GLU  63  -1.260  -9.424   7.926
  460   2HB   GLU  63          3HB       GLU  63  -0.774  -7.862   7.250
  461   1HG   GLU  63          2HG       GLU  63  -3.191  -7.376   6.780
  462   2HG   GLU  63          3HG       GLU  63  -3.614  -8.938   7.535
  463    H    LEU  64           H        LEU  64   0.852  -8.395   5.287
  464    HA   LEU  64           HA       LEU  64   0.396  -6.105   3.716
  465   1HB   LEU  64          2HB       LEU  64   2.613  -7.248   4.754
  466   2HB   LEU  64          3HB       LEU  64   2.770  -7.854   3.109
  467    HG   LEU  64           HG       LEU  64   4.087  -5.951   3.243
  468   1HD1  LEU  64          1HD1      LEU  64   2.677  -5.960   1.177
  469   2HD1  LEU  64          2HD1      LEU  64   1.572  -4.814   1.984
  470   3HD1  LEU  64          3HD1      LEU  64   3.249  -4.357   1.664
  471   1HD2  LEU  64          1HD2      LEU  64   1.786  -4.411   4.490
  472   2HD2  LEU  64          2HD2      LEU  64   3.257  -4.999   5.313
  473   3HD2  LEU  64          3HD2      LEU  64   3.370  -3.749   4.062
  474    H    LYS  65           H        LYS  65   0.577  -9.539   2.770
  475    HA   LYS  65           HA       LYS  65   0.351  -9.360  -0.050
  476   1HB   LYS  65          2HB       LYS  65   0.259 -11.381   1.714
  477   2HB   LYS  65          3HB       LYS  65  -1.464 -11.306   1.280
  478   1HG   LYS  65          2HG       LYS  65  -0.740 -11.350  -1.154
  479   2HG   LYS  65          3HG       LYS  65   0.925 -11.571  -0.605
  480   1HD   LYS  65          2HD       LYS  65  -1.426 -13.472  -0.334
  481   2HD   LYS  65          3HD       LYS  65   0.122 -13.715  -1.172
  482   1HE   LYS  65          2HE       LYS  65   1.234 -13.484   1.175
  483   2HE   LYS  65          3HE       LYS  65  -0.407 -13.626   1.841
  484   1HZ   LYS  65          1HZ       LYS  65   0.659 -15.714   1.824
  485   2HZ   LYS  65          2HZ       LYS  65  -0.554 -15.771   0.716
  486   3HZ   LYS  65          3HZ       LYS  65   1.017 -15.625   0.224
  487    H    PHE  66           H        PHE  66  -2.410  -9.274   2.260
  488    HA   PHE  66           HA       PHE  66  -4.264  -8.385   0.154
  489   1HB   PHE  66          2HB       PHE  66  -4.419  -9.145   3.072
  490   2HB   PHE  66          3HB       PHE  66  -5.602  -7.983   2.534
  491    HD1  PHE  66           1HD      PHE  66  -7.577  -8.476   1.478
  492    HD2  PHE  66           2HD      PHE  66  -4.411 -11.402   1.668
  493    HE1  PHE  66           1HE      PHE  66  -9.126 -10.201   0.647
  494    HE2  PHE  66           2HE      PHE  66  -5.979 -13.129   0.823
  495    HZ   PHE  66           HZ       PHE  66  -8.333 -12.531   0.307
  496    H    PHE  67           H        PHE  67  -2.382  -6.567  -0.124
  497    HA   PHE  67           HA       PHE  67  -2.967  -4.200   1.570
  498   1HB   PHE  67          2HB       PHE  67  -0.713  -4.551   1.089
  499   2HB   PHE  67          3HB       PHE  67  -0.987  -4.795  -0.626
  500    HD1  PHE  67           1HD      PHE  67   0.940  -3.267  -0.916
  501    HD2  PHE  67           2HD      PHE  67  -2.647  -1.907   1.068
  502    HE1  PHE  67           1HE      PHE  67   1.715  -0.927  -1.086
  503    HE2  PHE  67           2HE      PHE  67  -1.883   0.426   0.838
  504    HZ   PHE  67           HZ       PHE  67   0.281   0.931  -0.287
  505    H    LEU  68           H        LEU  68  -2.876  -4.766  -1.979
  506    HA   LEU  68           HA       LEU  68  -4.502  -2.465  -2.495
  507   1HB   LEU  68          2HB       LEU  68  -3.767  -4.803  -4.300
  508   2HB   LEU  68          3HB       LEU  68  -4.558  -3.289  -4.786
  509    HG   LEU  68           HG       LEU  68  -2.481  -2.077  -3.856
  510   1HD1  LEU  68          1HD1      LEU  68  -1.271  -3.843  -2.709
  511   2HD1  LEU  68          2HD1      LEU  68  -1.362  -4.910  -4.130
  512   3HD1  LEU  68          3HD1      LEU  68  -0.362  -3.446  -4.156
  513   1HD2  LEU  68          1HD2      LEU  68  -1.325  -2.359  -6.011
  514   2HD2  LEU  68          2HD2      LEU  68  -2.257  -3.835  -6.337
  515   3HD2  LEU  68          3HD2      LEU  68  -3.074  -2.257  -6.254
  516    H    GLN  69           H        GLN  69  -5.267  -5.818  -1.866
  517    HA   GLN  69           HA       GLN  69  -7.856  -5.837  -3.105
  518   1HB   GLN  69          2HB       GLN  69  -6.126  -7.753  -2.271
  519   2HB   GLN  69          3HB       GLN  69  -7.194  -7.732  -0.880
  520   1HG   GLN  69          2HG       GLN  69  -8.065  -9.385  -2.334
  521   2HG   GLN  69          3HG       GLN  69  -9.142  -7.999  -2.548
  522   1HE2  GLN  69          1HE2      GLN  69  -7.018 -10.233  -4.142
  523   2HE2  GLN  69          2HE2      GLN  69  -6.962  -9.442  -5.701
  524    H    LYS  70           H        LYS  70  -6.966  -4.062  -0.412
  525    HA   LYS  70           HA       LYS  70  -9.593  -4.259   0.917
  526   1HB   LYS  70          2HB       LYS  70  -7.229  -2.352   1.065
  527   2HB   LYS  70          3HB       LYS  70  -8.829  -1.857   1.624
  528   1HG   LYS  70          2HG       LYS  70  -7.790  -2.661   3.520
  529   2HG   LYS  70          3HG       LYS  70  -8.965  -3.894   3.073
  530   1HD   LYS  70          2HD       LYS  70  -7.005  -5.171   1.978
  531   2HD   LYS  70          3HD       LYS  70  -5.938  -3.954   2.694
  532   1HE   LYS  70          2HE       LYS  70  -7.252  -4.578   4.937
  533   2HE   LYS  70          3HE       LYS  70  -7.732  -6.024   4.036
  534   1HZ   LYS  70          1HZ       LYS  70  -5.173  -6.172   3.685
  535   2HZ   LYS  70          2HZ       LYS  70  -5.104  -5.169   4.975
  536   3HZ   LYS  70          3HZ       LYS  70  -5.809  -6.635   5.142
  537    H    PHE  71           H        PHE  71  -8.122  -2.657  -1.879
  538    HA   PHE  71           HA       PHE  71 -10.361  -0.752  -2.100
  539   1HB   PHE  71          2HB       PHE  71  -8.098  -1.002  -4.072
  540   2HB   PHE  71          3HB       PHE  71  -9.038   0.398  -3.590
  541    HD1  PHE  71           1HD      PHE  71  -5.887  -0.250  -3.793
  542    HD2  PHE  71           2HD      PHE  71  -8.700   0.171  -0.549
  543    HE1  PHE  71           1HE      PHE  71  -4.055   0.476  -2.293
  544    HE2  PHE  71           2HE      PHE  71  -6.874   0.869   0.946
  545    HZ   PHE  71           HZ       PHE  71  -4.531   1.036   0.073
  546    H    GLU  72           H        GLU  72  -8.689  -3.194  -4.107
  547    HA   GLU  72           HA       GLU  72 -11.056  -3.332  -5.922
  548   1HB   GLU  72          2HB       GLU  72  -8.333  -3.097  -6.485
  549   2HB   GLU  72          3HB       GLU  72  -8.602  -4.846  -6.594
  550   1HG   GLU  72          2HG       GLU  72  -8.880  -3.853  -8.773
  551   2HG   GLU  72          3HG       GLU  72 -10.478  -4.379  -8.228
  552    H    SER  73           H        SER  73 -11.383  -5.639  -6.803
  553    HA   SER  73           HA       SER  73 -11.118  -7.671  -4.634
  554   1HB   SER  73          2HB       SER  73 -12.973  -8.786  -5.992
  555   2HB   SER  73          3HB       SER  73 -13.407  -7.233  -5.253
  556    HG   SER  73           HG       SER  73 -12.702  -7.693  -7.968
  557    H    GLY  74           H        GLY  74  -9.679  -6.765  -7.586
  558   1HA   GLY  74          1HA       GLY  74  -8.497  -9.490  -7.901
  559   2HA   GLY  74          2HA       GLY  74  -9.204  -8.671  -9.302
  560    H    ALA  75           H        ALA  75  -7.408  -7.248  -6.565
  561    HA   ALA  75           HA       ALA  75  -5.488  -5.983  -8.396
  562   1HB   ALA  75          1HB       ALA  75  -5.716  -5.841  -5.368
  563   2HB   ALA  75          2HB       ALA  75  -4.715  -4.815  -6.434
  564   3HB   ALA  75          3HB       ALA  75  -6.457  -4.703  -6.517
  565    H    ARG  76           H        ARG  76  -3.208  -5.887  -7.169
  566    HA   ARG  76           HA       ARG  76  -2.149  -8.424  -8.014
  567   1HB   ARG  76          2HB       ARG  76  -1.538  -5.931  -8.618
  568   2HB   ARG  76          3HB       ARG  76  -0.610  -5.963  -7.120
  569   1HG   ARG  76          2HG       ARG  76   0.840  -6.421  -8.899
  570   2HG   ARG  76          3HG       ARG  76   0.672  -7.955  -8.063
  571   1HD   ARG  76          2HD       ARG  76  -0.651  -8.904  -9.826
  572   2HD   ARG  76          3HD       ARG  76  -1.147  -7.301 -10.405
  573    HE   ARG  76           HE       ARG  76   1.710  -7.647 -10.488
  574   1HH1  ARG  76          2HH2      ARG  76  -1.097  -8.274 -12.614
  575   2HH1  ARG  76          1HH2      ARG  76  -0.311  -7.328 -13.896
  576   1HH2  ARG  76          2HH1      ARG  76   2.486  -6.478 -12.025
  577   2HH2  ARG  76          1HH1      ARG  76   1.707  -6.425 -13.612
  578    H    GLU  77           H        GLU  77  -3.290  -8.330  -5.183
  579    HA   GLU  77           HA       GLU  77  -1.266  -8.108  -3.230
  580   1HB   GLU  77          2HB       GLU  77  -2.829  -9.915  -2.089
  581   2HB   GLU  77          3HB       GLU  77  -3.351  -8.243  -2.293
  582   1HG   GLU  77          2HG       GLU  77  -4.914  -8.669  -3.865
  583   2HG   GLU  77          3HG       GLU  77  -4.263 -10.189  -4.405
  584    H    LEU  78           H        LEU  78  -2.517 -11.009  -4.644
  585    HA   LEU  78           HA       LEU  78  -0.923 -12.965  -3.737
  586   1HB   LEU  78          2HB       LEU  78  -1.767 -12.931  -6.659
  587   2HB   LEU  78          3HB       LEU  78  -1.424 -14.317  -5.635
  588    HG   LEU  78           HG       LEU  78  -3.660 -14.443  -5.636
  589   1HD1  LEU  78          1HD1      LEU  78  -3.038 -14.176  -3.273
  590   2HD1  LEU  78          2HD1      LEU  78  -3.445 -12.449  -3.350
  591   3HD1  LEU  78          3HD1      LEU  78  -4.696 -13.661  -3.619
  592   1HD2  LEU  78          1HD2      LEU  78  -4.278 -12.791  -7.114
  593   2HD2  LEU  78          2HD2      LEU  78  -5.202 -12.395  -5.655
  594   3HD2  LEU  78          3HD2      LEU  78  -3.750 -11.464  -6.089
  595    H    THR  79           H        THR  79   0.154 -10.662  -6.328
  596    HA   THR  79           HA       THR  79   2.447 -12.345  -6.911
  597    HB   THR  79           HB       THR  79   2.326  -9.394  -7.415
  598    HG1  THR  79           1HG      THR  79   2.028 -10.344  -9.551
  599   1HG2  THR  79          1HG2      THR  79   4.063 -10.110  -9.170
  600   2HG2  THR  79          2HG2      THR  79   4.583 -10.574  -7.553
  601   3HG2  THR  79          3HG2      THR  79   3.873 -11.772  -8.633
  602    H    GLU  80           H        GLU  80   3.548 -12.785  -5.294
  603    HA   GLU  80           HA       GLU  80   3.998 -11.198  -2.962
  604   1HB   GLU  80          2HB       GLU  80   4.071 -13.503  -2.823
  605   2HB   GLU  80          3HB       GLU  80   5.457 -13.656  -3.942
  606   1HG   GLU  80          2HG       GLU  80   6.873 -12.479  -2.241
  607   2HG   GLU  80          3HG       GLU  80   5.469 -12.395  -1.159
  608    H    SER  81           H        SER  81   6.108 -11.592  -5.931
  609    HA   SER  81           HA       SER  81   8.171  -9.915  -5.188
  610   1HB   SER  81          2HB       SER  81   6.726  -9.788  -7.863
  611   2HB   SER  81          3HB       SER  81   8.388  -9.311  -7.516
  612    HG   SER  81           HG       SER  81   8.357 -11.281  -8.442
  613    H    GLU  82           H        GLU  82   4.958  -8.846  -6.481
  614    HA   GLU  82           HA       GLU  82   5.731  -6.081  -6.569
  615   1HB   GLU  82          2HB       GLU  82   2.953  -7.302  -6.633
  616   2HB   GLU  82          3HB       GLU  82   3.400  -5.695  -7.174
  617   1HG   GLU  82          2HG       GLU  82   5.093  -7.714  -8.521
  618   2HG   GLU  82          3HG       GLU  82   3.383  -8.089  -8.691
  619    H    THR  83           H        THR  83   3.746  -8.074  -4.355
  620    HA   THR  83           HA       THR  83   3.046  -6.046  -2.513
  621    HB   THR  83           HB       THR  83   2.883  -8.952  -2.678
  622    HG1  THR  83           1HG      THR  83   1.489  -7.852  -0.735
  623   1HG2  THR  83          1HG2      THR  83   4.486  -9.195  -0.843
  624   2HG2  THR  83          2HG2      THR  83   3.624  -7.960   0.108
  625   3HG2  THR  83          3HG2      THR  83   2.854  -9.505  -0.281
  626    H    LYS  84           H        LYS  84   5.830  -8.208  -2.701
  627    HA   LYS  84           HA       LYS  84   6.993  -7.359  -0.268
  628   1HB   LYS  84          2HB       LYS  84   7.196  -9.607  -1.215
  629   2HB   LYS  84          3HB       LYS  84   8.233  -9.001  -2.527
  630   1HG   LYS  84          2HG       LYS  84   8.886  -8.482   0.363
  631   2HG   LYS  84          3HG       LYS  84   9.176 -10.091  -0.297
  632   1HD   LYS  84          2HD       LYS  84  10.875  -9.426  -1.702
  633   2HD   LYS  84          3HD       LYS  84  10.263  -7.784  -1.899
  634   1HE   LYS  84          2HE       LYS  84  10.884  -7.257   0.470
  635   2HE   LYS  84          3HE       LYS  84  11.593  -8.874   0.626
  636   1HZ   LYS  84          1HZ       LYS  84  13.219  -7.180   0.112
  637   2HZ   LYS  84          2HZ       LYS  84  13.142  -8.281  -1.111
  638   3HZ   LYS  84          3HZ       LYS  84  12.445  -6.798  -1.287
  639    H    SER  85           H        SER  85   7.425  -6.337  -3.649
  640    HA   SER  85           HA       SER  85   9.715  -4.702  -3.329
  641   1HB   SER  85          2HB       SER  85   8.559  -5.204  -5.514
  642   2HB   SER  85          3HB       SER  85   7.248  -4.111  -5.033
  643    HG   SER  85           HG       SER  85   8.632  -2.871  -6.153
  644    H    LEU  86           H        LEU  86   6.205  -3.974  -2.855
  645    HA   LEU  86           HA       LEU  86   6.698  -1.363  -1.788
  646   1HB   LEU  86          2HB       LEU  86   4.357  -3.261  -1.832
  647   2HB   LEU  86          3HB       LEU  86   4.327  -1.963  -0.641
  648    HG   LEU  86           HG       LEU  86   3.209  -1.464  -2.831
  649   1HD1  LEU  86          1HD1      LEU  86   5.409   0.347  -1.733
  650   2HD1  LEU  86          2HD1      LEU  86   4.267   0.881  -2.960
  651   3HD1  LEU  86          3HD1      LEU  86   3.680   0.350  -1.375
  652   1HD2  LEU  86          1HD2      LEU  86   4.476  -0.823  -4.766
  653   2HD2  LEU  86          2HD2      LEU  86   6.017  -1.167  -3.970
  654   3HD2  LEU  86          3HD2      LEU  86   4.885  -2.491  -4.329
  655    H    MET  87           H        MET  87   6.094  -4.488  -0.066
  656    HA   MET  87           HA       MET  87   6.546  -3.570   2.491
  657   1HB   MET  87          2HB       MET  87   6.006  -5.972   1.726
  658   2HB   MET  87          3HB       MET  87   7.757  -6.183   1.550
  659   1HG   MET  87          2HG       MET  87   7.973  -5.403   3.997
  660   2HG   MET  87          3HG       MET  87   6.213  -5.435   4.050
  661   1HE   MET  87          1HE       MET  87   8.867  -7.994   2.550
  662   2HE   MET  87          2HE       MET  87   9.493  -7.473   4.131
  663   3HE   MET  87          3HE       MET  87   8.913  -9.142   3.905
  664    H    ALA  88           H        ALA  88   9.033  -4.394   0.076
  665    HA   ALA  88           HA       ALA  88  11.287  -4.523   1.682
  666   1HB   ALA  88          1HB       ALA  88  12.580  -4.139  -0.360
  667   2HB   ALA  88          2HB       ALA  88  11.188  -5.163  -0.755
  668   3HB   ALA  88          3HB       ALA  88  11.172  -3.453  -1.179
  669    H    ALA  89           H        ALA  89   9.879  -1.671   0.075
  670    HA   ALA  89           HA       ALA  89  11.971   0.094   1.216
  671   1HB   ALA  89          1HB       ALA  89  10.839   1.831  -0.110
  672   2HB   ALA  89          2HB       ALA  89  11.287   0.411  -1.083
  673   3HB   ALA  89          3HB       ALA  89   9.599   0.639  -0.564
  674    H    ALA  90           H        ALA  90   8.414  -0.473   1.520
  675    HA   ALA  90           HA       ALA  90   7.842   1.666   3.316
  676   1HB   ALA  90          1HB       ALA  90   5.947   0.217   4.026
  677   2HB   ALA  90          2HB       ALA  90   6.074   0.342   2.252
  678   3HB   ALA  90          3HB       ALA  90   6.647  -1.118   3.093
  679    H    ASP  91           H        ASP  91   9.084  -1.651   3.895
  680    HA   ASP  91           HA       ASP  91   9.108  -1.265   6.740
  681   1HB   ASP  91          2HB       ASP  91   8.937  -3.534   5.670
  682   2HB   ASP  91          3HB       ASP  91  10.626  -3.376   5.150
  683    H    ASN  92           H        ASN  92  10.528   0.239   7.558
  684    HA   ASN  92           HA       ASN  92  13.109   0.714   6.083
  685   1HB   ASN  92          2HB       ASN  92  13.212   2.911   6.936
  686   2HB   ASN  92          3HB       ASN  92  11.701   2.645   6.063
  687   1HD2  ASN  92          1HD2      ASN  92  10.380   4.184   7.028
  688   2HD2  ASN  92          2HD2      ASN  92  10.057   4.231   8.751
  689    H    ASP  93           H        ASP  93  12.054  -1.136   8.512
  690    HA   ASP  93           HA       ASP  93  14.347  -0.783  10.345
  691   1HB   ASP  93          2HB       ASP  93  12.292  -3.025  10.018
  692   2HB   ASP  93          3HB       ASP  93  13.591  -3.005  11.203
  693    H    GLY  94           H        GLY  94  13.136  -3.068   7.870
  694   1HA   GLY  94          1HA       GLY  94  14.410  -4.532   6.489
  695   2HA   GLY  94          2HA       GLY  94  15.825  -4.303   7.531
  696    H    ASP  95           H        ASP  95  12.378  -4.883   8.318
  697    HA   ASP  95           HA       ASP  95  13.082  -7.519   9.541
  698   1HB   ASP  95          2HB       ASP  95  12.140  -7.137  11.531
  699   2HB   ASP  95          3HB       ASP  95  12.720  -5.503  11.220
  700    H    GLY  96           H        GLY  96  10.341  -5.444   8.455
  701   1HA   GLY  96          1HA       GLY  96   9.369  -6.297   6.326
  702   2HA   GLY  96          2HA       GLY  96   9.129  -7.859   7.121
  703    H    LYS  97           H        LYS  97   8.320  -6.995   9.687
  704    HA   LYS  97           HA       LYS  97   5.546  -6.401   9.318
  705   1HB   LYS  97          2HB       LYS  97   7.348  -6.156  11.733
  706   2HB   LYS  97          3HB       LYS  97   5.595  -6.041  11.785
  707   1HG   LYS  97          2HG       LYS  97   5.290  -8.265  11.748
  708   2HG   LYS  97          3HG       LYS  97   6.379  -8.492  10.387
  709   1HD   LYS  97          2HD       LYS  97   7.059  -9.737  12.408
  710   2HD   LYS  97          3HD       LYS  97   8.313  -8.658  11.799
  711   1HE   LYS  97          2HE       LYS  97   6.522  -7.407  13.837
  712   2HE   LYS  97          3HE       LYS  97   7.402  -8.809  14.449
  713   1HZ   LYS  97          1HZ       LYS  97   8.814  -6.674  13.003
  714   2HZ   LYS  97          2HZ       LYS  97   8.565  -6.599  14.640
  715   3HZ   LYS  97          3HZ       LYS  97   9.439  -7.812  13.941
  716    H    ILE  98           H        ILE  98   4.809  -4.532   8.590
  717    HA   ILE  98           HA       ILE  98   6.215  -1.960   9.109
  718    HB   ILE  98           HB       ILE  98   4.246  -2.985   7.082
  719   1HG1  ILE  98          2HG1      ILE  98   6.669  -1.275   6.533
  720   2HG1  ILE  98          3HG1      ILE  98   6.933  -2.943   7.056
  721   1HG2  ILE  98          1HG2      ILE  98   4.063  -0.708   6.120
  722   2HG2  ILE  98          2HG2      ILE  98   3.247  -0.850   7.677
  723   3HG2  ILE  98          3HG2      ILE  98   4.827  -0.039   7.570
  724   1HD1  ILE  98          1HD1      ILE  98   6.860  -2.871   4.651
  725   2HD1  ILE  98          2HD1      ILE  98   5.492  -3.794   5.299
  726   3HD1  ILE  98          3HD1      ILE  98   5.228  -2.153   4.673
  727    H    GLY  99           H        GLY  99   5.019  -0.168   9.857
  728   1HA   GLY  99          1HA       GLY  99   2.488  -0.714  11.346
  729   2HA   GLY  99          2HA       GLY  99   3.835   0.178  12.084
  730    H    ALA 100           H        ALA 100   1.683   1.672  12.028
  731    HA   ALA 100           HA       ALA 100   0.893   2.870   9.568
  732   1HB   ALA 100          1HB       ALA 100  -0.178   4.531  10.941
  733   2HB   ALA 100          2HB       ALA 100  -0.443   2.934  11.673
  734   3HB   ALA 100          3HB       ALA 100   0.765   4.036  12.370
  735    H    GLU 101           H        GLU 101   3.157   3.908  12.122
  736    HA   GLU 101           HA       GLU 101   3.996   6.234  10.857
  737   1HB   GLU 101          2HB       GLU 101   4.930   4.544  13.113
  738   2HB   GLU 101          3HB       GLU 101   6.264   5.292  12.252
  739   1HG   GLU 101          2HG       GLU 101   5.919   7.197  13.308
  740   2HG   GLU 101          3HG       GLU 101   4.329   7.384  12.599
  741    H    GLU 102           H        GLU 102   5.955   3.200  10.870
  742    HA   GLU 102           HA       GLU 102   7.685   3.664   8.870
  743   1HB   GLU 102          2HB       GLU 102   6.401   1.251   9.934
  744   2HB   GLU 102          3HB       GLU 102   6.765   1.067   8.208
  745   1HG   GLU 102          2HG       GLU 102   9.079   1.718   8.595
  746   2HG   GLU 102          3HG       GLU 102   8.779   1.861  10.339
  747    H    PHE 103           H        PHE 103   4.278   2.691   8.226
  748    HA   PHE 103           HA       PHE 103   4.573   2.672   5.379
  749   1HB   PHE 103          2HB       PHE 103   2.753   1.572   6.669
  750   2HB   PHE 103          3HB       PHE 103   2.084   3.146   7.063
  751    HD1  PHE 103           1HD      PHE 103   3.031   0.939   4.169
  752    HD2  PHE 103           2HD      PHE 103   0.527   4.168   5.552
  753    HE1  PHE 103           1HE      PHE 103   1.752   0.857   2.049
  754    HE2  PHE 103           2HE      PHE 103  -0.782   4.044   3.447
  755    HZ   PHE 103           HZ       PHE 103  -0.146   2.431   1.678
  756    H    GLN 104           H        GLN 104   3.262   5.208   7.593
  757    HA   GLN 104           HA       GLN 104   2.709   7.113   5.536
  758   1HB   GLN 104          2HB       GLN 104   1.591   7.360   7.589
  759   2HB   GLN 104          3HB       GLN 104   3.108   7.424   8.501
  760   1HG   GLN 104          2HG       GLN 104   2.059   9.628   8.246
  761   2HG   GLN 104          3HG       GLN 104   3.694   9.574   7.541
  762   1HE2  GLN 104          1HE2      GLN 104   2.850  11.681   6.588
  763   2HE2  GLN 104          2HE2      GLN 104   1.952  11.524   5.080
  764    H    GLU 105           H        GLU 105   5.636   6.777   7.726
  765    HA   GLU 105           HA       GLU 105   7.156   8.867   6.811
  766   1HB   GLU 105          2HB       GLU 105   7.892   6.019   7.579
  767   2HB   GLU 105          3HB       GLU 105   9.119   7.079   6.885
  768   1HG   GLU 105          2HG       GLU 105   9.369   7.331   9.191
  769   2HG   GLU 105          3HG       GLU 105   8.576   8.813   8.653
  770    H    MET 106           H        MET 106   7.039   5.625   5.221
  771    HA   MET 106           HA       MET 106   8.693   6.557   3.080
  772   1HB   MET 106          2HB       MET 106   7.694   4.049   3.922
  773   2HB   MET 106          3HB       MET 106   7.003   4.284   2.314
  774   1HG   MET 106          2HG       MET 106   9.182   3.227   2.082
  775   2HG   MET 106          3HG       MET 106   9.328   4.888   1.506
  776   1HE   MET 106          1HE       MET 106  11.897   5.006   1.576
  777   2HE   MET 106          2HE       MET 106  12.875   4.380   2.923
  778   3HE   MET 106          3HE       MET 106  11.875   3.266   1.962
  779    H    VAL 107           H        VAL 107   5.145   6.181   3.330
  780    HA   VAL 107           HA       VAL 107   4.500   7.098   0.725
  781    HB   VAL 107           HB       VAL 107   3.032   7.155   3.364
  782   1HG1  VAL 107          1HG1      VAL 107   0.967   7.588   2.018
  783   2HG1  VAL 107          2HG1      VAL 107   2.042   8.978   2.132
  784   3HG1  VAL 107          3HG1      VAL 107   2.018   8.002   0.642
  785   1HG2  VAL 107          1HG2      VAL 107   2.621   5.519   0.822
  786   2HG2  VAL 107          2HG2      VAL 107   3.479   4.928   2.254
  787   3HG2  VAL 107          3HG2      VAL 107   1.758   5.324   2.359
  788    H    HIS 108           H        HIS 108   5.403   8.929   3.593
  789    HA   HIS 108           HA       HIS 108   4.399  11.457   2.744
  790   1HB   HIS 108          2HB       HIS 108   4.708  10.807   5.094
  791   2HB   HIS 108          3HB       HIS 108   6.443  10.652   4.852
  792    HD1  HIS 108           1HD      HIS 108   4.097  13.641   4.010
  793    HD2  HIS 108           2HD      HIS 108   7.513  12.556   6.215
  794    HE1  HIS 108           1HE      HIS 108   4.926  15.762   5.175
  795    H    SER 109           H        SER 109   7.264   9.622   2.099
  796    HA   SER 109           HA       SER 109   9.132  11.731   1.735
  797   1HB   SER 109          2HB       SER 109   9.715   9.308   2.097
  798   2HB   SER 109          3HB       SER 109   9.136   8.985   0.442
  799    HG   SER 109           HG       SER 109  10.618  10.769  -0.143
  Start of MODEL   11
    1   1H    MET   1           H1       MET   1 -16.608   4.409   0.277
    2   2H    MET   1           H2       MET   1 -18.176   3.970   0.493
    3   3H    MET   1           H3       MET   1 -17.562   5.259   1.300
    4    HA   MET   1           HA       MET   1 -17.841   3.459   2.753
    5   1HB   MET   1          2HB       MET   1 -16.929   1.364   2.549
    6   2HB   MET   1          3HB       MET   1 -17.471   1.706   0.908
    7   1HG   MET   1          2HG       MET   1 -15.075   2.225   0.304
    8   2HG   MET   1          3HG       MET   1 -14.614   1.787   1.972
    9   1HE   MET   1          1HE       MET   1 -13.044  -1.099   0.131
   10   2HE   MET   1          2HE       MET   1 -13.204   0.499  -0.617
   11   3HE   MET   1          3HE       MET   1 -12.784   0.362   1.107
   12    H    SER   2           H        SER   2 -14.605   4.032   1.279
   13    HA   SER   2           HA       SER   2 -13.907   5.803   3.410
   14   1HB   SER   2          2HB       SER   2 -12.495   3.083   3.249
   15   2HB   SER   2          3HB       SER   2 -11.807   4.511   4.047
   16    HG   SER   2           HG       SER   2 -14.378   3.955   4.832
   17    H    ILE   3           H        ILE   3 -11.587   3.834   1.536
   18    HA   ILE   3           HA       ILE   3 -10.533   6.270   0.454
   19    HB   ILE   3           HB       ILE   3  -8.720   5.014  -0.245
   20   1HG1  ILE   3          2HG1      ILE   3  -9.004   2.345  -0.011
   21   2HG1  ILE   3          3HG1      ILE   3 -10.626   2.700  -0.560
   22   1HG2  ILE   3          1HG2      ILE   3  -8.064   3.809   1.685
   23   2HG2  ILE   3          2HG2      ILE   3  -9.199   5.053   2.249
   24   3HG2  ILE   3          3HG2      ILE   3  -9.714   3.362   2.118
   25   1HD1  ILE   3          1HD1      ILE   3  -9.144   2.213  -2.463
   26   2HD1  ILE   3          2HD1      ILE   3  -9.562   3.931  -2.548
   27   3HD1  ILE   3          3HD1      ILE   3  -7.980   3.431  -1.919
   28    H    THR   4           H        THR   4 -12.584   3.702  -0.838
   29    HA   THR   4           HA       THR   4 -12.193   4.129  -3.531
   30    HB   THR   4           HB       THR   4 -13.481   2.300  -2.084
   31    HG1  THR   4           1HG      THR   4 -12.888   2.370  -4.251
   32   1HG2  THR   4          1HG2      THR   4 -15.413   3.827  -1.471
   33   2HG2  THR   4          2HG2      THR   4 -15.862   3.838  -3.192
   34   3HG2  THR   4          3HG2      THR   4 -15.869   2.315  -2.291
   35    H    ASP   5           H        ASP   5 -14.015   6.036  -1.256
   36    HA   ASP   5           HA       ASP   5 -15.120   7.709  -3.457
   37   1HB   ASP   5          2HB       ASP   5 -16.850   6.279  -2.359
   38   2HB   ASP   5          3HB       ASP   5 -16.426   7.012  -0.791
   39    H    VAL   6           H        VAL   6 -12.680   8.210  -2.728
   40    HA   VAL   6           HA       VAL   6 -12.994  10.719  -1.165
   41    HB   VAL   6           HB       VAL   6 -11.922   8.698   0.150
   42   1HG1  VAL   6          1HG1      VAL   6 -10.023   8.274  -1.475
   43   2HG1  VAL   6          2HG1      VAL   6  -9.376   9.864  -1.024
   44   3HG1  VAL   6          3HG1      VAL   6  -9.552   8.591   0.191
   45   1HG2  VAL   6          1HG2      VAL   6 -10.797  11.516   0.221
   46   2HG2  VAL   6          2HG2      VAL   6 -12.264  10.937   1.044
   47   3HG2  VAL   6          3HG2      VAL   6 -10.680  10.310   1.522
   48    H    LEU   7           H        LEU   7 -10.783   8.914  -3.266
   49    HA   LEU   7           HA       LEU   7 -10.407  10.930  -5.218
   50   1HB   LEU   7          2HB       LEU   7  -9.260  12.251  -3.511
   51   2HB   LEU   7          3HB       LEU   7  -8.372  10.847  -2.950
   52    HG   LEU   7           HG       LEU   7  -7.683  11.079  -5.705
   53   1HD1  LEU   7          1HD1      LEU   7  -6.905  13.368  -5.928
   54   2HD1  LEU   7          2HD1      LEU   7  -8.667  13.326  -5.729
   55   3HD1  LEU   7          3HD1      LEU   7  -7.631  13.802  -4.363
   56   1HD2  LEU   7          1HD2      LEU   7  -5.479  11.557  -4.830
   57   2HD2  LEU   7          2HD2      LEU   7  -6.152  12.054  -3.259
   58   3HD2  LEU   7          3HD2      LEU   7  -6.254  10.359  -3.787
   59    H    SER   8           H        SER   8  -8.385   8.712  -3.281
   60    HA   SER   8           HA       SER   8  -6.800   7.748  -5.165
   61   1HB   SER   8          2HB       SER   8  -7.799   6.366  -2.682
   62   2HB   SER   8          3HB       SER   8  -6.561   5.648  -3.729
   63    HG   SER   8           HG       SER   8  -5.224   7.356  -3.417
   64    H    ALA   9           H        ALA   9 -10.150   6.845  -5.261
   65    HA   ALA   9           HA       ALA   9 -10.007   4.367  -6.640
   66   1HB   ALA   9          1HB       ALA   9 -12.096   5.187  -7.753
   67   2HB   ALA   9          2HB       ALA   9 -12.109   5.311  -5.985
   68   3HB   ALA   9          3HB       ALA   9 -11.839   6.767  -6.976
   69    H    ASP  10           H        ASP  10  -9.553   7.752  -7.813
   70    HA   ASP  10           HA       ASP  10  -9.256   6.974 -10.595
   71   1HB   ASP  10          2HB       ASP  10  -9.907   9.255  -9.837
   72   2HB   ASP  10          3HB       ASP  10  -8.293   9.471  -9.130
   73    H    ASP  11           H        ASP  11  -7.082   7.560  -7.856
   74    HA   ASP  11           HA       ASP  11  -4.665   7.518  -9.357
   75   1HB   ASP  11          2HB       ASP  11  -5.089   7.046  -6.389
   76   2HB   ASP  11          3HB       ASP  11  -3.600   7.530  -7.200
   77    H    ILE  12           H        ILE  12  -6.440   4.947  -7.488
   78    HA   ILE  12           HA       ILE  12  -4.501   2.954  -7.986
   79    HB   ILE  12           HB       ILE  12  -6.127   1.384  -7.453
   80   1HG1  ILE  12          2HG1      ILE  12  -8.163   3.527  -7.236
   81   2HG1  ILE  12          3HG1      ILE  12  -8.155   2.223  -8.421
   82   1HG2  ILE  12          1HG2      ILE  12  -6.396   1.934  -5.100
   83   2HG2  ILE  12          2HG2      ILE  12  -4.835   2.499  -5.694
   84   3HG2  ILE  12          3HG2      ILE  12  -6.154   3.652  -5.443
   85   1HD1  ILE  12          1HD1      ILE  12  -9.753   1.653  -6.754
   86   2HD1  ILE  12          2HD1      ILE  12  -8.357   0.583  -6.519
   87   3HD1  ILE  12          3HD1      ILE  12  -8.626   1.974  -5.432
   88    H    ALA  13           H        ALA  13  -7.367   4.082  -9.854
   89    HA   ALA  13           HA       ALA  13  -7.231   2.102 -11.871
   90   1HB   ALA  13          1HB       ALA  13  -8.408   3.634 -13.303
   91   2HB   ALA  13          2HB       ALA  13  -9.059   3.781 -11.659
   92   3HB   ALA  13          3HB       ALA  13  -7.969   5.024 -12.307
   93    H    ALA  14           H        ALA  14  -5.455   5.230 -11.604
   94    HA   ALA  14           HA       ALA  14  -3.783   4.875 -13.898
   95   1HB   ALA  14          1HB       ALA  14  -2.994   6.193 -11.277
   96   2HB   ALA  14          2HB       ALA  14  -2.255   6.411 -12.866
   97   3HB   ALA  14          3HB       ALA  14  -3.917   6.971 -12.578
   98    H    ALA  15           H        ALA  15  -3.101   3.921 -10.490
   99    HA   ALA  15           HA       ALA  15  -0.606   2.764 -10.840
  100   1HB   ALA  15          1HB       ALA  15  -1.066   1.455  -8.854
  101   2HB   ALA  15          2HB       ALA  15  -1.775   3.074  -8.633
  102   3HB   ALA  15          3HB       ALA  15  -2.806   1.686  -9.024
  103    H    LEU  16           H        LEU  16  -3.762   1.245 -11.184
  104    HA   LEU  16           HA       LEU  16  -3.041  -1.389 -11.598
  105   1HB   LEU  16          2HB       LEU  16  -5.320  -0.411 -11.214
  106   2HB   LEU  16          3HB       LEU  16  -5.362   0.115 -12.892
  107    HG   LEU  16           HG       LEU  16  -6.721  -1.830 -12.425
  108   1HD1  LEU  16          1HD1      LEU  16  -4.511  -2.842 -14.223
  109   2HD1  LEU  16          2HD1      LEU  16  -6.246  -3.148 -14.295
  110   3HD1  LEU  16          3HD1      LEU  16  -5.626  -1.536 -14.699
  111   1HD2  LEU  16          1HD2      LEU  16  -5.847  -4.010 -11.850
  112   2HD2  LEU  16          2HD2      LEU  16  -4.187  -3.390 -11.801
  113   3HD2  LEU  16          3HD2      LEU  16  -5.386  -2.836 -10.608
  114    H    GLN  17           H        GLN  17  -3.107   1.336 -13.934
  115    HA   GLN  17           HA       GLN  17  -2.532  -0.542 -16.148
  116   1HB   GLN  17          2HB       GLN  17  -4.199   1.318 -16.361
  117   2HB   GLN  17          3HB       GLN  17  -2.837   2.456 -16.375
  118   1HG   GLN  17          2HG       GLN  17  -1.857   1.214 -18.309
  119   2HG   GLN  17          3HG       GLN  17  -3.209   0.070 -18.263
  120   1HE2  GLN  17          1HE2      GLN  17  -2.222   2.116 -20.356
  121   2HE2  GLN  17          2HE2      GLN  17  -3.706   2.962 -20.762
  122    H    GLU  18           H        GLU  18  -1.058   2.278 -14.535
  123    HA   GLU  18           HA       GLU  18   1.355   2.540 -15.902
  124   1HB   GLU  18          2HB       GLU  18   0.665   4.152 -14.300
  125   2HB   GLU  18          3HB       GLU  18   0.523   2.951 -13.012
  126   1HG   GLU  18          2HG       GLU  18   2.407   4.452 -12.702
  127   2HG   GLU  18          3HG       GLU  18   2.906   2.759 -12.798
  128    H    CYS  19           H        CYS  19   0.624   0.405 -13.105
  129    HA   CYS  19           HA       CYS  19   3.109  -1.184 -13.692
  130   1HB   CYS  19          2HB       CYS  19   1.482  -0.875 -11.128
  131   2HB   CYS  19          3HB       CYS  19   2.881  -1.943 -11.349
  132    HG   CYS  19           HG       CYS  19   4.579  -0.101 -11.957
  133    H    ARG  20           H        ARG  20   1.134  -1.763 -15.506
  134    HA   ARG  20           HA       ARG  20  -0.747  -3.756 -14.392
  135   1HB   ARG  20          2HB       ARG  20  -1.167  -2.270 -16.391
  136   2HB   ARG  20          3HB       ARG  20   0.011  -3.225 -17.298
  137   1HG   ARG  20          2HG       ARG  20  -1.429  -5.255 -16.863
  138   2HG   ARG  20          3HG       ARG  20  -2.583  -4.199 -16.007
  139   1HD   ARG  20          2HD       ARG  20  -2.836  -2.823 -18.039
  140   2HD   ARG  20          3HD       ARG  20  -1.667  -3.873 -18.887
  141    HE   ARG  20           HE       ARG  20  -3.866  -5.392 -17.803
  142   1HH1  ARG  20          2HH2      ARG  20  -3.050  -3.226 -20.456
  143   2HH1  ARG  20          1HH2      ARG  20  -4.180  -3.897 -21.591
  144   1HH2  ARG  20          2HH1      ARG  20  -5.390  -6.332 -19.281
  145   2HH2  ARG  20          1HH1      ARG  20  -5.553  -5.710 -20.890
  146    H    ASP  21           H        ASP  21   2.040  -3.819 -16.630
  147    HA   ASP  21           HA       ASP  21   2.315  -6.493 -16.956
  148   1HB   ASP  21          2HB       ASP  21   4.269  -4.166 -16.930
  149   2HB   ASP  21          3HB       ASP  21   4.826  -5.795 -17.275
  150    HA   PRO  22           HA       PRO  22   3.334  -8.236 -13.075
  151   1HB   PRO  22          2HB       PRO  22   4.922 -10.376 -13.738
  152   2HB   PRO  22          3HB       PRO  22   3.157 -10.301 -14.004
  153   1HG   PRO  22          2HG       PRO  22   5.348  -9.672 -15.997
  154   2HG   PRO  22          3HG       PRO  22   3.921 -10.728 -16.238
  155   1HD   PRO  22          2HD       PRO  22   3.926  -8.168 -17.098
  156   2HD   PRO  22          3HD       PRO  22   2.454  -8.839 -16.332
  157    H    ASP  23           H        ASP  23   5.000  -8.353 -11.509
  158    HA   ASP  23           HA       ASP  23   6.738  -7.820 -10.402
  159   1HB   ASP  23          2HB       ASP  23   7.893  -9.224 -12.150
  160   2HB   ASP  23          3HB       ASP  23   8.418  -7.720 -12.931
  161    H    THR  24           H        THR  24   5.905  -5.582 -12.965
  162    HA   THR  24           HA       THR  24   7.852  -3.650 -12.624
  163    HB   THR  24           HB       THR  24   5.055  -3.142 -13.716
  164    HG1  THR  24           1HG      THR  24   5.367  -4.917 -14.756
  165   1HG2  THR  24          1HG2      THR  24   6.556  -1.223 -14.037
  166   2HG2  THR  24          2HG2      THR  24   7.827  -2.294 -14.668
  167   3HG2  THR  24          3HG2      THR  24   6.322  -2.053 -15.574
  168    H    PHE  25           H        PHE  25   6.508  -4.147  -9.937
  169    HA   PHE  25           HA       PHE  25   4.812  -1.774  -9.767
  170   1HB   PHE  25          2HB       PHE  25   3.969  -4.114  -9.350
  171   2HB   PHE  25          3HB       PHE  25   4.659  -3.966  -7.732
  172    HD1  PHE  25           1HD      PHE  25   3.616  -0.663  -8.380
  173    HD2  PHE  25           2HD      PHE  25   1.943  -4.597  -7.789
  174    HE1  PHE  25           1HE      PHE  25   1.366   0.285  -8.348
  175    HE2  PHE  25           2HE      PHE  25  -0.300  -3.579  -7.490
  176    HZ   PHE  25           HZ       PHE  25  -0.598  -1.133  -7.787
  177    H    GLU  26           H        GLU  26   6.582  -0.284  -9.382
  178    HA   GLU  26           HA       GLU  26   8.514  -0.698  -7.308
  179   1HB   GLU  26          2HB       GLU  26   7.852   1.463  -9.278
  180   2HB   GLU  26          3HB       GLU  26   8.599   2.006  -7.773
  181   1HG   GLU  26          2HG       GLU  26  10.453   0.360  -8.145
  182   2HG   GLU  26          3HG       GLU  26   9.769   0.042  -9.753
  183    HA   PRO  27           HA       PRO  27   6.111   0.761  -3.951
  184   1HB   PRO  27          2HB       PRO  27   8.059   1.781  -2.217
  185   2HB   PRO  27          3HB       PRO  27   7.707   0.058  -2.403
  186   1HG   PRO  27          2HG       PRO  27   9.946   1.614  -3.675
  187   2HG   PRO  27          3HG       PRO  27   9.961  -0.051  -3.046
  188   1HD   PRO  27          2HD       PRO  27   9.747   0.528  -5.716
  189   2HD   PRO  27          3HD       PRO  27   8.984  -0.911  -4.977
  190    H    GLN  28           H        GLN  28   8.837   3.155  -4.295
  191    HA   GLN  28           HA       GLN  28   7.432   5.320  -3.496
  192   1HB   GLN  28          2HB       GLN  28  10.035   4.807  -4.443
  193   2HB   GLN  28          3HB       GLN  28   9.384   5.937  -5.636
  194   1HG   GLN  28          2HG       GLN  28   8.556   7.257  -3.576
  195   2HG   GLN  28          3HG       GLN  28   9.655   6.262  -2.621
  196   1HE2  GLN  28          1HE2      GLN  28  11.430   7.591  -2.128
  197   2HE2  GLN  28          2HE2      GLN  28  12.225   8.615  -3.308
  198    H    LYS  29           H        LYS  29   7.705   4.006  -6.797
  199    HA   LYS  29           HA       LYS  29   6.217   6.018  -8.122
  200   1HB   LYS  29          2HB       LYS  29   7.542   4.293  -9.285
  201   2HB   LYS  29          3HB       LYS  29   6.368   3.055  -8.793
  202   1HG   LYS  29          2HG       LYS  29   4.853   3.667 -10.384
  203   2HG   LYS  29          3HG       LYS  29   5.063   5.384 -10.055
  204   1HD   LYS  29          2HD       LYS  29   5.672   5.020 -12.282
  205   2HD   LYS  29          3HD       LYS  29   7.145   5.434 -11.392
  206   1HE   LYS  29          2HE       LYS  29   8.008   3.225 -11.542
  207   2HE   LYS  29          3HE       LYS  29   6.404   2.513 -11.805
  208   1HZ   LYS  29          1HZ       LYS  29   7.799   4.178 -13.776
  209   2HZ   LYS  29          2HZ       LYS  29   7.650   2.534 -13.821
  210   3HZ   LYS  29          3HZ       LYS  29   6.310   3.488 -13.936
  211    H    PHE  30           H        PHE  30   5.049   2.792  -6.846
  212    HA   PHE  30           HA       PHE  30   2.389   3.243  -7.487
  213   1HB   PHE  30          2HB       PHE  30   3.209   1.057  -6.764
  214   2HB   PHE  30          3HB       PHE  30   3.523   1.677  -5.152
  215    HD1  PHE  30           1HD      PHE  30   2.116   0.171  -3.899
  216    HD2  PHE  30           2HD      PHE  30   0.419   2.296  -7.235
  217    HE1  PHE  30           1HE      PHE  30  -0.146  -0.290  -3.041
  218    HE2  PHE  30           2HE      PHE  30  -1.842   1.695  -6.449
  219    HZ   PHE  30           HZ       PHE  30  -2.132   0.584  -4.263
  220    H    PHE  31           H        PHE  31   4.085   3.938  -4.481
  221    HA   PHE  31           HA       PHE  31   2.227   5.048  -2.787
  222   1HB   PHE  31          2HB       PHE  31   4.376   4.797  -1.951
  223   2HB   PHE  31          3HB       PHE  31   5.132   5.449  -3.387
  224    HD1  PHE  31           1HD      PHE  31   2.612   6.822  -1.000
  225    HD2  PHE  31           2HD      PHE  31   6.357   7.400  -3.047
  226    HE1  PHE  31           1HE      PHE  31   2.775   9.078  -0.116
  227    HE2  PHE  31           2HE      PHE  31   6.676   9.560  -1.858
  228    HZ   PHE  31           HZ       PHE  31   4.908  10.389  -0.324
  229    H    GLN  32           H        GLN  32   4.029   6.896  -5.354
  230    HA   GLN  32           HA       GLN  32   2.533   9.295  -4.773
  231   1HB   GLN  32          2HB       GLN  32   4.789   9.372  -5.718
  232   2HB   GLN  32          3HB       GLN  32   4.233   8.568  -7.198
  233   1HG   GLN  32          2HG       GLN  32   2.752  10.450  -7.724
  234   2HG   GLN  32          3HG       GLN  32   3.119  11.228  -6.179
  235   1HE2  GLN  32          1HE2      GLN  32   5.549  11.729  -5.808
  236   2HE2  GLN  32          2HE2      GLN  32   6.396  12.327  -7.223
  237    H    THR  33           H        THR  33   2.415   6.775  -7.352
  238    HA   THR  33           HA       THR  33   0.453   8.065  -8.844
  239    HB   THR  33           HB       THR  33   2.243   6.035  -9.267
  240    HG1  THR  33           1HG      THR  33  -0.086   6.731 -10.577
  241   1HG2  THR  33          1HG2      THR  33   1.156   3.987  -9.775
  242   2HG2  THR  33          2HG2      THR  33   0.609   4.381  -8.130
  243   3HG2  THR  33          3HG2      THR  33  -0.454   4.690  -9.512
  244    H    SER  34           H        SER  34   0.140   6.103  -5.999
  245    HA   SER  34           HA       SER  34  -2.679   5.523  -6.411
  246   1HB   SER  34          2HB       SER  34  -2.518   4.498  -4.154
  247   2HB   SER  34          3HB       SER  34  -1.333   3.873  -5.312
  248    HG   SER  34           HG       SER  34   0.255   5.067  -4.351
  249    H    GLY  35           H        GLY  35  -0.829   8.184  -5.219
  250   1HA   GLY  35          1HA       GLY  35  -1.657  10.246  -4.736
  251   2HA   GLY  35          2HA       GLY  35  -3.311   9.610  -4.567
  252    H    LEU  36           H        LEU  36  -1.074   7.726  -2.827
  253    HA   LEU  36           HA       LEU  36  -2.145   8.570  -0.299
  254   1HB   LEU  36          2HB       LEU  36   0.220   6.791  -0.977
  255   2HB   LEU  36          3HB       LEU  36  -0.618   6.902   0.576
  256    HG   LEU  36           HG       LEU  36  -1.889   5.902  -1.988
  257   1HD1  LEU  36          1HD1      LEU  36  -1.821   3.713  -0.890
  258   2HD1  LEU  36          2HD1      LEU  36  -0.184   4.372  -1.037
  259   3HD1  LEU  36          3HD1      LEU  36  -1.022   4.424   0.530
  260   1HD2  LEU  36          1HD2      LEU  36  -3.720   5.148  -0.462
  261   2HD2  LEU  36          2HD2      LEU  36  -3.005   6.152   0.819
  262   3HD2  LEU  36          3HD2      LEU  36  -3.619   6.892  -0.685
  263    H    SER  37           H        SER  37   0.750   9.475  -2.185
  264    HA   SER  37           HA       SER  37   2.060  11.141  -0.237
  265   1HB   SER  37          2HB       SER  37   2.740  12.354  -2.363
  266   2HB   SER  37          3HB       SER  37   3.060  10.616  -2.437
  267    HG   SER  37           HG       SER  37   1.957  11.454  -4.312
  268    H    LYS  38           H        LYS  38  -0.859  11.523  -2.160
  269    HA   LYS  38           HA       LYS  38  -0.811  14.434  -1.994
  270   1HB   LYS  38          2HB       LYS  38  -1.473  12.708  -3.940
  271   2HB   LYS  38          3HB       LYS  38  -3.075  12.831  -3.223
  272   1HG   LYS  38          2HG       LYS  38  -3.259  15.122  -3.796
  273   2HG   LYS  38          3HG       LYS  38  -1.514  15.340  -3.900
  274   1HD   LYS  38          2HD       LYS  38  -2.514  15.444  -6.092
  275   2HD   LYS  38          3HD       LYS  38  -1.340  14.143  -5.984
  276   1HE   LYS  38          2HE       LYS  38  -4.236  13.442  -5.471
  277   2HE   LYS  38          3HE       LYS  38  -3.820  13.907  -7.121
  278   1HZ   LYS  38          1HZ       LYS  38  -2.465  11.744  -5.674
  279   2HZ   LYS  38          2HZ       LYS  38  -3.643  11.487  -6.754
  280   3HZ   LYS  38          3HZ       LYS  38  -2.246  12.150  -7.248
  281    H    MET  39           H        MET  39  -2.345  11.661  -0.533
  282    HA   MET  39           HA       MET  39  -4.652  12.703   0.468
  283   1HB   MET  39          2HB       MET  39  -2.769  10.494   1.187
  284   2HB   MET  39          3HB       MET  39  -3.862  10.958   2.459
  285   1HG   MET  39          2HG       MET  39  -5.792  10.702   0.933
  286   2HG   MET  39          3HG       MET  39  -4.678  10.181  -0.347
  287   1HE   MET  39          1HE       MET  39  -7.321   8.483   0.829
  288   2HE   MET  39          2HE       MET  39  -6.337   8.376  -0.643
  289   3HE   MET  39          3HE       MET  39  -6.546   6.940   0.375
  290    H    SER  40           H        SER  40  -1.698  12.482   2.454
  291    HA   SER  40           HA       SER  40  -0.913  14.330   3.884
  292   1HB   SER  40          2HB       SER  40  -2.893  15.765   3.905
  293   2HB   SER  40          3HB       SER  40  -3.864  14.482   4.676
  294    HG   SER  40           HG       SER  40  -2.953  16.136   6.107
  295    H    ALA  41           H        ALA  41  -0.213  13.733   5.985
  296    HA   ALA  41           HA       ALA  41  -0.203  11.112   6.908
  297   1HB   ALA  41          1HB       ALA  41   0.154  12.153   9.187
  298   2HB   ALA  41          2HB       ALA  41   1.235  12.748   7.927
  299   3HB   ALA  41          3HB       ALA  41  -0.149  13.738   8.453
  300    H    ASN  42           H        ASN  42  -2.699  13.592   7.355
  301    HA   ASN  42           HA       ASN  42  -4.182  12.311   9.450
  302   1HB   ASN  42          2HB       ASN  42  -5.191  14.142   7.223
  303   2HB   ASN  42          3HB       ASN  42  -6.056  13.743   8.715
  304   1HD2  ASN  42          1HD2      ASN  42  -5.309  16.414   7.765
  305   2HD2  ASN  42          2HD2      ASN  42  -4.218  17.064   8.977
  306    H    GLN  43           H        GLN  43  -4.853  12.432   5.931
  307    HA   GLN  43           HA       GLN  43  -6.923  10.459   6.019
  308   1HB   GLN  43          2HB       GLN  43  -5.257  11.747   3.857
  309   2HB   GLN  43          3HB       GLN  43  -6.326  10.398   3.453
  310   1HG   GLN  43          2HG       GLN  43  -7.132  13.046   4.739
  311   2HG   GLN  43          3HG       GLN  43  -7.387  12.594   3.049
  312   1HE2  GLN  43          1HE2      GLN  43  -8.326   9.899   3.348
  313   2HE2  GLN  43          2HE2      GLN  43  -9.855   9.984   4.205
  314    H    VAL  44           H        VAL  44  -3.368  10.233   5.430
  315    HA   VAL  44           HA       VAL  44  -3.425   7.520   4.603
  316    HB   VAL  44           HB       VAL  44  -1.276   9.229   5.908
  317   1HG1  VAL  44          1HG1      VAL  44  -0.992   6.580   4.430
  318   2HG1  VAL  44          2HG1      VAL  44   0.333   7.641   4.960
  319   3HG1  VAL  44          3HG1      VAL  44  -0.679   6.830   6.165
  320   1HG2  VAL  44          1HG2      VAL  44  -2.219   9.924   3.598
  321   2HG2  VAL  44          2HG2      VAL  44  -0.493   9.628   3.676
  322   3HG2  VAL  44          3HG2      VAL  44  -1.593   8.409   2.982
  323    H    LYS  45           H        LYS  45  -3.121   9.055   7.864
  324    HA   LYS  45           HA       LYS  45  -2.822   6.632   9.323
  325   1HB   LYS  45          2HB       LYS  45  -2.417   8.918  10.201
  326   2HB   LYS  45          3HB       LYS  45  -4.167   9.203  10.234
  327   1HG   LYS  45          2HG       LYS  45  -4.409   7.217  11.746
  328   2HG   LYS  45          3HG       LYS  45  -2.658   7.027  11.764
  329   1HD   LYS  45          2HD       LYS  45  -4.302   9.421  12.739
  330   2HD   LYS  45          3HD       LYS  45  -3.533   8.220  13.774
  331   1HE   LYS  45          2HE       LYS  45  -2.160  10.329  12.038
  332   2HE   LYS  45          3HE       LYS  45  -2.221  10.246  13.800
  333   1HZ   LYS  45          1HZ       LYS  45  -0.733   8.499  11.965
  334   2HZ   LYS  45          2HZ       LYS  45  -0.143   9.456  13.134
  335   3HZ   LYS  45          3HZ       LYS  45  -0.964   8.096  13.556
  336    H    ASP  46           H        ASP  46  -5.744   8.447   8.228
  337    HA   ASP  46           HA       ASP  46  -7.630   6.642   9.363
  338   1HB   ASP  46          2HB       ASP  46  -7.744   8.810   7.360
  339   2HB   ASP  46          3HB       ASP  46  -8.937   7.525   7.146
  340    H    VAL  47           H        VAL  47  -6.403   6.610   5.966
  341    HA   VAL  47           HA       VAL  47  -7.767   4.227   5.366
  342    HB   VAL  47           HB       VAL  47  -6.524   3.974   3.423
  343   1HG1  VAL  47          1HG1      VAL  47  -6.934   5.968   2.353
  344   2HG1  VAL  47          2HG1      VAL  47  -7.949   6.139   3.799
  345   3HG1  VAL  47          3HG1      VAL  47  -6.384   6.964   3.695
  346   1HG2  VAL  47          1HG2      VAL  47  -4.476   5.235   2.852
  347   2HG2  VAL  47          2HG2      VAL  47  -4.349   5.652   4.569
  348   3HG2  VAL  47          3HG2      VAL  47  -4.250   3.961   4.063
  349    H    PHE  48           H        PHE  48  -4.511   4.623   6.775
  350    HA   PHE  48           HA       PHE  48  -3.616   2.008   6.941
  351   1HB   PHE  48          2HB       PHE  48  -2.135   3.511   7.795
  352   2HB   PHE  48          3HB       PHE  48  -3.348   4.393   8.694
  353    HD1  PHE  48           1HD      PHE  48  -1.558   1.088   8.685
  354    HD2  PHE  48           2HD      PHE  48  -3.746   4.008  10.982
  355    HE1  PHE  48           1HE      PHE  48  -1.401  -0.363  10.689
  356    HE2  PHE  48           2HE      PHE  48  -3.638   2.523  12.964
  357    HZ   PHE  48           HZ       PHE  48  -2.535   0.303  12.793
  358    H    ARG  49           H        ARG  49  -6.197   3.469   9.021
  359    HA   ARG  49           HA       ARG  49  -6.448   1.204  10.771
  360   1HB   ARG  49          2HB       ARG  49  -8.524   3.213   9.850
  361   2HB   ARG  49          3HB       ARG  49  -8.752   2.087  11.178
  362   1HG   ARG  49          2HG       ARG  49  -7.454   3.218  12.645
  363   2HG   ARG  49          3HG       ARG  49  -6.277   3.708  11.425
  364   1HD   ARG  49          2HD       ARG  49  -7.164   5.743  11.221
  365   2HD   ARG  49          3HD       ARG  49  -8.756   5.107  10.852
  366    HE   ARG  49           HE       ARG  49  -9.451   5.694  12.901
  367   1HH1  ARG  49          2HH2      ARG  49  -5.990   5.303  13.008
  368   2HH1  ARG  49          1HH2      ARG  49  -5.741   6.073  14.554
  369   1HH2  ARG  49          2HH1      ARG  49  -9.222   6.798  14.929
  370   2HH2  ARG  49          1HH1      ARG  49  -7.665   6.963  15.673
  371    H    PHE  50           H        PHE  50  -7.745   1.915   7.529
  372    HA   PHE  50           HA       PHE  50  -9.576  -0.353   7.528
  373   1HB   PHE  50          2HB       PHE  50  -9.557   1.966   6.166
  374   2HB   PHE  50          3HB       PHE  50  -8.644   1.009   5.012
  375    HD1  PHE  50           1HD      PHE  50 -11.811   1.166   7.009
  376    HD2  PHE  50           2HD      PHE  50  -9.886  -0.428   3.496
  377    HE1  PHE  50           1HE      PHE  50 -13.996   0.347   6.187
  378    HE2  PHE  50           2HE      PHE  50 -12.075  -1.307   2.706
  379    HZ   PHE  50           HZ       PHE  50 -14.136  -0.889   4.032
  380    H    ILE  51           H        ILE  51  -6.255   0.379   6.503
  381    HA   ILE  51           HA       ILE  51  -5.841  -2.046   5.013
  382    HB   ILE  51           HB       ILE  51  -3.743  -0.354   6.439
  383   1HG1  ILE  51          2HG1      ILE  51  -4.574   1.222   4.967
  384   2HG1  ILE  51          3HG1      ILE  51  -3.329   0.462   4.011
  385   1HG2  ILE  51          1HG2      ILE  51  -2.876  -2.504   5.895
  386   2HG2  ILE  51          2HG2      ILE  51  -3.550  -2.453   4.267
  387   3HG2  ILE  51          3HG2      ILE  51  -2.220  -1.364   4.725
  388   1HD1  ILE  51          1HD1      ILE  51  -5.173  -0.966   2.948
  389   2HD1  ILE  51          2HD1      ILE  51  -6.342   0.076   3.783
  390   3HD1  ILE  51          3HD1      ILE  51  -5.209   0.777   2.623
  391    H    ASP  52           H        ASP  52  -4.974  -1.172   8.410
  392    HA   ASP  52           HA       ASP  52  -4.093  -3.895   8.963
  393   1HB   ASP  52          2HB       ASP  52  -3.297  -1.612   9.990
  394   2HB   ASP  52          3HB       ASP  52  -4.604  -1.861  11.144
  395    H    ASN  53           H        ASN  53  -6.175  -4.641   8.061
  396    HA   ASN  53           HA       ASN  53  -8.732  -4.274   8.957
  397   1HB   ASN  53          2HB       ASN  53  -7.984  -5.591   7.006
  398   2HB   ASN  53          3HB       ASN  53  -7.427  -6.887   8.056
  399   1HD2  ASN  53          1HD2      ASN  53  -9.027  -8.230   9.163
  400   2HD2  ASN  53          2HD2      ASN  53 -10.682  -8.254   8.590
  401    H    ASP  54           H        ASP  54  -6.288  -6.405  10.353
  402    HA   ASP  54           HA       ASP  54  -7.985  -7.658  12.365
  403   1HB   ASP  54          2HB       ASP  54  -5.798  -8.684  12.954
  404   2HB   ASP  54          3HB       ASP  54  -6.110  -8.818  11.211
  405    H    GLN  55           H        GLN  55  -6.025  -4.759  12.081
  406    HA   GLN  55           HA       GLN  55  -5.305  -3.203  13.430
  407   1HB   GLN  55          2HB       GLN  55  -7.883  -4.016  14.663
  408   2HB   GLN  55          3HB       GLN  55  -6.840  -3.057  15.707
  409   1HG   GLN  55          2HG       GLN  55  -6.590  -1.337  13.974
  410   2HG   GLN  55          3HG       GLN  55  -7.649  -2.251  12.888
  411   1HE2  GLN  55          1HE2      GLN  55  -9.851  -2.899  14.021
  412   2HE2  GLN  55          2HE2      GLN  55 -10.617  -1.584  14.904
  413    H    SER  56           H        SER  56  -3.948  -5.823  13.691
  414    HA   SER  56           HA       SER  56  -2.934  -5.999  16.348
  415   1HB   SER  56          2HB       SER  56  -0.960  -6.992  15.370
  416   2HB   SER  56          3HB       SER  56  -2.402  -7.669  14.609
  417    HG   SER  56           HG       SER  56  -0.573  -7.014  13.209
  418    H    GLY  57           H        GLY  57  -2.284  -3.743  13.692
  419   1HA   GLY  57          1HA       GLY  57  -1.166  -1.666  13.833
  420   2HA   GLY  57          2HA       GLY  57  -0.493  -2.090  15.412
  421    H    TYR  58           H        TYR  58  -0.115  -4.844  13.572
  422    HA   TYR  58           HA       TYR  58   2.460  -3.996  12.323
  423   1HB   TYR  58          2HB       TYR  58   1.734  -6.620  13.646
  424   2HB   TYR  58          3HB       TYR  58   3.018  -6.454  12.456
  425    HD1  TYR  58           HD1      TYR  58   2.230  -6.044  15.961
  426    HD2  TYR  58           HD2      TYR  58   4.893  -4.772  12.816
  427    HE1  TYR  58           HE1      TYR  58   3.904  -5.334  17.652
  428    HE2  TYR  58           HE2      TYR  58   6.549  -4.054  14.500
  429    HH   TYR  58           HH       TYR  58   7.030  -3.862  16.745
  430    H    LEU  59           H        LEU  59   2.754  -4.438  10.300
  431    HA   LEU  59           HA       LEU  59   0.662  -5.774   8.697
  432   1HB   LEU  59          2HB       LEU  59   2.014  -3.107   8.509
  433   2HB   LEU  59          3HB       LEU  59   1.936  -3.995   6.990
  434    HG   LEU  59           HG       LEU  59  -0.537  -3.746   8.730
  435   1HD1  LEU  59          1HD1      LEU  59   0.323  -1.797   6.555
  436   2HD1  LEU  59          2HD1      LEU  59  -1.209  -1.783   7.455
  437   3HD1  LEU  59          3HD1      LEU  59   0.309  -1.442   8.300
  438   1HD2  LEU  59          1HD2      LEU  59  -0.427  -5.419   6.838
  439   2HD2  LEU  59          2HD2      LEU  59  -1.624  -4.168   6.535
  440   3HD2  LEU  59          3HD2      LEU  59  -0.024  -4.098   5.748
  441    H    ASP  60           H        ASP  60   1.974  -7.552   9.523
  442    HA   ASP  60           HA       ASP  60   4.437  -8.294   8.422
  443   1HB   ASP  60          2HB       ASP  60   1.988 -10.028   8.981
  444   2HB   ASP  60          3HB       ASP  60   3.671 -10.576   8.932
  445    H    GLU  61           H        GLU  61   4.910  -9.783   6.646
  446    HA   GLU  61           HA       GLU  61   4.030  -8.924   4.188
  447   1HB   GLU  61          2HB       GLU  61   5.316 -11.572   4.957
  448   2HB   GLU  61          3HB       GLU  61   5.075 -11.027   3.289
  449   1HG   GLU  61          2HG       GLU  61   6.373  -8.975   3.734
  450   2HG   GLU  61          3HG       GLU  61   6.682  -9.508   5.395
  451    H    GLU  62           H        GLU  62   2.739 -11.812   5.944
  452    HA   GLU  62           HA       GLU  62   0.968 -12.574   3.857
  453   1HB   GLU  62          2HB       GLU  62   0.886 -13.047   6.861
  454   2HB   GLU  62          3HB       GLU  62  -0.345 -13.668   5.749
  455   1HG   GLU  62          2HG       GLU  62   1.386 -14.818   4.413
  456   2HG   GLU  62          3HG       GLU  62   2.641 -14.260   5.534
  457    H    GLU  63           H        GLU  63   0.588 -10.022   6.356
  458    HA   GLU  63           HA       GLU  63  -2.204  -9.528   5.653
  459   1HB   GLU  63          2HB       GLU  63  -0.143  -7.788   7.074
  460   2HB   GLU  63          3HB       GLU  63  -1.807  -7.322   6.702
  461   1HG   GLU  63          2HG       GLU  63  -2.658  -9.220   8.043
  462   2HG   GLU  63          3HG       GLU  63  -0.994  -9.644   8.494
  463    H    LEU  64           H        LEU  64   1.016  -8.230   4.634
  464    HA   LEU  64           HA       LEU  64  -0.070  -6.357   2.752
  465   1HB   LEU  64          2HB       LEU  64   2.597  -7.803   2.772
  466   2HB   LEU  64          3HB       LEU  64   2.052  -6.789   1.440
  467    HG   LEU  64           HG       LEU  64   1.736  -4.869   2.986
  468   1HD1  LEU  64          1HD1      LEU  64   3.276  -6.642   4.935
  469   2HD1  LEU  64          2HD1      LEU  64   2.976  -4.909   5.127
  470   3HD1  LEU  64          3HD1      LEU  64   1.616  -6.040   5.171
  471   1HD2  LEU  64          1HD2      LEU  64   4.523  -6.081   2.827
  472   2HD2  LEU  64          2HD2      LEU  64   3.729  -5.155   1.534
  473   3HD2  LEU  64          3HD2      LEU  64   4.146  -4.360   3.058
  474    H    LYS  65           H        LYS  65   0.384  -9.872   2.525
  475    HA   LYS  65           HA       LYS  65  -0.327  -9.997  -0.254
  476   1HB   LYS  65          2HB       LYS  65   0.860 -11.713   1.406
  477   2HB   LYS  65          3HB       LYS  65  -0.777 -12.382   1.492
  478   1HG   LYS  65          2HG       LYS  65  -0.761 -12.428  -1.079
  479   2HG   LYS  65          3HG       LYS  65   0.897 -11.818  -1.000
  480   1HD   LYS  65          2HD       LYS  65   1.174 -14.074  -1.378
  481   2HD   LYS  65          3HD       LYS  65   1.539 -13.852   0.342
  482   1HE   LYS  65          2HE       LYS  65  -0.799 -14.675   0.880
  483   2HE   LYS  65          3HE       LYS  65  -1.087 -14.883  -0.856
  484   1HZ   LYS  65          1HZ       LYS  65   0.797 -16.421  -0.886
  485   2HZ   LYS  65          2HZ       LYS  65   0.922 -16.302   0.753
  486   3HZ   LYS  65          3HZ       LYS  65  -0.437 -16.944   0.089
  487    H    PHE  66           H        PHE  66  -2.296  -9.022   2.265
  488    HA   PHE  66           HA       PHE  66  -4.530  -9.252   0.475
  489   1HB   PHE  66          2HB       PHE  66  -4.756 -11.318   1.880
  490   2HB   PHE  66          3HB       PHE  66  -4.762 -10.325   3.331
  491    HD1  PHE  66           1HD      PHE  66  -6.814  -9.245   4.074
  492    HD2  PHE  66           2HD      PHE  66  -6.658 -11.232   0.253
  493    HE1  PHE  66           1HE      PHE  66  -9.279  -9.094   3.896
  494    HE2  PHE  66           2HE      PHE  66  -9.135 -11.085   0.083
  495    HZ   PHE  66           HZ       PHE  66 -10.443  -9.981   1.880
  496    H    PHE  67           H        PHE  67  -3.708  -7.142   0.459
  497    HA   PHE  67           HA       PHE  67  -4.451  -5.245   2.668
  498   1HB   PHE  67          2HB       PHE  67  -2.140  -5.233   2.736
  499   2HB   PHE  67          3HB       PHE  67  -1.983  -5.589   1.021
  500    HD1  PHE  67           1HD      PHE  67  -0.133  -4.098   0.817
  501    HD2  PHE  67           2HD      PHE  67  -4.006  -2.633   2.018
  502    HE1  PHE  67           1HE      PHE  67   0.491  -1.824   0.070
  503    HE2  PHE  67           2HE      PHE  67  -3.403  -0.379   1.202
  504    HZ   PHE  67           HZ       PHE  67  -1.176   0.022   0.174
  505    H    LEU  68           H        LEU  68  -3.848  -5.602  -0.865
  506    HA   LEU  68           HA       LEU  68  -5.246  -3.103  -1.493
  507   1HB   LEU  68          2HB       LEU  68  -3.673  -5.169  -3.027
  508   2HB   LEU  68          3HB       LEU  68  -4.943  -4.270  -3.864
  509    HG   LEU  68           HG       LEU  68  -2.785  -3.333  -4.245
  510   1HD1  LEU  68          1HD1      LEU  68  -4.179  -1.330  -2.475
  511   2HD1  LEU  68          2HD1      LEU  68  -3.419  -1.118  -4.064
  512   3HD1  LEU  68          3HD1      LEU  68  -4.974  -1.939  -3.950
  513   1HD2  LEU  68          1HD2      LEU  68  -2.663  -2.767  -1.266
  514   2HD2  LEU  68          2HD2      LEU  68  -1.688  -3.983  -2.117
  515   3HD2  LEU  68          3HD2      LEU  68  -1.471  -2.258  -2.478
  516    H    GLN  69           H        GLN  69  -6.029  -6.542  -1.203
  517    HA   GLN  69           HA       GLN  69  -8.365  -6.494  -2.734
  518   1HB   GLN  69          2HB       GLN  69  -7.928  -8.082  -0.211
  519   2HB   GLN  69          3HB       GLN  69  -9.286  -8.300  -1.315
  520   1HG   GLN  69          2HG       GLN  69  -6.388  -8.899  -1.892
  521   2HG   GLN  69          3HG       GLN  69  -7.701 -10.015  -1.709
  522   1HE2  GLN  69          1HE2      GLN  69  -5.915  -8.224  -3.966
  523   2HE2  GLN  69          2HE2      GLN  69  -6.625  -8.990  -5.355
  524    H    LYS  70           H        LYS  70  -7.823  -4.596   0.102
  525    HA   LYS  70           HA       LYS  70 -10.653  -4.198   0.770
  526   1HB   LYS  70          2HB       LYS  70  -8.047  -2.784   1.385
  527   2HB   LYS  70          3HB       LYS  70  -9.549  -1.871   1.478
  528   1HG   LYS  70          2HG       LYS  70  -9.024  -2.751   3.653
  529   2HG   LYS  70          3HG       LYS  70 -10.536  -3.421   3.021
  530   1HD   LYS  70          2HD       LYS  70  -9.221  -5.529   2.367
  531   2HD   LYS  70          3HD       LYS  70  -7.789  -4.768   3.073
  532   1HE   LYS  70          2HE       LYS  70  -8.696  -6.242   4.737
  533   2HE   LYS  70          3HE       LYS  70  -9.020  -4.577   5.260
  534   1HZ   LYS  70          1HZ       LYS  70 -10.892  -5.955   5.586
  535   2HZ   LYS  70          2HZ       LYS  70 -11.274  -4.839   4.444
  536   3HZ   LYS  70          3HZ       LYS  70 -10.965  -6.399   3.995
  537    H    PHE  71           H        PHE  71  -8.293  -2.756  -1.502
  538    HA   PHE  71           HA       PHE  71 -10.017  -0.478  -2.096
  539   1HB   PHE  71          2HB       PHE  71  -7.477  -1.510  -3.417
  540   2HB   PHE  71          3HB       PHE  71  -8.281   0.008  -3.784
  541    HD1  PHE  71           1HD      PHE  71  -8.537  -0.270  -0.243
  542    HD2  PHE  71           2HD      PHE  71  -5.709   0.535  -3.404
  543    HE1  PHE  71           1HE      PHE  71  -7.142   0.981   1.325
  544    HE2  PHE  71           2HE      PHE  71  -4.314   1.820  -1.812
  545    HZ   PHE  71           HZ       PHE  71  -5.030   2.062   0.554
  546    H    GLU  72           H        GLU  72  -9.106  -3.546  -3.685
  547    HA   GLU  72           HA       GLU  72 -11.379  -3.293  -5.566
  548   1HB   GLU  72          2HB       GLU  72  -9.853  -3.876  -7.459
  549   2HB   GLU  72          3HB       GLU  72  -9.502  -2.284  -6.787
  550   1HG   GLU  72          2HG       GLU  72  -7.568  -3.124  -5.570
  551   2HG   GLU  72          3HG       GLU  72  -7.999  -4.796  -5.965
  552    H    SER  73           H        SER  73 -11.227  -5.528  -6.942
  553    HA   SER  73           HA       SER  73 -10.877  -7.713  -4.908
  554   1HB   SER  73          2HB       SER  73 -12.817  -7.651  -7.234
  555   2HB   SER  73          3HB       SER  73 -12.762  -8.784  -5.871
  556    HG   SER  73           HG       SER  73 -14.352  -7.159  -5.549
  557    H    GLY  74           H        GLY  74  -8.909  -6.646  -7.092
  558   1HA   GLY  74          1HA       GLY  74  -8.017  -9.285  -7.936
  559   2HA   GLY  74          2HA       GLY  74  -8.737  -8.340  -9.256
  560    H    ALA  75           H        ALA  75  -6.801  -7.264  -6.430
  561    HA   ALA  75           HA       ALA  75  -5.135  -5.639  -8.117
  562   1HB   ALA  75          1HB       ALA  75  -4.292  -4.737  -6.169
  563   2HB   ALA  75          2HB       ALA  75  -5.889  -5.282  -5.632
  564   3HB   ALA  75          3HB       ALA  75  -4.463  -6.250  -5.266
  565    H    ARG  76           H        ARG  76  -2.705  -6.095  -6.504
  566    HA   ARG  76           HA       ARG  76  -1.618  -8.438  -8.005
  567   1HB   ARG  76          2HB       ARG  76  -0.992  -5.919  -8.458
  568   2HB   ARG  76          3HB       ARG  76  -0.074  -6.079  -6.955
  569   1HG   ARG  76          2HG       ARG  76   1.444  -6.594  -8.546
  570   2HG   ARG  76          3HG       ARG  76   1.017  -8.204  -8.066
  571   1HD   ARG  76          2HD       ARG  76  -0.047  -8.675 -10.119
  572   2HD   ARG  76          3HD       ARG  76  -0.566  -7.039 -10.375
  573    HE   ARG  76           HE       ARG  76   2.224  -8.123 -10.689
  574   1HH1  ARG  76          2HH2      ARG  76   0.064  -5.342 -11.001
  575   2HH1  ARG  76          1HH2      ARG  76   1.273  -4.339 -11.706
  576   1HH2  ARG  76          2HH1      ARG  76   3.764  -6.828 -11.263
  577   2HH2  ARG  76          1HH1      ARG  76   3.409  -5.529 -12.428
  578    H    GLU  77           H        GLU  77  -2.372  -7.491  -4.792
  579    HA   GLU  77           HA       GLU  77  -0.116  -7.967  -3.319
  580   1HB   GLU  77          2HB       GLU  77  -1.563  -8.542  -1.471
  581   2HB   GLU  77          3HB       GLU  77  -1.986  -7.083  -2.352
  582   1HG   GLU  77          2HG       GLU  77  -3.525  -9.010  -3.692
  583   2HG   GLU  77          3HG       GLU  77  -3.501  -9.629  -2.037
  584    H    LEU  78           H        LEU  78  -2.270 -10.332  -4.675
  585    HA   LEU  78           HA       LEU  78  -1.488 -12.770  -3.802
  586   1HB   LEU  78          2HB       LEU  78  -1.506 -12.293  -6.795
  587   2HB   LEU  78          3HB       LEU  78  -1.997 -13.702  -5.875
  588    HG   LEU  78           HG       LEU  78  -3.967 -12.918  -6.634
  589   1HD1  LEU  78          1HD1      LEU  78  -3.921 -11.383  -4.004
  590   2HD1  LEU  78          2HD1      LEU  78  -5.317 -12.035  -4.862
  591   3HD1  LEU  78          3HD1      LEU  78  -4.116 -13.139  -4.163
  592   1HD2  LEU  78          1HD2      LEU  78  -4.705 -10.706  -6.997
  593   2HD2  LEU  78          2HD2      LEU  78  -3.359  -9.989  -6.119
  594   3HD2  LEU  78          3HD2      LEU  78  -3.060 -10.832  -7.645
  595    H    THR  79           H        THR  79   0.415 -10.802  -6.211
  596    HA   THR  79           HA       THR  79   2.427 -12.882  -6.345
  597    HB   THR  79           HB       THR  79   2.744 -10.083  -7.447
  598    HG1  THR  79           1HG      THR  79   2.098 -11.230  -9.353
  599   1HG2  THR  79          1HG2      THR  79   4.755 -11.564  -7.463
  600   2HG2  THR  79          2HG2      THR  79   3.809 -12.871  -8.205
  601   3HG2  THR  79          3HG2      THR  79   4.144 -11.386  -9.107
  602    H    GLU  80           H        GLU  80   3.930 -13.131  -4.975
  603    HA   GLU  80           HA       GLU  80   4.342 -11.395  -2.786
  604   1HB   GLU  80          2HB       GLU  80   6.101 -13.691  -3.683
  605   2HB   GLU  80          3HB       GLU  80   6.145 -12.809  -2.137
  606   1HG   GLU  80          2HG       GLU  80   4.918 -14.742  -1.648
  607   2HG   GLU  80          3HG       GLU  80   3.718 -13.452  -1.767
  608    H    SER  81           H        SER  81   6.106 -11.570  -5.889
  609    HA   SER  81           HA       SER  81   8.379 -10.076  -5.096
  610   1HB   SER  81          2HB       SER  81   8.048 -11.287  -7.333
  611   2HB   SER  81          3HB       SER  81   7.160  -9.849  -7.878
  612    HG   SER  81           HG       SER  81   9.176  -9.294  -8.364
  613    H    GLU  82           H        GLU  82   5.464  -8.775  -6.847
  614    HA   GLU  82           HA       GLU  82   5.978  -6.086  -6.433
  615   1HB   GLU  82          2HB       GLU  82   3.335  -7.606  -6.641
  616   2HB   GLU  82          3HB       GLU  82   3.494  -5.847  -6.642
  617   1HG   GLU  82          2HG       GLU  82   3.510  -6.220  -8.900
  618   2HG   GLU  82          3HG       GLU  82   5.246  -6.271  -8.609
  619    H    THR  83           H        THR  83   4.223  -8.339  -4.204
  620    HA   THR  83           HA       THR  83   3.489  -6.345  -2.329
  621    HB   THR  83           HB       THR  83   3.848  -9.319  -2.283
  622    HG1  THR  83           1HG      THR  83   1.843  -8.002  -0.969
  623   1HG2  THR  83          1HG2      THR  83   3.272  -9.378   0.177
  624   2HG2  THR  83          2HG2      THR  83   4.947  -8.948  -0.169
  625   3HG2  THR  83          3HG2      THR  83   3.789  -7.681   0.280
  626    H    LYS  84           H        LYS  84   6.427  -8.349  -2.633
  627    HA   LYS  84           HA       LYS  84   7.634  -7.387  -0.283
  628   1HB   LYS  84          2HB       LYS  84   8.069  -9.542  -1.383
  629   2HB   LYS  84          3HB       LYS  84   8.968  -8.730  -2.678
  630   1HG   LYS  84          2HG       LYS  84   9.679  -8.188   0.210
  631   2HG   LYS  84          3HG       LYS  84  10.047  -9.781  -0.451
  632   1HD   LYS  84          2HD       LYS  84  11.429  -8.891  -2.191
  633   2HD   LYS  84          3HD       LYS  84  10.983  -7.216  -1.828
  634   1HE   LYS  84          2HE       LYS  84  12.164  -7.161   0.211
  635   2HE   LYS  84          3HE       LYS  84  12.234  -8.924   0.346
  636   1HZ   LYS  84          1HZ       LYS  84  13.709  -7.350  -1.655
  637   2HZ   LYS  84          2HZ       LYS  84  14.340  -7.988  -0.274
  638   3HZ   LYS  84          3HZ       LYS  84  13.774  -8.984  -1.451
  639    H    SER  85           H        SER  85   7.754  -6.295  -3.649
  640    HA   SER  85           HA       SER  85   9.772  -4.326  -3.442
  641   1HB   SER  85          2HB       SER  85   7.230  -4.202  -5.131
  642   2HB   SER  85          3HB       SER  85   8.728  -3.313  -5.388
  643    HG   SER  85           HG       SER  85   8.430  -6.154  -5.463
  644    H    LEU  86           H        LEU  86   6.240  -4.163  -2.681
  645    HA   LEU  86           HA       LEU  86   6.411  -1.448  -1.681
  646   1HB   LEU  86          2HB       LEU  86   4.357  -3.612  -1.641
  647   2HB   LEU  86          3HB       LEU  86   4.282  -2.438  -0.330
  648    HG   LEU  86           HG       LEU  86   2.876  -1.834  -2.263
  649   1HD1  LEU  86          1HD1      LEU  86   3.764  -0.141  -0.669
  650   2HD1  LEU  86          2HD1      LEU  86   5.097   0.213  -1.777
  651   3HD1  LEU  86          3HD1      LEU  86   3.444   0.534  -2.261
  652   1HD2  LEU  86          1HD2      LEU  86   4.275  -2.733  -4.069
  653   2HD2  LEU  86          2HD2      LEU  86   3.902  -1.033  -4.373
  654   3HD2  LEU  86          3HD2      LEU  86   5.502  -1.487  -3.793
  655    H    MET  87           H        MET  87   6.336  -4.569   0.038
  656    HA   MET  87           HA       MET  87   6.781  -3.728   2.571
  657   1HB   MET  87          2HB       MET  87   6.584  -6.130   1.711
  658   2HB   MET  87          3HB       MET  87   8.299  -6.035   1.325
  659   1HG   MET  87          2HG       MET  87   8.258  -5.240   4.003
  660   2HG   MET  87          3HG       MET  87   6.973  -6.437   3.915
  661   1HE   MET  87          1HE       MET  87  10.741  -5.627   3.704
  662   2HE   MET  87          2HE       MET  87  11.462  -7.150   3.135
  663   3HE   MET  87          3HE       MET  87  10.500  -6.155   2.019
  664    H    ALA  88           H        ALA  88   9.265  -4.109   0.068
  665    HA   ALA  88           HA       ALA  88  11.585  -3.835   1.546
  666   1HB   ALA  88          1HB       ALA  88  11.028  -2.961  -1.325
  667   2HB   ALA  88          2HB       ALA  88  12.635  -3.232  -0.619
  668   3HB   ALA  88          3HB       ALA  88  11.494  -4.581  -0.803
  669    H    ALA  89           H        ALA  89   9.618  -1.197   0.104
  670    HA   ALA  89           HA       ALA  89  11.516   0.851   1.117
  671   1HB   ALA  89          1HB       ALA  89   8.842   1.112  -0.273
  672   2HB   ALA  89          2HB       ALA  89   9.962   2.443   0.086
  673   3HB   ALA  89          3HB       ALA  89  10.445   1.180  -1.064
  674    H    ALA  90           H        ALA  90   8.205  -0.359   1.738
  675    HA   ALA  90           HA       ALA  90   7.423   1.593   3.690
  676   1HB   ALA  90          1HB       ALA  90   5.716  -0.074   4.233
  677   2HB   ALA  90          2HB       ALA  90   5.943  -0.027   2.457
  678   3HB   ALA  90          3HB       ALA  90   6.658  -1.343   3.418
  679    H    ASP  91           H        ASP  91   9.168  -1.520   4.033
  680    HA   ASP  91           HA       ASP  91   9.197  -1.305   6.886
  681   1HB   ASP  91          2HB       ASP  91   9.310  -3.491   5.757
  682   2HB   ASP  91          3HB       ASP  91  10.897  -3.069   5.082
  683    H    ASN  92           H        ASN  92  10.149   0.739   7.370
  684    HA   ASN  92           HA       ASN  92  12.727   1.511   6.093
  685   1HB   ASN  92          2HB       ASN  92  10.976   2.961   8.115
  686   2HB   ASN  92          3HB       ASN  92  12.505   3.569   7.473
  687   1HD2  ASN  92          1HD2      ASN  92   9.254   2.451   6.288
  688   2HD2  ASN  92          2HD2      ASN  92   9.246   3.622   4.993
  689    H    ASP  93           H        ASP  93  12.929  -0.883   7.502
  690    HA   ASP  93           HA       ASP  93  14.618  -0.161   9.863
  691   1HB   ASP  93          2HB       ASP  93  12.608  -2.453   9.619
  692   2HB   ASP  93          3HB       ASP  93  13.915  -2.425  10.797
  693    H    GLY  94           H        GLY  94  13.627  -2.823   7.680
  694   1HA   GLY  94          1HA       GLY  94  15.115  -4.181   6.370
  695   2HA   GLY  94          2HA       GLY  94  16.446  -3.814   7.481
  696    H    ASP  95           H        ASP  95  13.011  -4.678   8.076
  697    HA   ASP  95           HA       ASP  95  13.860  -7.248   9.318
  698   1HB   ASP  95          2HB       ASP  95  12.766  -6.999  11.265
  699   2HB   ASP  95          3HB       ASP  95  13.296  -5.332  11.045
  700    H    GLY  96           H        GLY  96  10.993  -5.352   8.214
  701   1HA   GLY  96          1HA       GLY  96  10.054  -6.184   6.082
  702   2HA   GLY  96          2HA       GLY  96   9.991  -7.806   6.786
  703    H    LYS  97           H        LYS  97   9.218  -6.753   9.510
  704    HA   LYS  97           HA       LYS  97   6.325  -6.658   9.053
  705   1HB   LYS  97          2HB       LYS  97   8.010  -6.318  11.564
  706   2HB   LYS  97          3HB       LYS  97   6.247  -6.382  11.520
  707   1HG   LYS  97          2HG       LYS  97   6.199  -8.624  10.776
  708   2HG   LYS  97          3HG       LYS  97   7.927  -8.636  10.367
  709   1HD   LYS  97          2HD       LYS  97   8.609  -8.423  12.646
  710   2HD   LYS  97          3HD       LYS  97   6.949  -8.211  13.222
  711   1HE   LYS  97          2HE       LYS  97   7.947 -10.727  11.786
  712   2HE   LYS  97          3HE       LYS  97   7.977 -10.543  13.547
  713   1HZ   LYS  97          1HZ       LYS  97   5.580 -10.279  13.509
  714   2HZ   LYS  97          2HZ       LYS  97   5.517 -10.394  11.905
  715   3HZ   LYS  97          3HZ       LYS  97   5.984 -11.694  12.772
  716    H    ILE  98           H        ILE  98   5.379  -4.822   8.406
  717    HA   ILE  98           HA       ILE  98   6.590  -2.169   9.021
  718    HB   ILE  98           HB       ILE  98   4.347  -3.156   7.242
  719   1HG1  ILE  98          2HG1      ILE  98   6.600  -1.602   6.113
  720   2HG1  ILE  98          3HG1      ILE  98   7.159  -3.056   6.921
  721   1HG2  ILE  98          1HG2      ILE  98   5.238  -0.277   7.645
  722   2HG2  ILE  98          2HG2      ILE  98   4.277  -0.866   6.282
  723   3HG2  ILE  98          3HG2      ILE  98   3.610  -0.958   7.914
  724   1HD1  ILE  98          1HD1      ILE  98   6.752  -3.586   4.674
  725   2HD1  ILE  98          2HD1      ILE  98   5.523  -4.422   5.635
  726   3HD1  ILE  98          3HD1      ILE  98   5.085  -2.950   4.720
  727    H    GLY  99           H        GLY  99   4.968  -0.521   9.822
  728   1HA   GLY  99          1HA       GLY  99   2.730  -1.520  11.388
  729   2HA   GLY  99          2HA       GLY  99   4.016  -0.693  12.312
  730    H    ALA 100           H        ALA 100   1.798   0.690  12.454
  731    HA   ALA 100           HA       ALA 100   0.848   2.169  10.262
  732   1HB   ALA 100          1HB       ALA 100   1.025   3.131  13.150
  733   2HB   ALA 100          2HB       ALA 100  -0.131   3.637  11.897
  734   3HB   ALA 100          3HB       ALA 100  -0.194   1.989  12.565
  735    H    GLU 101           H        GLU 101   3.386   2.872  12.654
  736    HA   GLU 101           HA       GLU 101   3.910   5.459  11.829
  737   1HB   GLU 101          2HB       GLU 101   4.602   4.430  13.980
  738   2HB   GLU 101          3HB       GLU 101   5.908   3.560  13.160
  739   1HG   GLU 101          2HG       GLU 101   7.040   5.620  12.643
  740   2HG   GLU 101          3HG       GLU 101   5.609   6.591  13.024
  741    H    GLU 102           H        GLU 102   5.967   2.566  11.080
  742    HA   GLU 102           HA       GLU 102   7.546   3.587   9.064
  743   1HB   GLU 102          2HB       GLU 102   6.255   0.862   9.387
  744   2HB   GLU 102          3HB       GLU 102   7.406   1.217   8.101
  745   1HG   GLU 102          2HG       GLU 102   9.114   1.841   9.771
  746   2HG   GLU 102          3HG       GLU 102   7.989   1.442  11.081
  747    H    PHE 103           H        PHE 103   4.171   2.339   8.656
  748    HA   PHE 103           HA       PHE 103   4.218   2.548   5.806
  749   1HB   PHE 103          2HB       PHE 103   2.562   1.350   7.434
  750   2HB   PHE 103          3HB       PHE 103   1.685   2.866   7.443
  751    HD1  PHE 103           1HD      PHE 103   2.038  -0.285   5.873
  752    HD2  PHE 103           2HD      PHE 103   1.167   3.843   4.951
  753    HE1  PHE 103           1HE      PHE 103   0.897  -0.988   3.796
  754    HE2  PHE 103           2HE      PHE 103   0.028   3.119   2.870
  755    HZ   PHE 103           HZ       PHE 103  -0.093   0.713   2.286
  756    H    GLN 104           H        GLN 104   2.938   4.759   8.314
  757    HA   GLN 104           HA       GLN 104   2.135   6.888   6.530
  758   1HB   GLN 104          2HB       GLN 104   1.423   6.373   8.989
  759   2HB   GLN 104          3HB       GLN 104   2.922   7.209   9.433
  760   1HG   GLN 104          2HG       GLN 104   2.023   9.125   7.879
  761   2HG   GLN 104          3HG       GLN 104   0.484   8.258   7.930
  762   1HE2  GLN 104          1HE2      GLN 104   2.575  10.441   9.559
  763   2HE2  GLN 104          2HE2      GLN 104   1.666  10.600  11.041
  764    H    GLU 105           H        GLU 105   5.268   6.100   8.143
  765    HA   GLU 105           HA       GLU 105   6.514   8.595   7.500
  766   1HB   GLU 105          2HB       GLU 105   7.582   5.780   7.999
  767   2HB   GLU 105          3HB       GLU 105   8.645   7.126   7.597
  768   1HG   GLU 105          2HG       GLU 105   6.708   7.262   9.947
  769   2HG   GLU 105          3HG       GLU 105   8.396   6.750  10.078
  770    H    MET 106           H        MET 106   6.520   5.424   5.784
  771    HA   MET 106           HA       MET 106   8.076   6.299   3.608
  772   1HB   MET 106          2HB       MET 106   7.142   3.921   4.275
  773   2HB   MET 106          3HB       MET 106   5.793   4.334   3.225
  774   1HG   MET 106          2HG       MET 106   8.730   3.986   2.497
  775   2HG   MET 106          3HG       MET 106   7.337   3.034   2.002
  776   1HE   MET 106          1HE       MET 106   8.796   6.763   1.570
  777   2HE   MET 106          2HE       MET 106   9.856   5.513   0.886
  778   3HE   MET 106          3HE       MET 106   8.986   6.638  -0.181
  779    H    VAL 107           H        VAL 107   4.527   6.162   4.034
  780    HA   VAL 107           HA       VAL 107   3.958   7.355   1.523
  781    HB   VAL 107           HB       VAL 107   2.282   6.863   3.995
  782   1HG1  VAL 107          1HG1      VAL 107   0.334   7.176   2.521
  783   2HG1  VAL 107          2HG1      VAL 107   1.236   8.684   2.698
  784   3HG1  VAL 107          3HG1      VAL 107   1.411   7.728   1.215
  785   1HG2  VAL 107          1HG2      VAL 107   3.110   4.821   2.807
  786   2HG2  VAL 107          2HG2      VAL 107   1.366   5.030   2.589
  787   3HG2  VAL 107          3HG2      VAL 107   2.479   5.461   1.280
  788    H    HIS 108           H        HIS 108   4.443   8.896   4.742
  789    HA   HIS 108           HA       HIS 108   3.324  11.383   3.678
  790   1HB   HIS 108          2HB       HIS 108   2.968  10.601   6.006
  791   2HB   HIS 108          3HB       HIS 108   4.662  10.980   6.355
  792    HD1  HIS 108           1HD      HIS 108   4.663  13.261   7.595
  793    HD2  HIS 108           2HD      HIS 108   1.699  12.927   4.628
  794    HE1  HIS 108           1HE      HIS 108   3.309  15.433   7.656
  795    H    SER 109           H        SER 109   6.107   9.896   2.934
  796    HA   SER 109           HA       SER 109   8.025  11.998   3.460
  797   1HB   SER 109          2HB       SER 109   8.656   9.572   3.329
  798   2HB   SER 109          3HB       SER 109   8.171   9.586   1.615
  799    HG   SER 109           HG       SER 109   9.657  11.478   1.513
  Start of MODEL   12
    1   1H    MET   1           H1       MET   1 -17.787   3.280   4.380
    2   2H    MET   1           H2       MET   1 -19.129   3.263   3.387
    3   3H    MET   1           H3       MET   1 -18.053   1.987   3.425
    4    HA   MET   1           HA       MET   1 -17.740   3.296   1.462
    5   1HB   MET   1          2HB       MET   1 -16.835   5.416   3.489
    6   2HB   MET   1          3HB       MET   1 -16.697   5.517   1.732
    7   1HG   MET   1          2HG       MET   1 -19.207   5.690   3.395
    8   2HG   MET   1          3HG       MET   1 -18.528   6.839   2.244
    9   1HE   MET   1          1HE       MET   1 -21.824   6.087   0.429
   10   2HE   MET   1          2HE       MET   1 -21.538   6.371   2.166
   11   3HE   MET   1          3HE       MET   1 -20.653   7.323   0.942
   12    H    SER   2           H        SER   2 -15.352   4.098   0.900
   13    HA   SER   2           HA       SER   2 -13.283   2.813   2.482
   14   1HB   SER   2          2HB       SER   2 -13.662   2.006  -0.441
   15   2HB   SER   2          3HB       SER   2 -12.540   1.317   0.745
   16    HG   SER   2           HG       SER   2 -14.362  -0.016   0.398
   17    H    ILE   3           H        ILE   3 -11.166   3.317   1.192
   18    HA   ILE   3           HA       ILE   3 -10.812   6.015   0.786
   19    HB   ILE   3           HB       ILE   3  -8.686   5.528  -0.052
   20   1HG1  ILE   3          2HG1      ILE   3  -9.174   3.991  -1.890
   21   2HG1  ILE   3          3HG1      ILE   3  -7.846   3.467  -0.877
   22   1HG2  ILE   3          1HG2      ILE   3  -9.155   4.877   2.298
   23   2HG2  ILE   3          2HG2      ILE   3  -9.331   3.191   1.799
   24   3HG2  ILE   3          3HG2      ILE   3  -7.786   4.008   1.560
   25   1HD1  ILE   3          1HD1      ILE   3  -9.187   1.690   0.084
   26   2HD1  ILE   3          2HD1      ILE   3 -10.666   2.299  -0.703
   27   3HD1  ILE   3          3HD1      ILE   3  -9.357   1.669  -1.680
   28    H    THR   4           H        THR   4 -12.009   3.682  -1.538
   29    HA   THR   4           HA       THR   4 -11.788   4.894  -3.949
   30    HB   THR   4           HB       THR   4 -12.882   2.665  -3.077
   31    HG1  THR   4           1HG      THR   4 -12.560   3.043  -5.116
   32   1HG2  THR   4          1HG2      THR   4 -14.808   3.657  -1.829
   33   2HG2  THR   4          2HG2      THR   4 -15.445   4.268  -3.379
   34   3HG2  THR   4          3HG2      THR   4 -15.270   2.529  -3.112
   35    H    ASP   5           H        ASP   5 -14.122   5.632  -1.318
   36    HA   ASP   5           HA       ASP   5 -15.459   7.645  -2.947
   37   1HB   ASP   5          2HB       ASP   5 -16.719   5.999  -1.548
   38   2HB   ASP   5          3HB       ASP   5 -15.967   6.704  -0.100
   39    H    VAL   6           H        VAL   6 -12.877   8.343  -2.606
   40    HA   VAL   6           HA       VAL   6 -13.107  10.847  -1.026
   41    HB   VAL   6           HB       VAL   6 -10.630   9.065  -0.815
   42   1HG1  VAL   6          1HG1      VAL   6 -11.450  11.662   0.551
   43   2HG1  VAL   6          2HG1      VAL   6 -10.023  10.703   0.973
   44   3HG1  VAL   6          3HG1      VAL   6 -10.133  11.454  -0.625
   45   1HG2  VAL   6          1HG2      VAL   6 -12.420   7.991   0.476
   46   2HG2  VAL   6          2HG2      VAL   6 -11.236   8.732   1.551
   47   3HG2  VAL   6          3HG2      VAL   6 -12.793   9.538   1.272
   48    H    LEU   7           H        LEU   7 -10.897   8.937  -3.051
   49    HA   LEU   7           HA       LEU   7 -10.751  10.818  -5.221
   50   1HB   LEU   7          2HB       LEU   7  -9.446  12.148  -3.536
   51   2HB   LEU   7          3HB       LEU   7  -8.446  10.736  -3.218
   52    HG   LEU   7           HG       LEU   7  -7.888  10.893  -5.816
   53   1HD1  LEU   7          1HD1      LEU   7  -9.544  12.671  -6.315
   54   2HD1  LEU   7          2HD1      LEU   7  -8.687  13.764  -5.203
   55   3HD1  LEU   7          3HD1      LEU   7  -7.880  13.168  -6.669
   56   1HD2  LEU   7          1HD2      LEU   7  -5.982  12.329  -5.285
   57   2HD2  LEU   7          2HD2      LEU   7  -6.769  12.856  -3.777
   58   3HD2  LEU   7          3HD2      LEU   7  -6.267  11.162  -3.988
   59    H    SER   8           H        SER   8  -8.854   8.550  -3.244
   60    HA   SER   8           HA       SER   8  -7.135   7.561  -4.918
   61   1HB   SER   8          2HB       SER   8  -8.551   5.968  -2.792
   62   2HB   SER   8          3HB       SER   8  -6.918   5.657  -3.435
   63    HG   SER   8           HG       SER   8  -6.353   7.773  -2.732
   64    H    ALA   9           H        ALA   9 -10.500   6.710  -5.352
   65    HA   ALA   9           HA       ALA   9 -10.216   4.222  -6.710
   66   1HB   ALA   9          1HB       ALA   9 -12.083   6.581  -7.299
   67   2HB   ALA   9          2HB       ALA   9 -12.294   4.919  -7.888
   68   3HB   ALA   9          3HB       ALA   9 -12.421   5.273  -6.157
   69    H    ASP  10           H        ASP  10  -9.849   7.608  -7.873
   70    HA   ASP  10           HA       ASP  10  -9.436   6.836 -10.626
   71   1HB   ASP  10          2HB       ASP  10 -10.194   9.098  -9.745
   72   2HB   ASP  10          3HB       ASP  10  -8.517   9.393  -9.251
   73    H    ASP  11           H        ASP  11  -7.353   7.477  -7.837
   74    HA   ASP  11           HA       ASP  11  -4.842   7.541  -9.183
   75   1HB   ASP  11          2HB       ASP  11  -5.540   6.867  -6.283
   76   2HB   ASP  11          3HB       ASP  11  -3.944   7.152  -6.937
   77    H    ILE  12           H        ILE  12  -6.567   4.907  -7.341
   78    HA   ILE  12           HA       ILE  12  -4.619   2.989  -7.940
   79    HB   ILE  12           HB       ILE  12  -6.075   1.373  -7.263
   80   1HG1  ILE  12          2HG1      ILE  12  -8.313   3.331  -7.134
   81   2HG1  ILE  12          3HG1      ILE  12  -8.202   1.904  -8.164
   82   1HG2  ILE  12          1HG2      ILE  12  -6.468   3.555  -5.228
   83   2HG2  ILE  12          2HG2      ILE  12  -6.053   1.843  -5.006
   84   3HG2  ILE  12          3HG2      ILE  12  -4.855   2.958  -5.652
   85   1HD1  ILE  12          1HD1      ILE  12  -9.674   1.383  -6.349
   86   2HD1  ILE  12          2HD1      ILE  12  -8.169   0.480  -6.090
   87   3HD1  ILE  12          3HD1      ILE  12  -8.512   1.953  -5.143
   88    H    ALA  13           H        ALA  13  -7.609   3.910  -9.682
   89    HA   ALA  13           HA       ALA  13  -7.505   1.903 -11.661
   90   1HB   ALA  13          1HB       ALA  13  -8.744   3.435 -13.092
   91   2HB   ALA  13          2HB       ALA  13  -9.369   3.493 -11.433
   92   3HB   ALA  13          3HB       ALA  13  -8.340   4.805 -12.044
   93    H    ALA  14           H        ALA  14  -5.748   5.068 -11.568
   94    HA   ALA  14           HA       ALA  14  -4.288   4.605 -13.998
   95   1HB   ALA  14          1HB       ALA  14  -4.431   6.818 -12.933
   96   2HB   ALA  14          2HB       ALA  14  -3.461   6.242 -11.561
   97   3HB   ALA  14          3HB       ALA  14  -2.743   6.314 -13.180
   98    H    ALA  15           H        ALA  15  -3.266   4.107 -10.585
   99    HA   ALA  15           HA       ALA  15  -0.786   3.102 -10.874
  100   1HB   ALA  15          1HB       ALA  15  -0.993   2.271  -8.703
  101   2HB   ALA  15          2HB       ALA  15  -2.176   3.576  -8.744
  102   3HB   ALA  15          3HB       ALA  15  -2.720   1.896  -8.870
  103    H    LEU  16           H        LEU  16  -3.793   1.299 -10.938
  104    HA   LEU  16           HA       LEU  16  -2.962  -1.319 -11.178
  105   1HB   LEU  16          2HB       LEU  16  -5.268  -0.903 -10.794
  106   2HB   LEU  16          3HB       LEU  16  -5.361   0.236 -12.135
  107    HG   LEU  16           HG       LEU  16  -5.228  -1.602 -13.780
  108   1HD1  LEU  16          1HD1      LEU  16  -4.069  -3.328 -12.372
  109   2HD1  LEU  16          2HD1      LEU  16  -5.515  -3.428 -11.347
  110   3HD1  LEU  16          3HD1      LEU  16  -5.593  -3.917 -13.052
  111   1HD2  LEU  16          1HD2      LEU  16  -7.512  -2.372 -13.431
  112   2HD2  LEU  16          2HD2      LEU  16  -7.457  -1.848 -11.734
  113   3HD2  LEU  16          3HD2      LEU  16  -7.365  -0.651 -13.043
  114    H    GLN  17           H        GLN  17  -3.211   1.220 -13.644
  115    HA   GLN  17           HA       GLN  17  -2.886  -0.696 -15.842
  116   1HB   GLN  17          2HB       GLN  17  -4.547   1.247 -15.677
  117   2HB   GLN  17          3HB       GLN  17  -3.204   2.316 -16.070
  118   1HG   GLN  17          2HG       GLN  17  -3.971  -0.124 -17.763
  119   2HG   GLN  17          3HG       GLN  17  -4.783   1.435 -17.929
  120   1HE2  GLN  17          1HE2      GLN  17  -3.869   0.843 -20.221
  121   2HE2  GLN  17          2HE2      GLN  17  -2.327   1.608 -20.566
  122    H    GLU  18           H        GLU  18  -1.178   2.097 -14.341
  123    HA   GLU  18           HA       GLU  18   0.990   2.056 -16.162
  124   1HB   GLU  18          2HB       GLU  18   1.929   3.725 -14.939
  125   2HB   GLU  18          3HB       GLU  18   0.244   3.868 -14.439
  126   1HG   GLU  18          2HG       GLU  18   0.835   2.618 -12.347
  127   2HG   GLU  18          3HG       GLU  18   2.531   2.627 -12.847
  128    H    CYS  19           H        CYS  19   0.553   0.400 -13.022
  129    HA   CYS  19           HA       CYS  19   2.997  -1.284 -13.485
  130   1HB   CYS  19          2HB       CYS  19   1.336  -0.651 -11.021
  131   2HB   CYS  19          3HB       CYS  19   2.590  -1.902 -11.097
  132    HG   CYS  19           HG       CYS  19   3.463   0.208  -9.871
  133    H    ARG  20           H        ARG  20   1.250  -2.098 -15.335
  134    HA   ARG  20           HA       ARG  20  -0.545  -4.110 -14.066
  135   1HB   ARG  20          2HB       ARG  20  -1.374  -2.463 -15.755
  136   2HB   ARG  20          3HB       ARG  20  -0.466  -3.323 -16.992
  137   1HG   ARG  20          2HG       ARG  20  -1.873  -5.196 -16.872
  138   2HG   ARG  20          3HG       ARG  20  -2.289  -4.919 -15.177
  139   1HD   ARG  20          2HD       ARG  20  -3.656  -2.989 -15.734
  140   2HD   ARG  20          3HD       ARG  20  -3.337  -3.183 -17.456
  141    HE   ARG  20           HE       ARG  20  -5.166  -4.658 -15.721
  142   1HH1  ARG  20          2HH2      ARG  20  -3.264  -4.952 -18.656
  143   2HH1  ARG  20          1HH2      ARG  20  -4.283  -6.134 -19.423
  144   1HH2  ARG  20          2HH1      ARG  20  -6.538  -6.276 -16.652
  145   2HH2  ARG  20          1HH1      ARG  20  -6.188  -6.924 -18.221
  146    H    ASP  21           H        ASP  21   2.608  -4.095 -15.136
  147    HA   ASP  21           HA       ASP  21   2.496  -6.762 -16.416
  148   1HB   ASP  21          2HB       ASP  21   4.439  -4.440 -16.414
  149   2HB   ASP  21          3HB       ASP  21   4.972  -6.045 -16.899
  150    HA   PRO  22           HA       PRO  22   4.037  -8.831 -12.924
  151   1HB   PRO  22          2HB       PRO  22   5.764 -10.730 -13.878
  152   2HB   PRO  22          3HB       PRO  22   3.994 -10.788 -14.113
  153   1HG   PRO  22          2HG       PRO  22   6.070  -9.714 -16.044
  154   2HG   PRO  22          3HG       PRO  22   4.755 -10.874 -16.395
  155   1HD   PRO  22          2HD       PRO  22   4.464  -8.244 -16.941
  156   2HD   PRO  22          3HD       PRO  22   3.100  -9.153 -16.234
  157    H    ASP  23           H        ASP  23   5.310  -8.063 -11.450
  158    HA   ASP  23           HA       ASP  23   7.003  -7.392 -10.219
  159   1HB   ASP  23          2HB       ASP  23   8.782  -8.685 -12.316
  160   2HB   ASP  23          3HB       ASP  23   9.335  -8.047 -10.768
  161    H    THR  24           H        THR  24   5.838  -5.455 -11.361
  162    HA   THR  24           HA       THR  24   7.950  -3.599 -12.453
  163    HB   THR  24           HB       THR  24   5.019  -3.183 -13.062
  164    HG1  THR  24           1HG      THR  24   5.313  -5.147 -13.839
  165   1HG2  THR  24          1HG2      THR  24   6.605  -1.344 -13.634
  166   2HG2  THR  24          2HG2      THR  24   7.590  -2.498 -14.562
  167   3HG2  THR  24          3HG2      THR  24   5.944  -2.108 -15.089
  168    H    PHE  25           H        PHE  25   5.669  -4.150  -9.907
  169    HA   PHE  25           HA       PHE  25   4.836  -1.544  -9.339
  170   1HB   PHE  25          2HB       PHE  25   3.882  -3.684  -8.526
  171   2HB   PHE  25          3HB       PHE  25   5.311  -3.964  -7.549
  172    HD1  PHE  25           1HD      PHE  25   1.983  -2.699  -7.536
  173    HD2  PHE  25           2HD      PHE  25   5.830  -2.240  -5.630
  174    HE1  PHE  25           1HE      PHE  25   0.914  -1.674  -5.554
  175    HE2  PHE  25           2HE      PHE  25   4.789  -0.979  -3.820
  176    HZ   PHE  25           HZ       PHE  25   2.303  -0.720  -3.741
  177    H    GLU  26           H        GLU  26   6.403   0.087  -9.127
  178    HA   GLU  26           HA       GLU  26   8.657  -0.315  -7.269
  179   1HB   GLU  26          2HB       GLU  26   7.996   1.705  -9.325
  180   2HB   GLU  26          3HB       GLU  26   8.437   2.408  -7.763
  181   1HG   GLU  26          2HG       GLU  26  10.496   0.765  -7.879
  182   2HG   GLU  26          3HG       GLU  26  10.146   0.810  -9.613
  183    HA   PRO  27           HA       PRO  27   6.147   0.932  -3.831
  184   1HB   PRO  27          2HB       PRO  27   8.050   1.906  -2.087
  185   2HB   PRO  27          3HB       PRO  27   7.784   0.178  -2.436
  186   1HG   PRO  27          2HG       PRO  27   9.948   1.954  -3.550
  187   2HG   PRO  27          3HG       PRO  27  10.035   0.242  -3.060
  188   1HD   PRO  27          2HD       PRO  27   9.785   1.041  -5.659
  189   2HD   PRO  27          3HD       PRO  27   9.174  -0.522  -5.035
  190    H    GLN  28           H        GLN  28   8.749   3.415  -4.153
  191    HA   GLN  28           HA       GLN  28   7.171   5.551  -3.318
  192   1HB   GLN  28          2HB       GLN  28   9.677   5.436  -5.007
  193   2HB   GLN  28          3HB       GLN  28   8.925   6.971  -4.536
  194   1HG   GLN  28          2HG       GLN  28   9.152   6.487  -2.179
  195   2HG   GLN  28          3HG       GLN  28   9.664   4.826  -2.503
  196   1HE2  GLN  28          1HE2      GLN  28  10.665   8.267  -2.939
  197   2HE2  GLN  28          2HE2      GLN  28  12.377   7.885  -2.982
  198    H    LYS  29           H        LYS  29   7.760   4.327  -6.607
  199    HA   LYS  29           HA       LYS  29   6.287   6.185  -8.101
  200   1HB   LYS  29          2HB       LYS  29   7.691   4.227  -8.959
  201   2HB   LYS  29          3HB       LYS  29   6.321   3.176  -8.576
  202   1HG   LYS  29          2HG       LYS  29   5.875   3.589 -10.784
  203   2HG   LYS  29          3HG       LYS  29   4.964   4.909 -10.065
  204   1HD   LYS  29          2HD       LYS  29   7.318   6.218 -10.334
  205   2HD   LYS  29          3HD       LYS  29   7.693   4.884 -11.418
  206   1HE   LYS  29          2HE       LYS  29   6.821   6.677 -12.770
  207   2HE   LYS  29          3HE       LYS  29   5.588   5.402 -12.732
  208   1HZ   LYS  29          1HZ       LYS  29   4.673   7.602 -12.405
  209   2HZ   LYS  29          2HZ       LYS  29   4.353   6.621 -11.151
  210   3HZ   LYS  29          3HZ       LYS  29   5.536   7.790 -11.015
  211    H    PHE  30           H        PHE  30   5.024   2.974  -6.956
  212    HA   PHE  30           HA       PHE  30   2.361   3.484  -7.677
  213   1HB   PHE  30          2HB       PHE  30   3.376   1.259  -7.141
  214   2HB   PHE  30          3HB       PHE  30   3.364   1.685  -5.438
  215    HD1  PHE  30           1HD      PHE  30   1.131   2.020  -4.250
  216    HD2  PHE  30           2HD      PHE  30   1.386   0.522  -8.291
  217    HE1  PHE  30           1HE      PHE  30  -1.237   1.309  -4.144
  218    HE2  PHE  30           2HE      PHE  30  -0.933  -0.327  -8.116
  219    HZ   PHE  30           HZ       PHE  30  -2.280   0.155  -6.089
  220    H    PHE  31           H        PHE  31   4.098   4.229  -4.731
  221    HA   PHE  31           HA       PHE  31   2.006   4.922  -2.962
  222   1HB   PHE  31          2HB       PHE  31   4.076   4.660  -1.953
  223   2HB   PHE  31          3HB       PHE  31   4.931   5.421  -3.276
  224    HD1  PHE  31           1HD      PHE  31   2.257   6.631  -0.965
  225    HD2  PHE  31           2HD      PHE  31   6.060   7.383  -2.864
  226    HE1  PHE  31           1HE      PHE  31   2.379   8.884   0.035
  227    HE2  PHE  31           2HE      PHE  31   6.232   9.531  -1.681
  228    HZ   PHE  31           HZ       PHE  31   4.456  10.207  -0.089
  229    H    GLN  32           H        GLN  32   4.022   7.071  -5.104
  230    HA   GLN  32           HA       GLN  32   2.448   9.407  -4.477
  231   1HB   GLN  32          2HB       GLN  32   4.277   8.736  -6.833
  232   2HB   GLN  32          3HB       GLN  32   3.431  10.285  -6.649
  233   1HG   GLN  32          2HG       GLN  32   4.486  10.555  -4.397
  234   2HG   GLN  32          3HG       GLN  32   5.449   9.103  -4.720
  235   1HE2  GLN  32          1HE2      GLN  32   4.774  12.448  -5.795
  236   2HE2  GLN  32          2HE2      GLN  32   6.300  12.658  -6.642
  237    H    THR  33           H        THR  33   2.387   6.975  -7.110
  238    HA   THR  33           HA       THR  33   0.418   8.245  -8.558
  239    HB   THR  33           HB       THR  33   2.081   5.892  -8.702
  240    HG1  THR  33           1HG      THR  33   0.567   6.370 -10.722
  241   1HG2  THR  33          1HG2      THR  33   0.088   4.497  -8.087
  242   2HG2  THR  33          2HG2      THR  33  -0.725   5.183  -9.523
  243   3HG2  THR  33          3HG2      THR  33   0.771   4.233  -9.687
  244    H    SER  34           H        SER  34   0.145   6.038  -5.850
  245    HA   SER  34           HA       SER  34  -2.658   5.545  -6.157
  246   1HB   SER  34          2HB       SER  34  -1.202   4.021  -4.916
  247   2HB   SER  34          3HB       SER  34  -0.854   5.291  -3.723
  248    HG   SER  34           HG       SER  34  -3.273   5.326  -3.508
  249    H    GLY  35           H        GLY  35  -0.951   8.389  -5.529
  250   1HA   GLY  35          1HA       GLY  35  -1.726  10.475  -4.970
  251   2HA   GLY  35          2HA       GLY  35  -3.324   9.805  -4.609
  252    H    LEU  36           H        LEU  36  -0.879   8.033  -3.000
  253    HA   LEU  36           HA       LEU  36  -2.070   8.850  -0.544
  254   1HB   LEU  36          2HB       LEU  36  -0.272   6.701  -1.477
  255   2HB   LEU  36          3HB       LEU  36   0.063   7.200   0.169
  256    HG   LEU  36           HG       LEU  36  -2.729   6.549  -0.808
  257   1HD1  LEU  36          1HD1      LEU  36  -2.448   4.377   0.380
  258   2HD1  LEU  36          2HD1      LEU  36  -1.358   4.529  -1.012
  259   3HD1  LEU  36          3HD1      LEU  36  -0.729   4.753   0.636
  260   1HD2  LEU  36          1HD2      LEU  36  -1.843   6.346   2.073
  261   2HD2  LEU  36          2HD2      LEU  36  -2.160   7.955   1.427
  262   3HD2  LEU  36          3HD2      LEU  36  -3.430   6.739   1.377
  263    H    SER  37           H        SER  37   0.808   9.881  -2.240
  264    HA   SER  37           HA       SER  37   2.132  11.266  -0.061
  265   1HB   SER  37          2HB       SER  37   3.103  12.545  -2.018
  266   2HB   SER  37          3HB       SER  37   3.245  10.804  -2.231
  267    HG   SER  37           HG       SER  37   1.213  12.397  -3.391
  268    H    LYS  38           H        LYS  38  -0.813  11.841  -1.898
  269    HA   LYS  38           HA       LYS  38  -0.772  14.747  -1.323
  270   1HB   LYS  38          2HB       LYS  38  -1.743  13.232  -3.538
  271   2HB   LYS  38          3HB       LYS  38  -3.173  13.698  -2.624
  272   1HG   LYS  38          2HG       LYS  38  -2.836  15.468  -4.131
  273   2HG   LYS  38          3HG       LYS  38  -2.230  16.085  -2.587
  274   1HD   LYS  38          2HD       LYS  38   0.117  15.355  -3.358
  275   2HD   LYS  38          3HD       LYS  38  -0.617  14.952  -4.923
  276   1HE   LYS  38          2HE       LYS  38  -1.433  17.369  -5.059
  277   2HE   LYS  38          3HE       LYS  38  -0.511  17.705  -3.584
  278   1HZ   LYS  38          1HZ       LYS  38   0.605  16.782  -6.152
  279   2HZ   LYS  38          2HZ       LYS  38   0.724  18.297  -5.526
  280   3HZ   LYS  38          3HZ       LYS  38   1.483  17.044  -4.783
  281    H    MET  39           H        MET  39  -2.327  11.620  -0.494
  282    HA   MET  39           HA       MET  39  -4.315  12.821   1.200
  283   1HB   MET  39          2HB       MET  39  -2.953  10.131   1.113
  284   2HB   MET  39          3HB       MET  39  -3.924  10.562   2.507
  285   1HG   MET  39          2HG       MET  39  -5.829  11.143   1.030
  286   2HG   MET  39          3HG       MET  39  -4.901  10.574  -0.369
  287   1HE   MET  39          1HE       MET  39  -7.907   9.724   0.847
  288   2HE   MET  39          2HE       MET  39  -7.245   9.363  -0.762
  289   3HE   MET  39          3HE       MET  39  -7.873   8.044   0.261
  290    H    SER  40           H        SER  40  -4.248  13.790   3.168
  291    HA   SER  40           HA       SER  40  -1.682  14.519   4.279
  292   1HB   SER  40          2HB       SER  40  -2.912  15.716   5.956
  293   2HB   SER  40          3HB       SER  40  -3.697  15.995   4.402
  294    HG   SER  40           HG       SER  40  -5.329  14.588   5.009
  295    H    ALA  41           H        ALA  41  -0.934  14.011   6.457
  296    HA   ALA  41           HA       ALA  41  -0.611  11.418   7.188
  297   1HB   ALA  41          1HB       ALA  41   0.608  13.275   8.194
  298   2HB   ALA  41          2HB       ALA  41  -0.860  13.823   9.038
  299   3HB   ALA  41          3HB       ALA  41  -0.117  12.271   9.467
  300    H    ASN  42           H        ASN  42  -3.379  13.434   8.046
  301    HA   ASN  42           HA       ASN  42  -4.677  11.761   9.939
  302   1HB   ASN  42          2HB       ASN  42  -6.153  13.465   7.884
  303   2HB   ASN  42          3HB       ASN  42  -6.642  13.027   9.517
  304   1HD2  ASN  42          1HD2      ASN  42  -4.802  15.233   7.499
  305   2HD2  ASN  42          2HD2      ASN  42  -4.315  16.302   8.814
  306    H    GLN  43           H        GLN  43  -5.182  12.104   6.403
  307    HA   GLN  43           HA       GLN  43  -7.028   9.912   6.192
  308   1HB   GLN  43          2HB       GLN  43  -5.377  11.511   4.193
  309   2HB   GLN  43          3HB       GLN  43  -6.312  10.109   3.687
  310   1HG   GLN  43          2HG       GLN  43  -7.435  12.591   5.053
  311   2HG   GLN  43          3HG       GLN  43  -7.573  12.195   3.334
  312   1HE2  GLN  43          1HE2      GLN  43  -8.237   9.419   3.440
  313   2HE2  GLN  43          2HE2      GLN  43  -9.776   9.273   4.262
  314    H    VAL  44           H        VAL  44  -3.444  10.189   5.693
  315    HA   VAL  44           HA       VAL  44  -3.110   7.610   4.601
  316    HB   VAL  44           HB       VAL  44  -1.335   9.378   6.359
  317   1HG1  VAL  44          1HG1      VAL  44  -0.402   7.152   6.465
  318   2HG1  VAL  44          2HG1      VAL  44  -0.659   6.925   4.722
  319   3HG1  VAL  44          3HG1      VAL  44   0.539   8.109   5.312
  320   1HG2  VAL  44          1HG2      VAL  44  -2.098  10.345   4.123
  321   2HG2  VAL  44          2HG2      VAL  44  -0.360  10.157   4.283
  322   3HG2  VAL  44          3HG2      VAL  44  -1.318   8.994   3.335
  323    H    LYS  45           H        LYS  45  -3.089   8.738   8.034
  324    HA   LYS  45           HA       LYS  45  -2.591   6.070   8.998
  325   1HB   LYS  45          2HB       LYS  45  -1.867   8.056  10.075
  326   2HB   LYS  45          3HB       LYS  45  -3.551   8.501  10.502
  327   1HG   LYS  45          2HG       LYS  45  -3.719   6.704  12.045
  328   2HG   LYS  45          3HG       LYS  45  -2.423   5.789  11.273
  329   1HD   LYS  45          2HD       LYS  45  -1.765   6.695  13.463
  330   2HD   LYS  45          3HD       LYS  45  -0.696   7.177  12.153
  331   1HE   LYS  45          2HE       LYS  45  -2.935   8.961  13.247
  332   2HE   LYS  45          3HE       LYS  45  -1.280   8.959  13.872
  333   1HZ   LYS  45          1HZ       LYS  45  -2.105   9.754  11.163
  334   2HZ   LYS  45          2HZ       LYS  45  -1.404  10.678  12.323
  335   3HZ   LYS  45          3HZ       LYS  45  -0.548   9.486  11.561
  336    H    ASP  46           H        ASP  46  -5.583   7.928   8.295
  337    HA   ASP  46           HA       ASP  46  -7.374   6.038   9.498
  338   1HB   ASP  46          2HB       ASP  46  -8.132   8.248   8.771
  339   2HB   ASP  46          3HB       ASP  46  -7.811   7.830   7.078
  340    H    VAL  47           H        VAL  47  -6.347   6.343   6.049
  341    HA   VAL  47           HA       VAL  47  -7.533   3.996   5.174
  342    HB   VAL  47           HB       VAL  47  -6.151   4.014   3.247
  343   1HG1  VAL  47          1HG1      VAL  47  -6.401   6.963   3.774
  344   2HG1  VAL  47          2HG1      VAL  47  -6.768   6.044   2.328
  345   3HG1  VAL  47          3HG1      VAL  47  -7.852   5.962   3.738
  346   1HG2  VAL  47          1HG2      VAL  47  -4.281   5.365   2.820
  347   2HG2  VAL  47          2HG2      VAL  47  -4.319   5.951   4.489
  348   3HG2  VAL  47          3HG2      VAL  47  -3.923   4.251   4.137
  349    H    PHE  48           H        PHE  48  -4.230   4.357   6.545
  350    HA   PHE  48           HA       PHE  48  -3.299   1.745   6.525
  351   1HB   PHE  48          2HB       PHE  48  -1.909   3.327   7.482
  352   2HB   PHE  48          3HB       PHE  48  -3.165   3.970   8.509
  353    HD1  PHE  48           1HD      PHE  48  -0.838   1.072   8.139
  354    HD2  PHE  48           2HD      PHE  48  -3.458   3.278  10.740
  355    HE1  PHE  48           1HE      PHE  48  -0.343  -0.496  10.035
  356    HE2  PHE  48           2HE      PHE  48  -3.185   1.543  12.501
  357    HZ   PHE  48           HZ       PHE  48  -1.698  -0.406  12.081
  358    H    ARG  49           H        ARG  49  -5.762   3.042   8.837
  359    HA   ARG  49           HA       ARG  49  -6.037   0.531  10.265
  360   1HB   ARG  49          2HB       ARG  49  -7.923   2.917  10.092
  361   2HB   ARG  49          3HB       ARG  49  -8.054   1.577  11.236
  362   1HG   ARG  49          2HG       ARG  49  -5.947   2.153  12.289
  363   2HG   ARG  49          3HG       ARG  49  -5.602   3.344  11.040
  364   1HD   ARG  49          2HD       ARG  49  -6.322   4.658  12.859
  365   2HD   ARG  49          3HD       ARG  49  -7.603   4.659  11.666
  366    HE   ARG  49           HE       ARG  49  -9.014   3.608  13.123
  367   1HH1  ARG  49          2HH2      ARG  49  -5.726   3.094  14.225
  368   2HH1  ARG  49          1HH2      ARG  49  -6.144   2.539  15.819
  369   1HH2  ARG  49          2HH1      ARG  49  -9.644   2.875  15.235
  370   2HH2  ARG  49          1HH1      ARG  49  -8.447   2.399  16.392
  371    H    PHE  50           H        PHE  50  -7.531   1.982   7.400
  372    HA   PHE  50           HA       PHE  50  -9.738   0.139   7.210
  373   1HB   PHE  50          2HB       PHE  50  -9.341   2.403   5.959
  374   2HB   PHE  50          3HB       PHE  50  -8.432   1.446   4.798
  375    HD1  PHE  50           1HD      PHE  50  -9.605  -0.147   3.298
  376    HD2  PHE  50           2HD      PHE  50 -11.755   2.095   6.293
  377    HE1  PHE  50           1HE      PHE  50 -11.745  -0.852   2.286
  378    HE2  PHE  50           2HE      PHE  50 -13.899   1.392   5.263
  379    HZ   PHE  50           HZ       PHE  50 -13.903  -0.091   3.280
  380    H    ILE  51           H        ILE  51  -6.356   0.141   6.064
  381    HA   ILE  51           HA       ILE  51  -6.781  -2.342   4.598
  382    HB   ILE  51           HB       ILE  51  -4.168  -0.889   5.028
  383   1HG1  ILE  51          2HG1      ILE  51  -5.599   0.702   3.926
  384   2HG1  ILE  51          3HG1      ILE  51  -4.521   0.021   2.740
  385   1HG2  ILE  51          1HG2      ILE  51  -3.792  -2.120   2.763
  386   2HG2  ILE  51          2HG2      ILE  51  -3.744  -3.110   4.234
  387   3HG2  ILE  51          3HG2      ILE  51  -5.178  -3.108   3.189
  388   1HD1  ILE  51          1HD1      ILE  51  -7.447  -0.738   3.154
  389   2HD1  ILE  51          2HD1      ILE  51  -6.795   0.265   1.860
  390   3HD1  ILE  51          3HD1      ILE  51  -6.374  -1.461   1.940
  391    H    ASP  52           H        ASP  52  -4.890  -1.567   7.615
  392    HA   ASP  52           HA       ASP  52  -4.322  -4.436   8.029
  393   1HB   ASP  52          2HB       ASP  52  -2.867  -2.560   8.922
  394   2HB   ASP  52          3HB       ASP  52  -4.126  -2.214  10.101
  395    H    ASN  53           H        ASN  53  -6.570  -4.880   7.481
  396    HA   ASN  53           HA       ASN  53  -8.893  -4.047   8.780
  397   1HB   ASN  53          2HB       ASN  53  -8.960  -5.219   6.704
  398   2HB   ASN  53          3HB       ASN  53  -8.118  -6.625   7.370
  399   1HD2  ASN  53          1HD2      ASN  53  -9.283  -8.197   8.583
  400   2HD2  ASN  53          2HD2      ASN  53 -11.037  -8.169   8.627
  401    H    ASP  54           H        ASP  54  -6.594  -6.528   9.712
  402    HA   ASP  54           HA       ASP  54  -7.977  -7.787  11.884
  403   1HB   ASP  54          2HB       ASP  54  -5.615  -8.474  12.439
  404   2HB   ASP  54          3HB       ASP  54  -6.114  -8.872  10.791
  405    H    GLN  55           H        GLN  55  -6.302  -4.737  11.465
  406    HA   GLN  55           HA       GLN  55  -5.489  -3.183  12.805
  407   1HB   GLN  55          2HB       GLN  55  -8.152  -3.799  14.064
  408   2HB   GLN  55          3HB       GLN  55  -7.057  -2.682  14.897
  409   1HG   GLN  55          2HG       GLN  55  -6.802  -1.330  12.841
  410   2HG   GLN  55          3HG       GLN  55  -7.967  -2.371  12.010
  411   1HE2  GLN  55          1HE2      GLN  55 -10.162  -2.560  13.154
  412   2HE2  GLN  55          2HE2      GLN  55 -10.796  -1.090  13.875
  413    H    SER  56           H        SER  56  -3.901  -4.892  12.914
  414    HA   SER  56           HA       SER  56  -3.250  -5.922  15.625
  415   1HB   SER  56          2HB       SER  56  -1.219  -6.773  14.513
  416   2HB   SER  56          3HB       SER  56  -2.698  -7.319  13.718
  417    HG   SER  56           HG       SER  56  -2.235  -5.189  12.403
  418    H    GLY  57           H        GLY  57  -2.266  -3.455  13.225
  419   1HA   GLY  57          1HA       GLY  57  -1.339  -1.305  14.154
  420   2HA   GLY  57          2HA       GLY  57  -0.359  -2.271  15.252
  421    H    TYR  58           H        TYR  58  -0.008  -4.381  13.023
  422    HA   TYR  58           HA       TYR  58   2.132  -2.944  11.521
  423   1HB   TYR  58          2HB       TYR  58   2.211  -5.604  12.959
  424   2HB   TYR  58          3HB       TYR  58   3.255  -5.263  11.592
  425    HD1  TYR  58           HD1      TYR  58   2.407  -4.040  15.035
  426    HD2  TYR  58           HD2      TYR  58   5.240  -4.009  11.795
  427    HE1  TYR  58           HE1      TYR  58   4.046  -2.866  16.473
  428    HE2  TYR  58           HE2      TYR  58   6.860  -2.783  13.215
  429    HH   TYR  58           HH       TYR  58   6.149  -1.899  16.597
  430    H    LEU  59           H        LEU  59   2.288  -3.327   9.381
  431    HA   LEU  59           HA       LEU  59   0.295  -5.154   8.108
  432   1HB   LEU  59          2HB       LEU  59   2.233  -3.102   7.002
  433   2HB   LEU  59          3HB       LEU  59   1.458  -4.329   6.001
  434    HG   LEU  59           HG       LEU  59   0.317  -2.192   5.863
  435   1HD1  LEU  59          1HD1      LEU  59  -0.969  -4.285   5.493
  436   2HD1  LEU  59          2HD1      LEU  59  -1.491  -4.254   7.197
  437   3HD1  LEU  59          3HD1      LEU  59  -1.963  -2.952   6.106
  438   1HD2  LEU  59          1HD2      LEU  59  -0.491  -2.576   8.766
  439   2HD2  LEU  59          2HD2      LEU  59   0.728  -1.412   8.178
  440   3HD2  LEU  59          3HD2      LEU  59  -0.974  -1.275   7.669
  441    H    ASP  60           H        ASP  60   1.269  -6.846   9.384
  442    HA   ASP  60           HA       ASP  60   3.775  -8.002   8.929
  443   1HB   ASP  60          2HB       ASP  60   1.288  -9.712   9.091
  444   2HB   ASP  60          3HB       ASP  60   2.863  -9.935   9.869
  445    H    GLU  61           H        GLU  61   4.383  -9.802   7.445
  446    HA   GLU  61           HA       GLU  61   4.080  -9.251   4.783
  447   1HB   GLU  61          2HB       GLU  61   4.837 -11.817   6.229
  448   2HB   GLU  61          3HB       GLU  61   4.659 -11.807   4.472
  449   1HG   GLU  61          2HG       GLU  61   6.180  -9.934   4.255
  450   2HG   GLU  61          3HG       GLU  61   6.465  -9.899   6.014
  451    H    GLU  62           H        GLU  62   2.190 -11.891   6.369
  452    HA   GLU  62           HA       GLU  62   0.488 -12.320   4.241
  453   1HB   GLU  62          2HB       GLU  62   0.461 -12.780   7.214
  454   2HB   GLU  62          3HB       GLU  62  -1.155 -12.692   6.525
  455   1HG   GLU  62          2HG       GLU  62  -0.219 -15.006   6.655
  456   2HG   GLU  62          3HG       GLU  62  -0.748 -14.507   5.044
  457    H    GLU  63           H        GLU  63   0.175  -9.512   6.459
  458    HA   GLU  63           HA       GLU  63  -2.515  -8.962   5.433
  459   1HB   GLU  63          2HB       GLU  63  -0.598  -7.530   7.223
  460   2HB   GLU  63          3HB       GLU  63  -1.596  -6.508   6.174
  461   1HG   GLU  63          2HG       GLU  63  -2.859  -6.817   8.163
  462   2HG   GLU  63          3HG       GLU  63  -3.651  -7.747   6.913
  463    H    LEU  64           H        LEU  64   0.820  -8.215   4.511
  464    HA   LEU  64           HA       LEU  64  -0.036  -6.665   2.165
  465   1HB   LEU  64          2HB       LEU  64   2.663  -7.919   2.737
  466   2HB   LEU  64          3HB       LEU  64   2.281  -6.697   1.521
  467    HG   LEU  64           HG       LEU  64   2.082  -6.258   4.531
  468   1HD1  LEU  64          1HD1      LEU  64   4.095  -4.920   4.229
  469   2HD1  LEU  64          2HD1      LEU  64   4.381  -6.594   3.717
  470   3HD1  LEU  64          3HD1      LEU  64   4.140  -5.321   2.496
  471   1HD2  LEU  64          1HD2      LEU  64   1.734  -4.397   2.126
  472   2HD2  LEU  64          2HD2      LEU  64   0.524  -4.775   3.374
  473   3HD2  LEU  64          3HD2      LEU  64   1.961  -3.828   3.787
  474    H    LYS  65           H        LYS  65  -0.786  -9.788   2.763
  475    HA   LYS  65           HA       LYS  65  -0.433 -10.538  -0.096
  476   1HB   LYS  65          2HB       LYS  65   0.032 -12.146   1.829
  477   2HB   LYS  65          3HB       LYS  65  -1.720 -12.132   2.128
  478   1HG   LYS  65          2HG       LYS  65  -2.201 -13.200   0.065
  479   2HG   LYS  65          3HG       LYS  65  -0.604 -12.816  -0.598
  480   1HD   LYS  65          2HD       LYS  65  -0.656 -15.172  -0.012
  481   2HD   LYS  65          3HD       LYS  65   0.490 -14.300   1.014
  482   1HE   LYS  65          2HE       LYS  65  -1.361 -14.192   2.801
  483   2HE   LYS  65          3HE       LYS  65  -2.298 -15.294   1.781
  484   1HZ   LYS  65          1HZ       LYS  65   0.346 -15.766   3.028
  485   2HZ   LYS  65          2HZ       LYS  65  -1.048 -16.440   3.480
  486   3HZ   LYS  65          3HZ       LYS  65  -0.387 -16.851   2.021
  487    H    PHE  66           H        PHE  66  -2.398  -8.579   1.807
  488    HA   PHE  66           HA       PHE  66  -4.587  -8.809  -0.133
  489   1HB   PHE  66          2HB       PHE  66  -4.970  -8.959   2.894
  490   2HB   PHE  66          3HB       PHE  66  -6.271  -8.843   1.719
  491    HD1  PHE  66           1HD      PHE  66  -3.919 -11.101   3.374
  492    HD2  PHE  66           2HD      PHE  66  -6.862 -10.756   0.236
  493    HE1  PHE  66           1HE      PHE  66  -4.123 -13.562   3.288
  494    HE2  PHE  66           2HE      PHE  66  -7.035 -13.221   0.129
  495    HZ   PHE  66           HZ       PHE  66  -5.668 -14.634   1.649
  496    H    PHE  67           H        PHE  67  -2.515  -6.730   0.325
  497    HA   PHE  67           HA       PHE  67  -3.632  -4.600   1.921
  498   1HB   PHE  67          2HB       PHE  67  -1.311  -4.698   1.641
  499   2HB   PHE  67          3HB       PHE  67  -1.387  -4.793  -0.087
  500    HD1  PHE  67           1HD      PHE  67  -1.207  -2.965  -1.477
  501    HD2  PHE  67           2HD      PHE  67  -1.515  -2.457   2.763
  502    HE1  PHE  67           1HE      PHE  67  -0.943  -0.514  -1.770
  503    HE2  PHE  67           2HE      PHE  67  -1.233  -0.008   2.501
  504    HZ   PHE  67           HZ       PHE  67  -0.982   0.980   0.222
  505    H    LEU  68           H        LEU  68  -3.196  -4.524  -1.700
  506    HA   LEU  68           HA       LEU  68  -5.328  -2.667  -2.036
  507   1HB   LEU  68          2HB       LEU  68  -3.888  -4.484  -3.954
  508   2HB   LEU  68          3HB       LEU  68  -5.121  -3.320  -4.479
  509    HG   LEU  68           HG       LEU  68  -2.834  -2.366  -2.787
  510   1HD1  LEU  68          1HD1      LEU  68  -1.465  -1.951  -4.733
  511   2HD1  LEU  68          2HD1      LEU  68  -1.820  -3.678  -4.646
  512   3HD1  LEU  68          3HD1      LEU  68  -2.696  -2.657  -5.809
  513   1HD2  LEU  68          1HD2      LEU  68  -4.747  -0.849  -3.268
  514   2HD2  LEU  68          2HD2      LEU  68  -3.220  -0.260  -3.917
  515   3HD2  LEU  68          3HD2      LEU  68  -4.415  -1.010  -5.001
  516    H    GLN  69           H        GLN  69  -5.524  -6.081  -1.505
  517    HA   GLN  69           HA       GLN  69  -7.896  -6.644  -2.973
  518   1HB   GLN  69          2HB       GLN  69  -6.853  -7.798  -0.378
  519   2HB   GLN  69          3HB       GLN  69  -8.276  -8.429  -1.203
  520   1HG   GLN  69          2HG       GLN  69  -5.573  -8.192  -2.576
  521   2HG   GLN  69          3HG       GLN  69  -6.068  -9.643  -1.698
  522   1HE2  GLN  69          1HE2      GLN  69  -5.366  -9.302  -4.608
  523   2HE2  GLN  69          2HE2      GLN  69  -6.769  -9.967  -5.386
  524    H    LYS  70           H        LYS  70  -7.450  -4.887   0.116
  525    HA   LYS  70           HA       LYS  70 -10.393  -4.742   0.495
  526   1HB   LYS  70          2HB       LYS  70  -8.086  -3.559   2.083
  527   2HB   LYS  70          3HB       LYS  70  -9.790  -3.206   2.363
  528   1HG   LYS  70          2HG       LYS  70  -9.407  -4.830   3.909
  529   2HG   LYS  70          3HG       LYS  70 -10.194  -5.719   2.597
  530   1HD   LYS  70          2HD       LYS  70  -7.908  -6.512   1.846
  531   2HD   LYS  70          3HD       LYS  70  -7.183  -5.525   3.118
  532   1HE   LYS  70          2HE       LYS  70  -7.167  -7.714   3.977
  533   2HE   LYS  70          3HE       LYS  70  -8.481  -6.893   4.823
  534   1HZ   LYS  70          1HZ       LYS  70  -8.769  -8.738   2.537
  535   2HZ   LYS  70          2HZ       LYS  70  -9.130  -9.070   4.103
  536   3HZ   LYS  70          3HZ       LYS  70 -10.018  -7.959   3.276
  537    H    PHE  71           H        PHE  71  -8.081  -3.068  -1.421
  538    HA   PHE  71           HA       PHE  71  -9.567  -0.520  -1.370
  539   1HB   PHE  71          2HB       PHE  71  -7.311  -1.563  -3.134
  540   2HB   PHE  71          3HB       PHE  71  -8.251  -0.154  -3.525
  541    HD1  PHE  71           1HD      PHE  71  -7.267   1.884  -3.084
  542    HD2  PHE  71           2HD      PHE  71  -6.390  -1.427  -0.465
  543    HE1  PHE  71           1HE      PHE  71  -5.298   3.096  -2.217
  544    HE2  PHE  71           2HE      PHE  71  -4.378  -0.237   0.349
  545    HZ   PHE  71           HZ       PHE  71  -3.847   2.044  -0.496
  546    H    GLU  72           H        GLU  72  -8.975  -3.250  -3.597
  547    HA   GLU  72           HA       GLU  72 -11.441  -2.489  -5.131
  548   1HB   GLU  72          2HB       GLU  72  -9.269  -2.011  -6.240
  549   2HB   GLU  72          3HB       GLU  72  -8.848  -3.725  -6.160
  550   1HG   GLU  72          2HG       GLU  72  -9.693  -3.200  -8.368
  551   2HG   GLU  72          3HG       GLU  72 -10.884  -4.230  -7.566
  552    H    SER  73           H        SER  73  -9.281  -5.317  -4.725
  553    HA   SER  73           HA       SER  73  -9.880  -7.430  -3.943
  554   1HB   SER  73          2HB       SER  73 -12.265  -6.894  -3.472
  555   2HB   SER  73          3HB       SER  73 -12.626  -7.157  -5.197
  556    HG   SER  73           HG       SER  73 -11.916  -9.285  -4.950
  557    H    GLY  74           H        GLY  74  -8.741  -8.698  -5.157
  558   1HA   GLY  74          1HA       GLY  74  -8.110  -9.998  -7.029
  559   2HA   GLY  74          2HA       GLY  74  -9.182  -9.061  -8.073
  560    H    ALA  75           H        ALA  75  -6.940  -7.479  -5.866
  561    HA   ALA  75           HA       ALA  75  -5.461  -6.279  -8.129
  562   1HB   ALA  75          1HB       ALA  75  -4.541  -4.811  -6.369
  563   2HB   ALA  75          2HB       ALA  75  -6.314  -4.818  -6.355
  564   3HB   ALA  75          3HB       ALA  75  -5.419  -5.759  -5.140
  565    H    ARG  76           H        ARG  76  -3.074  -5.963  -7.587
  566    HA   ARG  76           HA       ARG  76  -1.828  -8.276  -8.295
  567   1HB   ARG  76          2HB       ARG  76  -1.151  -5.754  -8.453
  568   2HB   ARG  76          3HB       ARG  76  -0.361  -6.029  -6.904
  569   1HG   ARG  76          2HG       ARG  76   1.355  -6.344  -8.399
  570   2HG   ARG  76          3HG       ARG  76   0.906  -7.997  -8.100
  571   1HD   ARG  76          2HD       ARG  76   0.320  -8.387 -10.230
  572   2HD   ARG  76          3HD       ARG  76  -0.642  -6.922 -10.382
  573    HE   ARG  76           HE       ARG  76   2.226  -7.284 -11.028
  574   1HH1  ARG  76          2HH2      ARG  76  -0.026  -4.902  -9.860
  575   2HH1  ARG  76          1HH2      ARG  76   0.641  -3.623 -10.848
  576   1HH2  ARG  76          2HH1      ARG  76   3.322  -5.626 -11.996
  577   2HH2  ARG  76          1HH1      ARG  76   2.900  -3.960 -11.641
  578    H    GLU  77           H        GLU  77  -2.592  -7.586  -5.043
  579    HA   GLU  77           HA       GLU  77  -0.557  -8.128  -3.391
  580   1HB   GLU  77          2HB       GLU  77  -3.359  -9.375  -3.206
  581   2HB   GLU  77          3HB       GLU  77  -2.201  -9.140  -1.893
  582   1HG   GLU  77          2HG       GLU  77  -3.522  -6.855  -3.450
  583   2HG   GLU  77          3HG       GLU  77  -3.832  -7.368  -1.789
  584    H    LEU  78           H        LEU  78  -2.320 -10.638  -5.091
  585    HA   LEU  78           HA       LEU  78  -1.232 -12.938  -3.972
  586   1HB   LEU  78          2HB       LEU  78  -1.757 -12.588  -6.949
  587   2HB   LEU  78          3HB       LEU  78  -1.688 -14.083  -6.028
  588    HG   LEU  78           HG       LEU  78  -3.921 -13.828  -6.312
  589   1HD1  LEU  78          1HD1      LEU  78  -3.443 -14.109  -3.881
  590   2HD1  LEU  78          2HD1      LEU  78  -3.575 -12.349  -3.656
  591   3HD1  LEU  78          3HD1      LEU  78  -4.981 -13.279  -4.188
  592   1HD2  LEU  78          1HD2      LEU  78  -5.231 -11.932  -6.464
  593   2HD2  LEU  78          2HD2      LEU  78  -4.119 -10.932  -5.536
  594   3HD2  LEU  78          3HD2      LEU  78  -3.711 -11.400  -7.202
  595    H    THR  79           H        THR  79   0.378 -10.827  -6.433
  596    HA   THR  79           HA       THR  79   2.568 -12.687  -6.782
  597    HB   THR  79           HB       THR  79   2.534  -9.723  -7.377
  598    HG1  THR  79           1HG      THR  79   2.384 -10.903  -9.535
  599   1HG2  THR  79          1HG2      THR  79   4.345 -10.432  -9.028
  600   2HG2  THR  79          2HG2      THR  79   4.814 -10.815  -7.374
  601   3HG2  THR  79          3HG2      THR  79   4.201 -12.087  -8.432
  602    H    GLU  80           H        GLU  80   3.833 -13.145  -5.197
  603    HA   GLU  80           HA       GLU  80   4.198 -11.656  -2.817
  604   1HB   GLU  80          2HB       GLU  80   6.097 -13.762  -3.928
  605   2HB   GLU  80          3HB       GLU  80   5.923 -13.192  -2.258
  606   1HG   GLU  80          2HG       GLU  80   4.676 -15.120  -2.144
  607   2HG   GLU  80          3HG       GLU  80   3.397 -13.968  -2.538
  608    H    SER  81           H        SER  81   6.267 -11.835  -5.791
  609    HA   SER  81           HA       SER  81   8.371 -10.249  -5.021
  610   1HB   SER  81          2HB       SER  81   7.016 -10.022  -7.725
  611   2HB   SER  81          3HB       SER  81   8.739  -9.907  -7.368
  612    HG   SER  81           HG       SER  81   8.059 -11.919  -8.253
  613    H    GLU  82           H        GLU  82   5.294  -9.061  -6.516
  614    HA   GLU  82           HA       GLU  82   6.122  -6.333  -6.540
  615   1HB   GLU  82          2HB       GLU  82   3.287  -7.391  -6.638
  616   2HB   GLU  82          3HB       GLU  82   3.873  -5.868  -7.295
  617   1HG   GLU  82          2HG       GLU  82   5.346  -8.173  -8.474
  618   2HG   GLU  82          3HG       GLU  82   3.596  -8.333  -8.622
  619    H    THR  83           H        THR  83   4.184  -8.335  -4.312
  620    HA   THR  83           HA       THR  83   3.404  -6.357  -2.411
  621    HB   THR  83           HB       THR  83   3.735  -9.341  -2.525
  622    HG1  THR  83           1HG      THR  83   1.781  -8.280  -1.055
  623   1HG2  THR  83          1HG2      THR  83   3.260  -9.600  -0.103
  624   2HG2  THR  83          2HG2      THR  83   4.915  -9.098  -0.421
  625   3HG2  THR  83          3HG2      THR  83   3.725  -7.906   0.155
  626    H    LYS  84           H        LYS  84   6.291  -8.442  -2.668
  627    HA   LYS  84           HA       LYS  84   7.380  -7.375  -0.282
  628   1HB   LYS  84          2HB       LYS  84   7.682  -9.673  -1.142
  629   2HB   LYS  84          3HB       LYS  84   8.787  -9.069  -2.389
  630   1HG   LYS  84          2HG       LYS  84  10.462  -8.676  -0.857
  631   2HG   LYS  84          3HG       LYS  84   9.322  -8.164   0.394
  632   1HD   LYS  84          2HD       LYS  84   8.614 -10.500   0.770
  633   2HD   LYS  84          3HD       LYS  84   9.825 -11.069  -0.394
  634   1HE   LYS  84          2HE       LYS  84  11.622 -10.589   1.054
  635   2HE   LYS  84          3HE       LYS  84  10.744  -9.332   1.914
  636   1HZ   LYS  84          1HZ       LYS  84  10.237 -12.223   2.210
  637   2HZ   LYS  84          2HZ       LYS  84  10.940 -11.229   3.314
  638   3HZ   LYS  84          3HZ       LYS  84   9.367 -11.067   2.950
  639    H    SER  85           H        SER  85   7.643  -6.412  -3.643
  640    HA   SER  85           HA       SER  85   9.808  -4.564  -3.354
  641   1HB   SER  85          2HB       SER  85   7.385  -4.357  -5.195
  642   2HB   SER  85          3HB       SER  85   8.923  -3.506  -5.354
  643    HG   SER  85           HG       SER  85   8.579  -6.341  -5.399
  644    H    LEU  86           H        LEU  86   6.252  -4.272  -2.759
  645    HA   LEU  86           HA       LEU  86   6.373  -1.561  -1.776
  646   1HB   LEU  86          2HB       LEU  86   4.311  -3.100  -2.372
  647   2HB   LEU  86          3HB       LEU  86   4.409  -3.593  -0.686
  648    HG   LEU  86           HG       LEU  86   3.992  -0.764  -1.740
  649   1HD1  LEU  86          1HD1      LEU  86   1.781  -0.976  -0.761
  650   2HD1  LEU  86          2HD1      LEU  86   2.041  -2.329  -1.877
  651   3HD1  LEU  86          3HD1      LEU  86   2.165  -2.589  -0.127
  652   1HD2  LEU  86          1HD2      LEU  86   5.262  -0.498   0.264
  653   2HD2  LEU  86          2HD2      LEU  86   3.577  -0.164   0.654
  654   3HD2  LEU  86          3HD2      LEU  86   4.289  -1.721   1.127
  655    H    MET  87           H        MET  87   6.187  -4.684   0.052
  656    HA   MET  87           HA       MET  87   6.687  -3.719   2.527
  657   1HB   MET  87          2HB       MET  87   6.329  -6.181   1.804
  658   2HB   MET  87          3HB       MET  87   8.097  -6.263   1.656
  659   1HG   MET  87          2HG       MET  87   8.226  -5.365   4.059
  660   2HG   MET  87          3HG       MET  87   6.462  -5.491   4.076
  661   1HE   MET  87          1HE       MET  87   9.018  -8.163   2.700
  662   2HE   MET  87          2HE       MET  87   9.818  -7.346   4.070
  663   3HE   MET  87          3HE       MET  87   9.303  -9.044   4.228
  664    H    ALA  88           H        ALA  88   9.247  -4.577   0.214
  665    HA   ALA  88           HA       ALA  88  11.503  -4.384   1.784
  666   1HB   ALA  88          1HB       ALA  88  11.593  -5.301  -0.446
  667   2HB   ALA  88          2HB       ALA  88  11.083  -3.767  -1.173
  668   3HB   ALA  88          3HB       ALA  88  12.684  -3.909  -0.406
  669    H    ALA  89           H        ALA  89   9.786  -1.707   0.157
  670    HA   ALA  89           HA       ALA  89  11.826   0.246   1.115
  671   1HB   ALA  89          1HB       ALA  89   9.372   0.510  -0.632
  672   2HB   ALA  89          2HB       ALA  89  10.452   1.856  -0.186
  673   3HB   ALA  89          3HB       ALA  89  11.088   0.503  -1.143
  674    H    ALA  90           H        ALA  90   8.420  -0.716   1.646
  675    HA   ALA  90           HA       ALA  90   7.673   1.441   3.365
  676   1HB   ALA  90          1HB       ALA  90   6.112  -0.304   2.394
  677   2HB   ALA  90          2HB       ALA  90   6.876  -1.507   3.433
  678   3HB   ALA  90          3HB       ALA  90   5.959  -0.174   4.168
  679    H    ASP  91           H        ASP  91   9.279  -1.679   4.057
  680    HA   ASP  91           HA       ASP  91   9.413  -1.220   6.884
  681   1HB   ASP  91          2HB       ASP  91   9.682  -3.500   6.113
  682   2HB   ASP  91          3HB       ASP  91  10.986  -3.021   5.005
  683    H    ASN  92           H        ASN  92  10.699   0.277   7.857
  684    HA   ASN  92           HA       ASN  92  13.091   1.303   6.330
  685   1HB   ASN  92          2HB       ASN  92  12.958   3.350   7.472
  686   2HB   ASN  92          3HB       ASN  92  11.394   2.988   6.737
  687   1HD2  ASN  92          1HD2      ASN  92  10.722   4.727   8.242
  688   2HD2  ASN  92          2HD2      ASN  92  10.279   4.260   9.892
  689    H    ASP  93           H        ASP  93  12.615  -1.105   8.397
  690    HA   ASP  93           HA       ASP  93  14.933  -0.454  10.183
  691   1HB   ASP  93          2HB       ASP  93  13.123  -2.881  10.050
  692   2HB   ASP  93          3HB       ASP  93  14.485  -2.686  11.144
  693    H    GLY  94           H        GLY  94  13.829  -2.919   7.766
  694   1HA   GLY  94          1HA       GLY  94  15.262  -4.255   6.406
  695   2HA   GLY  94          2HA       GLY  94  16.627  -3.943   7.492
  696    H    ASP  95           H        ASP  95  13.202  -4.808   7.982
  697    HA   ASP  95           HA       ASP  95  13.921  -7.369   9.269
  698   1HB   ASP  95          2HB       ASP  95  12.231  -7.089  11.001
  699   2HB   ASP  95          3HB       ASP  95  13.602  -5.998  11.161
  700    H    GLY  96           H        GLY  96  11.034  -5.465   8.436
  701   1HA   GLY  96          1HA       GLY  96  10.018  -6.319   6.199
  702   2HA   GLY  96          2HA       GLY  96   9.809  -7.846   7.084
  703    H    LYS  97           H        LYS  97   9.126  -7.013   9.607
  704    HA   LYS  97           HA       LYS  97   6.408  -6.344   9.450
  705   1HB   LYS  97          2HB       LYS  97   6.438  -6.122  11.829
  706   2HB   LYS  97          3HB       LYS  97   7.522  -7.435  11.375
  707   1HG   LYS  97          2HG       LYS  97   9.450  -5.834  11.615
  708   2HG   LYS  97          3HG       LYS  97   8.316  -4.628  12.250
  709   1HD   LYS  97          2HD       LYS  97   7.641  -6.325  14.003
  710   2HD   LYS  97          3HD       LYS  97   8.990  -7.341  13.485
  711   1HE   LYS  97          2HE       LYS  97   9.324  -4.429  14.397
  712   2HE   LYS  97          3HE       LYS  97   9.330  -5.781  15.535
  713   1HZ   LYS  97          1HZ       LYS  97  11.541  -5.129  14.888
  714   2HZ   LYS  97          2HZ       LYS  97  11.255  -6.668  14.371
  715   3HZ   LYS  97          3HZ       LYS  97  11.227  -5.398  13.325
  716    H    ILE  98           H        ILE  98   5.334  -4.472   9.145
  717    HA   ILE  98           HA       ILE  98   6.806  -1.862   9.071
  718    HB   ILE  98           HB       ILE  98   4.708  -3.152   7.347
  719   1HG1  ILE  98          2HG1      ILE  98   7.031  -1.513   6.359
  720   2HG1  ILE  98          3HG1      ILE  98   7.437  -3.041   7.138
  721   1HG2  ILE  98          1HG2      ILE  98   4.442  -1.047   6.096
  722   2HG2  ILE  98          2HG2      ILE  98   3.786  -0.890   7.719
  723   3HG2  ILE  98          3HG2      ILE  98   5.362  -0.174   7.324
  724   1HD1  ILE  98          1HD1      ILE  98   7.162  -3.398   4.788
  725   2HD1  ILE  98          2HD1      ILE  98   5.897  -4.252   5.715
  726   3HD1  ILE  98          3HD1      ILE  98   5.491  -2.768   4.822
  727    H    GLY  99           H        GLY  99   6.295  -0.851  10.948
  728   1HA   GLY  99          1HA       GLY  99   3.710  -1.081  12.250
  729   2HA   GLY  99          2HA       GLY  99   4.932   0.173  12.525
  730    H    ALA 100           H        ALA 100   2.139   0.712  12.445
  731    HA   ALA 100           HA       ALA 100   1.203   1.969  10.104
  732   1HB   ALA 100          1HB       ALA 100   1.025   3.136  12.922
  733   2HB   ALA 100          2HB       ALA 100  -0.118   3.330  11.574
  734   3HB   ALA 100          3HB       ALA 100   0.046   1.764  12.398
  735    H    GLU 101           H        GLU 101   3.572   2.937  12.530
  736    HA   GLU 101           HA       GLU 101   4.000   5.556  11.702
  737   1HB   GLU 101          2HB       GLU 101   4.699   4.377  13.853
  738   2HB   GLU 101          3HB       GLU 101   6.109   3.751  12.986
  739   1HG   GLU 101          2HG       GLU 101   6.947   6.003  12.657
  740   2HG   GLU 101          3HG       GLU 101   5.407   6.715  13.180
  741    H    GLU 102           H        GLU 102   5.898   2.588  10.876
  742    HA   GLU 102           HA       GLU 102   7.613   3.682   8.945
  743   1HB   GLU 102          2HB       GLU 102   6.359   0.902   8.985
  744   2HB   GLU 102          3HB       GLU 102   7.787   1.405   8.070
  745   1HG   GLU 102          2HG       GLU 102   8.897   1.975  10.266
  746   2HG   GLU 102          3HG       GLU 102   7.529   1.238  11.107
  747    H    PHE 103           H        PHE 103   4.307   2.332   8.540
  748    HA   PHE 103           HA       PHE 103   4.119   2.704   5.747
  749   1HB   PHE 103          2HB       PHE 103   2.510   1.403   7.024
  750   2HB   PHE 103          3HB       PHE 103   1.911   2.852   7.818
  751    HD1  PHE 103           1HD      PHE 103   0.230   4.220   6.786
  752    HD2  PHE 103           2HD      PHE 103   2.342   1.299   4.421
  753    HE1  PHE 103           1HE      PHE 103  -1.453   4.464   4.980
  754    HE2  PHE 103           2HE      PHE 103   0.732   1.636   2.572
  755    HZ   PHE 103           HZ       PHE 103  -1.215   3.163   2.873
  756    H    GLN 104           H        GLN 104   2.978   4.998   8.317
  757    HA   GLN 104           HA       GLN 104   2.284   7.128   6.518
  758   1HB   GLN 104          2HB       GLN 104   1.672   6.894   8.987
  759   2HB   GLN 104          3HB       GLN 104   3.300   7.508   9.348
  760   1HG   GLN 104          2HG       GLN 104   2.770   9.501   7.859
  761   2HG   GLN 104          3HG       GLN 104   1.133   8.876   7.670
  762   1HE2  GLN 104          1HE2      GLN 104   2.887  11.123   9.310
  763   2HE2  GLN 104          2HE2      GLN 104   1.904  11.288  10.747
  764    H    GLU 105           H        GLU 105   5.418   6.200   8.013
  765    HA   GLU 105           HA       GLU 105   6.862   8.485   7.276
  766   1HB   GLU 105          2HB       GLU 105   7.552   6.583   8.810
  767   2HB   GLU 105          3HB       GLU 105   8.019   5.659   7.373
  768   1HG   GLU 105          2HG       GLU 105   9.124   8.457   7.703
  769   2HG   GLU 105          3HG       GLU 105   9.727   7.175   8.757
  770    H    MET 106           H        MET 106   6.694   5.333   5.448
  771    HA   MET 106           HA       MET 106   8.018   6.434   3.168
  772   1HB   MET 106          2HB       MET 106   7.181   4.617   1.852
  773   2HB   MET 106          3HB       MET 106   7.859   4.037   3.370
  774   1HG   MET 106          2HG       MET 106   5.765   3.455   4.246
  775   2HG   MET 106          3HG       MET 106   4.876   4.445   3.095
  776   1HE   MET 106          1HE       MET 106   4.355   3.926   0.614
  777   2HE   MET 106          2HE       MET 106   6.057   3.588   0.202
  778   3HE   MET 106          3HE       MET 106   4.804   2.390  -0.167
  779    H    VAL 107           H        VAL 107   4.563   6.302   4.063
  780    HA   VAL 107           HA       VAL 107   3.695   7.351   1.585
  781    HB   VAL 107           HB       VAL 107   2.304   6.981   4.233
  782   1HG1  VAL 107          1HG1      VAL 107   1.260   8.127   1.644
  783   2HG1  VAL 107          2HG1      VAL 107   0.199   7.369   2.810
  784   3HG1  VAL 107          3HG1      VAL 107   1.134   8.817   3.256
  785   1HG2  VAL 107          1HG2      VAL 107   2.785   4.901   2.948
  786   2HG2  VAL 107          2HG2      VAL 107   1.066   5.256   2.940
  787   3HG2  VAL 107          3HG2      VAL 107   2.043   5.617   1.506
  788    H    HIS 108           H        HIS 108   5.090   8.993   4.335
  789    HA   HIS 108           HA       HIS 108   3.863  11.526   3.717
  790   1HB   HIS 108          2HB       HIS 108   4.754  10.964   5.944
  791   2HB   HIS 108          3HB       HIS 108   6.378  10.762   5.280
  792    HD1  HIS 108           1HD      HIS 108   5.065  13.856   3.835
  793    HD2  HIS 108           2HD      HIS 108   6.893  12.560   7.382
  794    HE1  HIS 108           1HE      HIS 108   5.889  15.961   5.042
  795    H    SER 109           H        SER 109   6.430   9.685   2.323
  796    HA   SER 109           HA       SER 109   8.381  11.552   1.836
  797   1HB   SER 109          2HB       SER 109   8.554   9.083   1.654
  798   2HB   SER 109          3HB       SER 109   7.704   9.145   0.104
  799    HG   SER 109           HG       SER 109   9.948  10.772   0.438
  Start of MODEL   13
    1   1H    MET   1           H1       MET   1 -17.837   4.673   5.093
    2   2H    MET   1           H2       MET   1 -19.023   5.680   4.506
    3   3H    MET   1           H3       MET   1 -19.011   4.047   4.146
    4    HA   MET   1           HA       MET   1 -18.102   4.984   2.212
    5   1HB   MET   1          2HB       MET   1 -16.193   6.581   3.967
    6   2HB   MET   1          3HB       MET   1 -16.469   6.710   2.227
    7   1HG   MET   1          2HG       MET   1 -17.524   8.583   3.143
    8   2HG   MET   1          3HG       MET   1 -18.845   7.473   2.778
    9   1HE   MET   1          1HE       MET   1 -20.527   8.834   4.346
   10   2HE   MET   1          2HE       MET   1 -20.111   9.336   6.005
   11   3HE   MET   1          3HE       MET   1 -19.212  10.004   4.624
   12    H    SER   2           H        SER   2 -15.733   4.766   1.449
   13    HA   SER   2           HA       SER   2 -13.857   3.575   3.200
   14   1HB   SER   2          2HB       SER   2 -14.858   1.449   2.573
   15   2HB   SER   2          3HB       SER   2 -14.860   1.884   0.854
   16    HG   SER   2           HG       SER   2 -13.048   0.541   1.595
   17    H    ILE   3           H        ILE   3 -11.915   3.136   1.482
   18    HA   ILE   3           HA       ILE   3 -11.127   5.771   0.774
   19    HB   ILE   3           HB       ILE   3  -9.111   4.747  -0.097
   20   1HG1  ILE   3          2HG1      ILE   3  -9.148   2.070   0.192
   21   2HG1  ILE   3          3HG1      ILE   3 -10.821   2.253  -0.322
   22   1HG2  ILE   3          1HG2      ILE   3 -10.071   3.102   2.273
   23   2HG2  ILE   3          2HG2      ILE   3  -8.420   3.607   1.883
   24   3HG2  ILE   3          3HG2      ILE   3  -9.620   4.817   2.378
   25   1HD1  ILE   3          1HD1      ILE   3  -9.411   1.814  -2.243
   26   2HD1  ILE   3          2HD1      ILE   3  -9.931   3.490  -2.380
   27   3HD1  ILE   3          3HD1      ILE   3  -8.292   3.108  -1.788
   28    H    THR   4           H        THR   4 -12.728   3.271  -1.133
   29    HA   THR   4           HA       THR   4 -12.421   4.192  -3.691
   30    HB   THR   4           HB       THR   4 -13.392   2.054  -2.722
   31    HG1  THR   4           1HG      THR   4 -13.407   2.673  -4.770
   32   1HG2  THR   4          1HG2      THR   4 -16.045   3.531  -2.593
   33   2HG2  THR   4          2HG2      THR   4 -15.711   1.829  -2.239
   34   3HG2  THR   4          3HG2      THR   4 -15.087   3.088  -1.159
   35    H    ASP   5           H        ASP   5 -14.574   5.295  -1.097
   36    HA   ASP   5           HA       ASP   5 -16.024   7.193  -2.852
   37   1HB   ASP   5          2HB       ASP   5 -17.275   5.485  -1.564
   38   2HB   ASP   5          3HB       ASP   5 -16.535   6.074  -0.064
   39    H    VAL   6           H        VAL   6 -13.352   7.763  -2.280
   40    HA   VAL   6           HA       VAL   6 -13.602  10.293  -0.721
   41    HB   VAL   6           HB       VAL   6 -11.317   8.274  -0.482
   42   1HG1  VAL   6          1HG1      VAL   6 -10.344   9.854   1.139
   43   2HG1  VAL   6          2HG1      VAL   6 -10.417  10.560  -0.478
   44   3HG1  VAL   6          3HG1      VAL   6 -11.608  11.041   0.750
   45   1HG2  VAL   6          1HG2      VAL   6 -13.300   9.295   1.591
   46   2HG2  VAL   6          2HG2      VAL   6 -13.276   7.670   0.880
   47   3HG2  VAL   6          3HG2      VAL   6 -11.935   8.197   1.902
   48    H    LEU   7           H        LEU   7 -11.376   8.379  -2.728
   49    HA   LEU   7           HA       LEU   7 -11.271  10.218  -4.926
   50   1HB   LEU   7          2HB       LEU   7 -10.000  11.687  -3.493
   51   2HB   LEU   7          3HB       LEU   7  -9.052  10.354  -2.851
   52    HG   LEU   7           HG       LEU   7  -8.612  10.384  -5.714
   53   1HD1  LEU   7          1HD1      LEU   7  -8.262  13.119  -4.437
   54   2HD1  LEU   7          2HD1      LEU   7  -7.662  12.607  -6.028
   55   3HD1  LEU   7          3HD1      LEU   7  -9.408  12.701  -5.732
   56   1HD2  LEU   7          1HD2      LEU   7  -6.786  11.317  -3.474
   57   2HD2  LEU   7          2HD2      LEU   7  -7.045   9.612  -3.914
   58   3HD2  LEU   7          3HD2      LEU   7  -6.313  10.729  -5.077
   59    H    SER   8           H        SER   8  -9.428   7.915  -2.932
   60    HA   SER   8           HA       SER   8  -7.713   7.005  -4.668
   61   1HB   SER   8          2HB       SER   8  -9.082   5.613  -2.360
   62   2HB   SER   8          3HB       SER   8  -7.769   4.819  -3.263
   63    HG   SER   8           HG       SER   8  -6.440   6.445  -2.848
   64    H    ALA   9           H        ALA   9 -11.050   6.099  -5.077
   65    HA   ALA   9           HA       ALA   9 -10.757   3.763  -6.658
   66   1HB   ALA   9          1HB       ALA   9 -12.631   6.149  -6.972
   67   2HB   ALA   9          2HB       ALA   9 -12.816   4.590  -7.808
   68   3HB   ALA   9          3HB       ALA   9 -12.947   4.667  -6.041
   69    H    ASP  10           H        ASP  10 -10.209   7.210  -7.495
   70    HA   ASP  10           HA       ASP  10  -9.662   6.703 -10.300
   71   1HB   ASP  10          2HB       ASP  10 -10.395   8.897  -9.374
   72   2HB   ASP  10          3HB       ASP  10  -8.853   9.034  -8.508
   73    H    ASP  11           H        ASP  11  -7.785   6.837  -7.305
   74    HA   ASP  11           HA       ASP  11  -5.210   6.964  -8.527
   75   1HB   ASP  11          2HB       ASP  11  -4.412   7.145  -6.506
   76   2HB   ASP  11          3HB       ASP  11  -6.040   7.456  -6.033
   77    H    ILE  12           H        ILE  12  -7.133   4.219  -7.196
   78    HA   ILE  12           HA       ILE  12  -5.220   2.337  -7.872
   79    HB   ILE  12           HB       ILE  12  -6.954   0.680  -7.656
   80   1HG1  ILE  12          2HG1      ILE  12  -8.854   2.966  -7.295
   81   2HG1  ILE  12          3HG1      ILE  12  -8.879   1.810  -8.635
   82   1HG2  ILE  12          1HG2      ILE  12  -5.712   1.640  -5.724
   83   2HG2  ILE  12          2HG2      ILE  12  -7.049   2.768  -5.446
   84   3HG2  ILE  12          3HG2      ILE  12  -7.303   1.021  -5.285
   85   1HD1  ILE  12          1HD1      ILE  12 -10.611   1.179  -7.131
   86   2HD1  ILE  12          2HD1      ILE  12  -9.307   0.001  -6.931
   87   3HD1  ILE  12          3HD1      ILE  12  -9.547   1.286  -5.722
   88    H    ALA  13           H        ALA  13  -7.889   3.675  -9.828
   89    HA   ALA  13           HA       ALA  13  -7.603   1.995 -12.094
   90   1HB   ALA  13          1HB       ALA  13  -8.595   3.845 -13.373
   91   2HB   ALA  13          2HB       ALA  13  -9.462   3.553 -11.850
   92   3HB   ALA  13          3HB       ALA  13  -8.368   4.941 -12.002
   93    H    ALA  14           H        ALA  14  -5.838   5.041 -11.260
   94    HA   ALA  14           HA       ALA  14  -4.093   5.017 -13.550
   95   1HB   ALA  14          1HB       ALA  14  -2.655   6.468 -12.251
   96   2HB   ALA  14          2HB       ALA  14  -4.351   6.963 -12.075
   97   3HB   ALA  14          3HB       ALA  14  -3.537   6.096 -10.760
   98    H    ALA  15           H        ALA  15  -3.405   3.842 -10.219
   99    HA   ALA  15           HA       ALA  15  -0.884   2.774 -10.741
  100   1HB   ALA  15          1HB       ALA  15  -1.172   1.473  -8.717
  101   2HB   ALA  15          2HB       ALA  15  -1.926   3.054  -8.459
  102   3HB   ALA  15          3HB       ALA  15  -2.941   1.640  -8.794
  103    H    LEU  16           H        LEU  16  -4.028   1.201 -11.015
  104    HA   LEU  16           HA       LEU  16  -3.333  -1.381 -11.674
  105   1HB   LEU  16          2HB       LEU  16  -5.551  -0.942 -11.227
  106   2HB   LEU  16          3HB       LEU  16  -5.669   0.374 -12.385
  107    HG   LEU  16           HG       LEU  16  -5.123  -2.248 -13.661
  108   1HD1  LEU  16          1HD1      LEU  16  -7.460  -3.011 -13.432
  109   2HD1  LEU  16          2HD1      LEU  16  -6.606  -3.041 -11.878
  110   3HD1  LEU  16          3HD1      LEU  16  -7.762  -1.739 -12.229
  111   1HD2  LEU  16          1HD2      LEU  16  -5.751   0.052 -14.700
  112   2HD2  LEU  16          2HD2      LEU  16  -6.680  -1.355 -15.271
  113   3HD2  LEU  16          3HD2      LEU  16  -7.375  -0.227 -14.087
  114    H    GLN  17           H        GLN  17  -3.386   1.431 -13.947
  115    HA   GLN  17           HA       GLN  17  -2.516  -0.392 -16.150
  116   1HB   GLN  17          2HB       GLN  17  -3.348   2.501 -16.094
  117   2HB   GLN  17          3HB       GLN  17  -2.551   1.761 -17.490
  118   1HG   GLN  17          2HG       GLN  17  -4.687   0.010 -16.547
  119   2HG   GLN  17          3HG       GLN  17  -5.318   1.633 -16.824
  120   1HE2  GLN  17          1HE2      GLN  17  -5.827   2.129 -18.947
  121   2HE2  GLN  17          2HE2      GLN  17  -5.370   1.146 -20.323
  122    H    GLU  18           H        GLU  18  -1.279   2.441 -14.337
  123    HA   GLU  18           HA       GLU  18   1.167   2.751 -15.634
  124   1HB   GLU  18          2HB       GLU  18   0.213   4.305 -13.990
  125   2HB   GLU  18          3HB       GLU  18   0.440   3.120 -12.701
  126   1HG   GLU  18          2HG       GLU  18   2.094   4.809 -12.530
  127   2HG   GLU  18          3HG       GLU  18   2.913   3.307 -12.992
  128    H    CYS  19           H        CYS  19   0.384   0.566 -12.903
  129    HA   CYS  19           HA       CYS  19   2.961  -0.917 -13.311
  130   1HB   CYS  19          2HB       CYS  19   1.266  -0.609 -10.796
  131   2HB   CYS  19          3HB       CYS  19   2.700  -1.643 -10.981
  132    HG   CYS  19           HG       CYS  19   2.524   1.600 -11.436
  133    H    ARG  20           H        ARG  20   1.190  -1.565 -15.175
  134    HA   ARG  20           HA       ARG  20  -0.733  -3.602 -14.238
  135   1HB   ARG  20          2HB       ARG  20  -1.431  -2.337 -16.049
  136   2HB   ARG  20          3HB       ARG  20   0.111  -2.477 -16.914
  137   1HG   ARG  20          2HG       ARG  20  -0.323  -4.763 -17.492
  138   2HG   ARG  20          3HG       ARG  20  -1.746  -4.836 -16.416
  139   1HD   ARG  20          2HD       ARG  20  -2.928  -3.209 -17.763
  140   2HD   ARG  20          3HD       ARG  20  -1.475  -2.883 -18.743
  141    HE   ARG  20           HE       ARG  20  -1.924  -5.602 -19.020
  142   1HH1  ARG  20          2HH2      ARG  20  -3.642  -2.591 -19.761
  143   2HH1  ARG  20          1HH2      ARG  20  -4.497  -3.233 -21.127
  144   1HH2  ARG  20          2HH1      ARG  20  -3.025  -6.474 -20.849
  145   2HH2  ARG  20          1HH1      ARG  20  -4.123  -5.504 -21.774
  146    H    ASP  21           H        ASP  21   2.178  -3.484 -16.290
  147    HA   ASP  21           HA       ASP  21   2.373  -6.194 -16.786
  148   1HB   ASP  21          2HB       ASP  21   4.333  -3.869 -16.804
  149   2HB   ASP  21          3HB       ASP  21   4.896  -5.488 -17.150
  150    HA   PRO  22           HA       PRO  22   3.509  -7.994 -13.034
  151   1HB   PRO  22          2HB       PRO  22   4.957 -10.215 -13.741
  152   2HB   PRO  22          3HB       PRO  22   3.201 -10.040 -14.034
  153   1HG   PRO  22          2HG       PRO  22   5.458  -9.476 -15.976
  154   2HG   PRO  22          3HG       PRO  22   3.997 -10.468 -16.265
  155   1HD   PRO  22          2HD       PRO  22   4.122  -7.874 -17.059
  156   2HD   PRO  22          3HD       PRO  22   2.610  -8.522 -16.353
  157    H    ASP  23           H        ASP  23   4.939  -7.539 -11.533
  158    HA   ASP  23           HA       ASP  23   6.675  -6.991 -10.389
  159   1HB   ASP  23          2HB       ASP  23   8.353  -8.325 -12.538
  160   2HB   ASP  23          3HB       ASP  23   8.940  -7.816 -10.950
  161    H    THR  24           H        THR  24   5.526  -5.070 -12.089
  162    HA   THR  24           HA       THR  24   7.816  -3.242 -12.693
  163    HB   THR  24           HB       THR  24   4.889  -2.799 -13.383
  164    HG1  THR  24           1HG      THR  24   5.368  -4.597 -14.423
  165   1HG2  THR  24          1HG2      THR  24   5.893  -1.470 -15.261
  166   2HG2  THR  24          2HG2      THR  24   6.226  -0.765 -13.677
  167   3HG2  THR  24          3HG2      THR  24   7.492  -1.687 -14.525
  168    H    PHE  25           H        PHE  25   6.005  -4.075 -10.075
  169    HA   PHE  25           HA       PHE  25   4.944  -1.530  -9.308
  170   1HB   PHE  25          2HB       PHE  25   4.647  -4.120  -8.448
  171   2HB   PHE  25          3HB       PHE  25   5.597  -3.473  -7.143
  172    HD1  PHE  25           1HD      PHE  25   2.457  -3.086  -9.107
  173    HD2  PHE  25           2HD      PHE  25   4.609  -1.803  -5.597
  174    HE1  PHE  25           1HE      PHE  25   0.330  -2.360  -8.078
  175    HE2  PHE  25           2HE      PHE  25   2.482  -0.918  -4.660
  176    HZ   PHE  25           HZ       PHE  25   0.335  -1.438  -5.761
  177    H    GLU  26           H        GLU  26   5.800   0.050  -8.047
  178    HA   GLU  26           HA       GLU  26   8.363  -0.409  -6.662
  179   1HB   GLU  26          2HB       GLU  26   7.850   1.606  -8.805
  180   2HB   GLU  26          3HB       GLU  26   8.478   2.273  -7.294
  181   1HG   GLU  26          2HG       GLU  26  10.244   0.247  -7.583
  182   2HG   GLU  26          3HG       GLU  26   9.826   0.529  -9.281
  183    HA   PRO  27           HA       PRO  27   6.077   1.229  -3.308
  184   1HB   PRO  27          2HB       PRO  27   8.099   2.287  -1.715
  185   2HB   PRO  27          3HB       PRO  27   7.722   0.555  -1.895
  186   1HG   PRO  27          2HG       PRO  27   9.922   2.113  -3.248
  187   2HG   PRO  27          3HG       PRO  27   9.946   0.440  -2.617
  188   1HD   PRO  27          2HD       PRO  27   9.648   0.994  -5.255
  189   2HD   PRO  27          3HD       PRO  27   8.940  -0.438  -4.447
  190    H    GLN  28           H        GLN  28   8.692   3.666  -3.757
  191    HA   GLN  28           HA       GLN  28   7.151   5.928  -3.149
  192   1HB   GLN  28          2HB       GLN  28   9.618   5.571  -4.868
  193   2HB   GLN  28          3HB       GLN  28   8.943   7.160  -4.459
  194   1HG   GLN  28          2HG       GLN  28   9.237   6.793  -2.090
  195   2HG   GLN  28          3HG       GLN  28   9.650   5.093  -2.328
  196   1HE2  GLN  28          1HE2      GLN  28  10.912   8.383  -2.371
  197   2HE2  GLN  28          2HE2      GLN  28  12.566   7.899  -2.700
  198    H    LYS  29           H        LYS  29   7.765   4.481  -6.325
  199    HA   LYS  29           HA       LYS  29   6.264   6.144  -7.981
  200   1HB   LYS  29          2HB       LYS  29   7.667   4.118  -8.633
  201   2HB   LYS  29          3HB       LYS  29   6.329   3.111  -8.049
  202   1HG   LYS  29          2HG       LYS  29   5.787   3.157 -10.241
  203   2HG   LYS  29          3HG       LYS  29   4.884   4.582  -9.717
  204   1HD   LYS  29          2HD       LYS  29   7.021   5.939 -10.401
  205   2HD   LYS  29          3HD       LYS  29   7.553   4.422 -11.164
  206   1HE   LYS  29          2HE       LYS  29   5.110   4.397 -12.187
  207   2HE   LYS  29          3HE       LYS  29   5.061   6.111 -11.763
  208   1HZ   LYS  29          1HZ       LYS  29   5.631   5.581 -13.987
  209   2HZ   LYS  29          2HZ       LYS  29   6.862   6.464 -13.295
  210   3HZ   LYS  29          3HZ       LYS  29   7.024   4.828 -13.555
  211    H    PHE  30           H        PHE  30   5.056   3.168  -6.255
  212    HA   PHE  30           HA       PHE  30   2.356   3.534  -6.953
  213   1HB   PHE  30          2HB       PHE  30   3.271   1.431  -6.122
  214   2HB   PHE  30          3HB       PHE  30   3.556   2.143  -4.535
  215    HD1  PHE  30           1HD      PHE  30   1.807   2.062  -2.887
  216    HD2  PHE  30           2HD      PHE  30   0.878   1.349  -7.041
  217    HE1  PHE  30           1HE      PHE  30  -0.524   1.470  -2.270
  218    HE2  PHE  30           2HE      PHE  30  -1.456   0.795  -6.414
  219    HZ   PHE  30           HZ       PHE  30  -2.170   0.904  -4.042
  220    H    PHE  31           H        PHE  31   4.131   4.668  -4.013
  221    HA   PHE  31           HA       PHE  31   1.916   5.727  -2.646
  222   1HB   PHE  31          2HB       PHE  31   4.683   6.958  -2.725
  223   2HB   PHE  31          3HB       PHE  31   3.494   7.096  -1.437
  224    HD1  PHE  31           1HD      PHE  31   2.781   3.947  -1.555
  225    HD2  PHE  31           2HD      PHE  31   6.354   6.302  -1.051
  226    HE1  PHE  31           1HE      PHE  31   3.877   2.051  -0.432
  227    HE2  PHE  31           2HE      PHE  31   7.500   4.349  -0.072
  228    HZ   PHE  31           HZ       PHE  31   6.255   2.221   0.293
  229    H    GLN  32           H        GLN  32   3.832   7.206  -5.287
  230    HA   GLN  32           HA       GLN  32   2.348   9.739  -5.141
  231   1HB   GLN  32          2HB       GLN  32   4.369   8.570  -7.071
  232   2HB   GLN  32          3HB       GLN  32   3.466  10.060  -7.409
  233   1HG   GLN  32          2HG       GLN  32   4.289  11.099  -5.352
  234   2HG   GLN  32          3HG       GLN  32   5.107   9.606  -4.876
  235   1HE2  GLN  32          1HE2      GLN  32   4.959  11.458  -8.007
  236   2HE2  GLN  32          2HE2      GLN  32   6.706  11.600  -8.132
  237    H    THR  33           H        THR  33   2.356   6.891  -7.391
  238    HA   THR  33           HA       THR  33   0.487   8.020  -9.092
  239    HB   THR  33           HB       THR  33   2.107   5.762  -9.077
  240    HG1  THR  33           1HG      THR  33   0.015   6.602 -10.685
  241   1HG2  THR  33          1HG2      THR  33   0.361   4.369  -7.893
  242   2HG2  THR  33          2HG2      THR  33  -0.732   4.731  -9.253
  243   3HG2  THR  33          3HG2      THR  33   0.774   3.825  -9.523
  244    H    SER  34           H        SER  34   0.068   5.982  -6.236
  245    HA   SER  34           HA       SER  34  -2.751   5.747  -6.508
  246   1HB   SER  34          2HB       SER  34  -0.980   5.125  -4.130
  247   2HB   SER  34          3HB       SER  34  -2.595   4.469  -4.463
  248    HG   SER  34           HG       SER  34  -0.600   3.255  -5.181
  249    H    GLY  35           H        GLY  35  -0.924   8.473  -5.563
  250   1HA   GLY  35          1HA       GLY  35  -1.802  10.486  -4.859
  251   2HA   GLY  35          2HA       GLY  35  -3.366   9.711  -4.575
  252    H    LEU  36           H        LEU  36  -1.856   7.677  -2.839
  253    HA   LEU  36           HA       LEU  36  -2.301   8.638  -0.353
  254   1HB   LEU  36          2HB       LEU  36  -0.718   6.405  -1.579
  255   2HB   LEU  36          3HB       LEU  36  -0.492   6.689   0.124
  256    HG   LEU  36           HG       LEU  36  -3.263   6.427  -1.092
  257   1HD1  LEU  36          1HD1      LEU  36  -2.047   4.353  -1.573
  258   2HD1  LEU  36          2HD1      LEU  36  -1.527   4.234   0.124
  259   3HD1  LEU  36          3HD1      LEU  36  -3.246   4.076  -0.297
  260   1HD2  LEU  36          1HD2      LEU  36  -3.989   5.973   1.161
  261   2HD2  LEU  36          2HD2      LEU  36  -2.318   5.918   1.767
  262   3HD2  LEU  36          3HD2      LEU  36  -3.041   7.450   1.260
  263    H    SER  37           H        SER  37   0.658   9.147  -2.217
  264    HA   SER  37           HA       SER  37   2.161  10.373  -0.031
  265   1HB   SER  37          2HB       SER  37   3.423   9.563  -1.906
  266   2HB   SER  37          3HB       SER  37   2.333  10.372  -3.053
  267    HG   SER  37           HG       SER  37   4.465  11.402  -1.626
  268    H    LYS  38           H        LYS  38  -0.415  11.464  -2.129
  269    HA   LYS  38           HA       LYS  38   0.192  14.308  -1.731
  270   1HB   LYS  38          2HB       LYS  38  -1.328  12.764  -3.676
  271   2HB   LYS  38          3HB       LYS  38  -2.447  13.792  -2.794
  272   1HG   LYS  38          2HG       LYS  38  -1.704  15.104  -4.625
  273   2HG   LYS  38          3HG       LYS  38  -0.815  15.721  -3.228
  274   1HD   LYS  38          2HD       LYS  38   0.937  13.784  -4.049
  275   2HD   LYS  38          3HD       LYS  38   0.115  14.085  -5.589
  276   1HE   LYS  38          2HE       LYS  38   0.635  16.583  -5.230
  277   2HE   LYS  38          3HE       LYS  38   1.588  16.099  -3.814
  278   1HZ   LYS  38          1HZ       LYS  38   2.994  16.353  -5.693
  279   2HZ   LYS  38          2HZ       LYS  38   2.951  14.757  -5.302
  280   3HZ   LYS  38          3HZ       LYS  38   2.103  15.313  -6.604
  281    H    MET  39           H        MET  39  -1.888  11.653  -0.590
  282    HA   MET  39           HA       MET  39  -3.474  13.301   1.142
  283   1HB   MET  39          2HB       MET  39  -2.917  10.353   0.825
  284   2HB   MET  39          3HB       MET  39  -3.704  10.914   2.278
  285   1HG   MET  39          2HG       MET  39  -5.458  12.030   0.932
  286   2HG   MET  39          3HG       MET  39  -4.675  11.469  -0.554
  287   1HE   MET  39          1HE       MET  39  -7.812  11.085   0.322
  288   2HE   MET  39          2HE       MET  39  -7.094  10.675  -1.254
  289   3HE   MET  39          3HE       MET  39  -8.044   9.459  -0.370
  290    H    SER  40           H        SER  40  -2.739  14.335   2.935
  291    HA   SER  40           HA       SER  40  -0.123  13.879   4.022
  292   1HB   SER  40          2HB       SER  40  -1.469  16.015   4.258
  293   2HB   SER  40          3HB       SER  40  -2.505  15.151   5.421
  294    HG   SER  40           HG       SER  40   0.274  15.723   5.628
  295    H    ALA  41           H        ALA  41   0.266  13.189   6.242
  296    HA   ALA  41           HA       ALA  41  -0.154  10.582   6.862
  297   1HB   ALA  41          1HB       ALA  41   1.402  12.106   8.033
  298   2HB   ALA  41          2HB       ALA  41   0.037  12.885   8.856
  299   3HB   ALA  41          3HB       ALA  41   0.412  11.181   9.186
  300    H    ASN  42           H        ASN  42  -2.212  13.264   7.903
  301    HA   ASN  42           HA       ASN  42  -4.133  12.213   9.522
  302   1HB   ASN  42          2HB       ASN  42  -4.709  13.956   7.092
  303   2HB   ASN  42          3HB       ASN  42  -5.708  13.806   8.545
  304   1HD2  ASN  42          1HD2      ASN  42  -4.748  16.289   7.535
  305   2HD2  ASN  42          2HD2      ASN  42  -3.572  16.916   8.678
  306    H    GLN  43           H        GLN  43  -4.172  11.982   5.933
  307    HA   GLN  43           HA       GLN  43  -6.645  10.384   5.972
  308   1HB   GLN  43          2HB       GLN  43  -4.923  11.739   3.922
  309   2HB   GLN  43          3HB       GLN  43  -5.800  10.301   3.398
  310   1HG   GLN  43          2HG       GLN  43  -7.061  12.741   4.718
  311   2HG   GLN  43          3HG       GLN  43  -7.038  12.426   2.977
  312   1HE2  GLN  43          1HE2      GLN  43  -7.672   9.711   2.776
  313   2HE2  GLN  43          2HE2      GLN  43  -9.266   9.461   3.474
  314    H    VAL  44           H        VAL  44  -3.061   9.856   5.584
  315    HA   VAL  44           HA       VAL  44  -3.413   7.214   4.600
  316    HB   VAL  44           HB       VAL  44  -1.073   8.310   6.213
  317   1HG1  VAL  44          1HG1      VAL  44   0.216   6.715   4.841
  318   2HG1  VAL  44          2HG1      VAL  44  -1.125   5.819   5.587
  319   3HG1  VAL  44          3HG1      VAL  44  -1.229   6.328   3.890
  320   1HG2  VAL  44          1HG2      VAL  44  -1.672   8.642   3.237
  321   2HG2  VAL  44          2HG2      VAL  44  -1.442   9.933   4.425
  322   3HG2  VAL  44          3HG2      VAL  44  -0.086   8.918   3.981
  323    H    LYS  45           H        LYS  45  -3.399   8.654   7.877
  324    HA   LYS  45           HA       LYS  45  -3.459   6.280   9.415
  325   1HB   LYS  45          2HB       LYS  45  -3.197   8.625  10.235
  326   2HB   LYS  45          3HB       LYS  45  -4.952   8.824  10.065
  327   1HG   LYS  45          2HG       LYS  45  -5.348   6.969  11.626
  328   2HG   LYS  45          3HG       LYS  45  -3.606   6.637  11.711
  329   1HD   LYS  45          2HD       LYS  45  -3.198   8.891  12.628
  330   2HD   LYS  45          3HD       LYS  45  -4.939   9.248  12.557
  331   1HE   LYS  45          2HE       LYS  45  -5.423   7.463  14.172
  332   2HE   LYS  45          3HE       LYS  45  -3.732   6.926  14.151
  333   1HZ   LYS  45          1HZ       LYS  45  -4.658   9.543  15.135
  334   2HZ   LYS  45          2HZ       LYS  45  -4.212   8.266  16.070
  335   3HZ   LYS  45          3HZ       LYS  45  -3.099   9.014  15.123
  336    H    ASP  46           H        ASP  46  -6.231   8.129   8.008
  337    HA   ASP  46           HA       ASP  46  -8.247   6.350   8.857
  338   1HB   ASP  46          2HB       ASP  46  -8.019   8.381   6.642
  339   2HB   ASP  46          3HB       ASP  46  -9.309   7.180   6.541
  340    H    VAL  47           H        VAL  47  -6.398   6.284   5.734
  341    HA   VAL  47           HA       VAL  47  -7.703   3.883   4.940
  342    HB   VAL  47           HB       VAL  47  -6.313   3.595   3.192
  343   1HG1  VAL  47          1HG1      VAL  47  -6.033   6.579   3.550
  344   2HG1  VAL  47          2HG1      VAL  47  -6.258   5.653   2.060
  345   3HG1  VAL  47          3HG1      VAL  47  -7.585   5.784   3.225
  346   1HG2  VAL  47          1HG2      VAL  47  -4.122   4.404   2.787
  347   2HG2  VAL  47          2HG2      VAL  47  -4.061   5.179   4.371
  348   3HG2  VAL  47          3HG2      VAL  47  -4.125   3.413   4.236
  349    H    PHE  48           H        PHE  48  -4.652   4.290   6.780
  350    HA   PHE  48           HA       PHE  48  -3.798   1.678   6.981
  351   1HB   PHE  48          2HB       PHE  48  -3.732   3.959   8.955
  352   2HB   PHE  48          3HB       PHE  48  -3.228   2.366   9.470
  353    HD1  PHE  48           1HD      PHE  48  -1.636   1.081   7.713
  354    HD2  PHE  48           2HD      PHE  48  -1.860   5.332   8.420
  355    HE1  PHE  48           1HE      PHE  48   0.766   1.315   7.199
  356    HE2  PHE  48           2HE      PHE  48   0.498   5.564   7.837
  357    HZ   PHE  48           HZ       PHE  48   1.848   3.568   7.398
  358    H    ARG  49           H        ARG  49  -6.327   3.190   9.066
  359    HA   ARG  49           HA       ARG  49  -6.692   0.798  10.616
  360   1HB   ARG  49          2HB       ARG  49  -8.707   3.021  10.074
  361   2HB   ARG  49          3HB       ARG  49  -8.825   1.729  11.289
  362   1HG   ARG  49          2HG       ARG  49  -6.481   2.572  12.085
  363   2HG   ARG  49          3HG       ARG  49  -6.852   4.037  11.176
  364   1HD   ARG  49          2HD       ARG  49  -8.148   4.812  12.841
  365   2HD   ARG  49          3HD       ARG  49  -9.164   3.363  12.779
  366    HE   ARG  49           HE       ARG  49  -6.693   2.799  14.135
  367   1HH1  ARG  49          2HH2      ARG  49  -9.795   4.390  14.611
  368   2HH1  ARG  49          1HH2      ARG  49  -9.851   4.147  16.329
  369   1HH2  ARG  49          2HH1      ARG  49  -6.708   2.452  16.412
  370   2HH2  ARG  49          1HH1      ARG  49  -8.021   3.035  17.380
  371    H    PHE  50           H        PHE  50  -7.837   1.658   7.402
  372    HA   PHE  50           HA       PHE  50  -9.741  -0.555   7.307
  373   1HB   PHE  50          2HB       PHE  50  -9.734   1.630   5.882
  374   2HB   PHE  50          3HB       PHE  50  -8.533   0.815   4.893
  375    HD1  PHE  50           1HD      PHE  50 -11.921   0.315   6.441
  376    HD2  PHE  50           2HD      PHE  50  -9.408  -0.372   3.006
  377    HE1  PHE  50           1HE      PHE  50 -13.830  -0.718   5.252
  378    HE2  PHE  50           2HE      PHE  50 -11.349  -1.339   1.798
  379    HZ   PHE  50           HZ       PHE  50 -13.531  -1.606   2.948
  380    H    ILE  51           H        ILE  51  -6.327   0.076   6.415
  381    HA   ILE  51           HA       ILE  51  -5.983  -2.387   5.016
  382    HB   ILE  51           HB       ILE  51  -3.742  -0.829   6.318
  383   1HG1  ILE  51          2HG1      ILE  51  -4.659   0.871   5.045
  384   2HG1  ILE  51          3HG1      ILE  51  -3.477   0.173   3.984
  385   1HG2  ILE  51          1HG2      ILE  51  -3.135  -3.063   5.469
  386   2HG2  ILE  51          2HG2      ILE  51  -3.865  -2.681   3.904
  387   3HG2  ILE  51          3HG2      ILE  51  -2.422  -1.805   4.458
  388   1HD1  ILE  51          1HD1      ILE  51  -5.467   0.693   2.744
  389   2HD1  ILE  51          2HD1      ILE  51  -5.361  -1.082   2.813
  390   3HD1  ILE  51          3HD1      ILE  51  -6.507  -0.206   3.837
  391    H    ASP  52           H        ASP  52  -5.056  -1.514   8.406
  392    HA   ASP  52           HA       ASP  52  -4.342  -4.264   9.140
  393   1HB   ASP  52          2HB       ASP  52  -4.634  -1.666  10.605
  394   2HB   ASP  52          3HB       ASP  52  -4.981  -3.126  11.512
  395    H    ASN  53           H        ASN  53  -6.156  -5.143   7.984
  396    HA   ASN  53           HA       ASN  53  -8.859  -4.838   8.867
  397   1HB   ASN  53          2HB       ASN  53  -8.022  -5.822   6.688
  398   2HB   ASN  53          3HB       ASN  53  -7.648  -7.312   7.573
  399   1HD2  ASN  53          1HD2      ASN  53  -9.431  -8.629   8.290
  400   2HD2  ASN  53          2HD2      ASN  53 -11.061  -8.343   7.719
  401    H    ASP  54           H        ASP  54  -6.134  -6.777  10.027
  402    HA   ASP  54           HA       ASP  54  -7.629  -8.363  11.915
  403   1HB   ASP  54          2HB       ASP  54  -5.495  -8.936  12.844
  404   2HB   ASP  54          3HB       ASP  54  -5.410  -9.023  11.081
  405    H    GLN  55           H        GLN  55  -5.807  -5.375  12.065
  406    HA   GLN  55           HA       GLN  55  -6.548  -3.364  12.970
  407   1HB   GLN  55          2HB       GLN  55  -8.079  -2.919  14.496
  408   2HB   GLN  55          3HB       GLN  55  -8.752  -4.296  13.637
  409   1HG   GLN  55          2HG       GLN  55  -8.986  -5.387  15.593
  410   2HG   GLN  55          3HG       GLN  55  -7.241  -5.328  15.846
  411   1HE2  GLN  55          1HE2      GLN  55 -10.001  -2.975  16.004
  412   2HE2  GLN  55          2HE2      GLN  55  -9.557  -2.364  17.594
  413    H    SER  56           H        SER  56  -4.268  -5.397  13.609
  414    HA   SER  56           HA       SER  56  -3.675  -4.859  16.388
  415   1HB   SER  56          2HB       SER  56  -1.442  -5.926  15.801
  416   2HB   SER  56          3HB       SER  56  -2.907  -6.900  15.615
  417    HG   SER  56           HG       SER  56  -2.465  -7.146  13.655
  418    H    GLY  57           H        GLY  57  -2.463  -3.417  13.316
  419   1HA   GLY  57          1HA       GLY  57  -1.914  -1.029  13.423
  420   2HA   GLY  57          2HA       GLY  57  -1.125  -1.282  14.981
  421    H    TYR  58           H        TYR  58  -0.029  -3.934  13.967
  422    HA   TYR  58           HA       TYR  58   2.315  -2.929  12.472
  423   1HB   TYR  58          2HB       TYR  58   1.569  -5.707  13.449
  424   2HB   TYR  58          3HB       TYR  58   3.056  -5.286  12.608
  425    HD1  TYR  58           HD1      TYR  58   1.426  -5.450  15.831
  426    HD2  TYR  58           HD2      TYR  58   4.620  -3.531  13.661
  427    HE1  TYR  58           HE1      TYR  58   2.463  -4.744  17.972
  428    HE2  TYR  58           HE2      TYR  58   5.650  -2.826  15.798
  429    HH   TYR  58           HH       TYR  58   5.456  -2.799  18.096
  430    H    LEU  59           H        LEU  59   2.540  -3.225  10.302
  431    HA   LEU  59           HA       LEU  59   0.290  -4.487   8.772
  432   1HB   LEU  59          2HB       LEU  59   2.478  -2.534   7.990
  433   2HB   LEU  59          3HB       LEU  59   1.526  -3.440   6.815
  434    HG   LEU  59           HG       LEU  59   0.631  -1.213   7.064
  435   1HD1  LEU  59          1HD1      LEU  59  -0.910  -3.105   6.587
  436   2HD1  LEU  59          2HD1      LEU  59  -1.356  -3.134   8.312
  437   3HD1  LEU  59          3HD1      LEU  59  -1.680  -1.698   7.342
  438   1HD2  LEU  59          1HD2      LEU  59   0.054  -1.834   9.981
  439   2HD2  LEU  59          2HD2      LEU  59   1.296  -0.714   9.393
  440   3HD2  LEU  59          3HD2      LEU  59  -0.434  -0.400   9.105
  441    H    ASP  60           H        ASP  60   1.027  -6.378   9.850
  442    HA   ASP  60           HA       ASP  60   3.535  -7.594   9.448
  443   1HB   ASP  60          2HB       ASP  60   0.987  -9.202   9.648
  444   2HB   ASP  60          3HB       ASP  60   2.569  -9.450  10.414
  445    H    GLU  61           H        GLU  61   4.023  -9.493   7.929
  446    HA   GLU  61           HA       GLU  61   3.934  -8.721   5.356
  447   1HB   GLU  61          2HB       GLU  61   5.155 -10.697   6.617
  448   2HB   GLU  61          3HB       GLU  61   3.895 -11.703   5.911
  449   1HG   GLU  61          2HG       GLU  61   5.273  -9.784   4.028
  450   2HG   GLU  61          3HG       GLU  61   6.278 -11.007   4.802
  451    H    GLU  62           H        GLU  62   1.679 -11.193   6.719
  452    HA   GLU  62           HA       GLU  62   0.105 -11.453   4.472
  453   1HB   GLU  62          2HB       GLU  62  -0.608 -11.766   7.424
  454   2HB   GLU  62          3HB       GLU  62  -1.654 -12.257   6.087
  455   1HG   GLU  62          2HG       GLU  62  -0.582 -14.245   6.405
  456   2HG   GLU  62          3HG       GLU  62   0.571 -13.517   5.256
  457    H    GLU  63           H        GLU  63  -0.088  -8.647   6.693
  458    HA   GLU  63           HA       GLU  63  -2.686  -7.817   5.655
  459   1HB   GLU  63          2HB       GLU  63  -0.577  -6.567   7.323
  460   2HB   GLU  63          3HB       GLU  63  -1.233  -5.477   6.104
  461   1HG   GLU  63          2HG       GLU  63  -2.596  -5.142   7.950
  462   2HG   GLU  63          3HG       GLU  63  -3.581  -6.135   6.874
  463    H    LEU  64           H        LEU  64   0.692  -7.555   4.648
  464    HA   LEU  64           HA       LEU  64   0.055  -6.005   2.272
  465   1HB   LEU  64          2HB       LEU  64   2.400  -6.607   3.801
  466   2HB   LEU  64          3HB       LEU  64   2.683  -7.277   2.207
  467    HG   LEU  64           HG       LEU  64   1.876  -4.408   2.860
  468   1HD1  LEU  64          1HD1      LEU  64   4.499  -5.598   1.857
  469   2HD1  LEU  64          2HD1      LEU  64   4.190  -3.875   2.144
  470   3HD1  LEU  64          3HD1      LEU  64   4.197  -5.010   3.506
  471   1HD2  LEU  64          1HD2      LEU  64   2.657  -5.597   0.150
  472   2HD2  LEU  64          2HD2      LEU  64   1.027  -5.053   0.581
  473   3HD2  LEU  64          3HD2      LEU  64   2.351  -3.890   0.521
  474    H    LYS  65           H        LYS  65  -0.909  -8.996   2.948
  475    HA   LYS  65           HA       LYS  65  -0.545 -10.005   0.175
  476   1HB   LYS  65          2HB       LYS  65  -0.008 -11.431   2.215
  477   2HB   LYS  65          3HB       LYS  65  -1.756 -11.389   2.567
  478   1HG   LYS  65          2HG       LYS  65  -2.278 -12.651   0.605
  479   2HG   LYS  65          3HG       LYS  65  -0.640 -12.436  -0.036
  480   1HD   LYS  65          2HD       LYS  65  -0.871 -14.685   0.899
  481   2HD   LYS  65          3HD       LYS  65   0.317 -13.733   1.802
  482   1HE   LYS  65          2HE       LYS  65  -1.498 -13.269   3.552
  483   2HE   LYS  65          3HE       LYS  65  -2.555 -14.374   2.661
  484   1HZ   LYS  65          1HZ       LYS  65  -1.432 -15.390   4.521
  485   2HZ   LYS  65          2HZ       LYS  65  -0.907 -16.100   3.129
  486   3HZ   LYS  65          3HZ       LYS  65   0.039 -15.007   3.925
  487    H    PHE  66           H        PHE  66  -2.532  -7.918   1.962
  488    HA   PHE  66           HA       PHE  66  -4.524  -8.231  -0.145
  489   1HB   PHE  66          2HB       PHE  66  -6.455  -8.254   1.446
  490   2HB   PHE  66          3HB       PHE  66  -5.505  -9.720   1.387
  491    HD1  PHE  66           1HD      PHE  66  -4.403 -10.574   3.350
  492    HD2  PHE  66           2HD      PHE  66  -6.127  -6.620   3.434
  493    HE1  PHE  66           1HE      PHE  66  -4.396 -10.610   5.828
  494    HE2  PHE  66           2HE      PHE  66  -5.934  -6.611   5.897
  495    HZ   PHE  66           HZ       PHE  66  -5.285  -8.686   7.102
  496    H    PHE  67           H        PHE  67  -2.533  -6.150   0.557
  497    HA   PHE  67           HA       PHE  67  -3.745  -3.954   1.914
  498   1HB   PHE  67          2HB       PHE  67  -1.367  -4.113   1.595
  499   2HB   PHE  67          3HB       PHE  67  -1.531  -4.118  -0.143
  500    HD1  PHE  67           1HD      PHE  67  -3.479  -1.595   1.765
  501    HD2  PHE  67           2HD      PHE  67   0.158  -2.471  -0.339
  502    HE1  PHE  67           1HE      PHE  67  -2.867   0.813   1.815
  503    HE2  PHE  67           2HE      PHE  67   0.790  -0.067  -0.266
  504    HZ   PHE  67           HZ       PHE  67  -0.724   1.576   0.835
  505    H    LEU  68           H        LEU  68  -3.242  -4.287  -1.684
  506    HA   LEU  68           HA       LEU  68  -5.358  -2.359  -2.159
  507   1HB   LEU  68          2HB       LEU  68  -3.647  -4.067  -3.972
  508   2HB   LEU  68          3HB       LEU  68  -4.954  -2.994  -4.538
  509    HG   LEU  68           HG       LEU  68  -3.748  -1.074  -3.414
  510   1HD1  LEU  68          1HD1      LEU  68  -2.132  -2.430  -2.052
  511   2HD1  LEU  68          2HD1      LEU  68  -1.362  -2.959  -3.568
  512   3HD1  LEU  68          3HD1      LEU  68  -1.347  -1.258  -3.090
  513   1HD2  LEU  68          1HD2      LEU  68  -1.950  -1.328  -5.444
  514   2HD2  LEU  68          2HD2      LEU  68  -3.077  -2.587  -5.910
  515   3HD2  LEU  68          3HD2      LEU  68  -3.659  -0.923  -5.697
  516    H    GLN  69           H        GLN  69  -5.420  -5.811  -1.740
  517    HA   GLN  69           HA       GLN  69  -7.638  -6.541  -3.396
  518   1HB   GLN  69          2HB       GLN  69  -6.772  -7.487  -0.660
  519   2HB   GLN  69          3HB       GLN  69  -8.120  -8.210  -1.527
  520   1HG   GLN  69          2HG       GLN  69  -5.368  -8.017  -2.785
  521   2HG   GLN  69          3HG       GLN  69  -5.842  -9.376  -1.750
  522   1HE2  GLN  69          1HE2      GLN  69  -5.433  -8.608  -4.955
  523   2HE2  GLN  69          2HE2      GLN  69  -6.698  -9.615  -5.583
  524    H    LYS  70           H        LYS  70  -7.464  -4.750  -0.320
  525    HA   LYS  70           HA       LYS  70 -10.262  -4.782   0.264
  526   1HB   LYS  70          2HB       LYS  70  -8.346  -2.516   0.918
  527   2HB   LYS  70          3HB       LYS  70  -9.827  -3.003   1.742
  528   1HG   LYS  70          2HG       LYS  70  -8.348  -5.319   1.996
  529   2HG   LYS  70          3HG       LYS  70  -7.070  -4.096   1.908
  530   1HD   LYS  70          2HD       LYS  70  -7.538  -4.231   4.214
  531   2HD   LYS  70          3HD       LYS  70  -8.385  -2.778   3.670
  532   1HE   LYS  70          2HE       LYS  70 -10.415  -4.570   3.315
  533   2HE   LYS  70          3HE       LYS  70  -9.449  -5.506   4.458
  534   1HZ   LYS  70          1HZ       LYS  70 -10.895  -4.333   5.757
  535   2HZ   LYS  70          2HZ       LYS  70  -9.532  -3.414   5.853
  536   3HZ   LYS  70          3HZ       LYS  70 -10.757  -2.911   4.884
  537    H    PHE  71           H        PHE  71  -8.434  -3.071  -2.161
  538    HA   PHE  71           HA       PHE  71 -10.473  -0.956  -2.530
  539   1HB   PHE  71          2HB       PHE  71  -7.889  -1.294  -4.055
  540   2HB   PHE  71          3HB       PHE  71  -8.869   0.145  -3.833
  541    HD1  PHE  71           1HD      PHE  71  -8.977  -0.427  -0.600
  542    HD2  PHE  71           2HD      PHE  71  -5.927   0.095  -3.607
  543    HE1  PHE  71           1HE      PHE  71  -7.338   0.161   1.151
  544    HE2  PHE  71           2HE      PHE  71  -4.321   0.770  -1.853
  545    HZ   PHE  71           HZ       PHE  71  -4.996   0.753   0.520
  546    H    GLU  72           H        GLU  72  -8.736  -3.563  -4.306
  547    HA   GLU  72           HA       GLU  72 -10.811  -3.550  -6.436
  548   1HB   GLU  72          2HB       GLU  72  -8.818  -2.091  -6.974
  549   2HB   GLU  72          3HB       GLU  72  -7.797  -3.511  -6.909
  550   1HG   GLU  72          2HG       GLU  72 -10.216  -3.569  -8.723
  551   2HG   GLU  72          3HG       GLU  72  -8.826  -2.580  -9.186
  552    H    SER  73           H        SER  73 -11.202  -5.610  -7.295
  553    HA   SER  73           HA       SER  73 -10.956  -7.641  -5.369
  554   1HB   SER  73          2HB       SER  73 -11.988  -8.959  -7.432
  555   2HB   SER  73          3HB       SER  73 -12.897  -7.646  -6.665
  556    HG   SER  73           HG       SER  73 -11.201  -7.192  -8.904
  557    H    GLY  74           H        GLY  74  -8.990  -6.997  -8.224
  558   1HA   GLY  74          1HA       GLY  74  -7.576  -9.636  -7.942
  559   2HA   GLY  74          2HA       GLY  74  -7.930  -8.821  -9.473
  560    H    ALA  75           H        ALA  75  -7.069  -6.873  -6.664
  561    HA   ALA  75           HA       ALA  75  -4.865  -5.703  -8.019
  562   1HB   ALA  75          1HB       ALA  75  -5.380  -5.791  -5.017
  563   2HB   ALA  75          2HB       ALA  75  -4.355  -4.654  -5.940
  564   3HB   ALA  75          3HB       ALA  75  -6.116  -4.624  -6.141
  565    H    ARG  76           H        ARG  76  -2.626  -5.784  -7.472
  566    HA   ARG  76           HA       ARG  76  -1.811  -8.401  -7.875
  567   1HB   ARG  76          2HB       ARG  76  -0.838  -6.039  -8.647
  568   2HB   ARG  76          3HB       ARG  76   0.164  -6.215  -7.209
  569   1HG   ARG  76          2HG       ARG  76   1.517  -7.427  -8.490
  570   2HG   ARG  76          3HG       ARG  76   0.406  -8.730  -8.283
  571   1HD   ARG  76          2HD       ARG  76   0.262  -8.821 -10.544
  572   2HD   ARG  76          3HD       ARG  76  -0.898  -7.513 -10.403
  573    HE   ARG  76           HE       ARG  76   2.041  -7.286 -10.993
  574   1HH1  ARG  76          2HH2      ARG  76  -1.107  -5.550 -11.095
  575   2HH1  ARG  76          1HH2      ARG  76  -0.277  -4.129 -11.737
  576   1HH2  ARG  76          2HH1      ARG  76   2.886  -5.525 -11.677
  577   2HH2  ARG  76          1HH1      ARG  76   1.906  -4.116 -12.157
  578    H    GLU  77           H        GLU  77  -2.683  -7.859  -4.936
  579    HA   GLU  77           HA       GLU  77  -0.481  -7.964  -3.208
  580   1HB   GLU  77          2HB       GLU  77  -3.244  -9.198  -2.861
  581   2HB   GLU  77          3HB       GLU  77  -2.057  -8.843  -1.597
  582   1HG   GLU  77          2HG       GLU  77  -3.272  -6.683  -3.402
  583   2HG   GLU  77          3HG       GLU  77  -3.798  -7.057  -1.765
  584    H    LEU  78           H        LEU  78  -2.195 -10.478  -4.890
  585    HA   LEU  78           HA       LEU  78  -1.058 -12.763  -3.764
  586   1HB   LEU  78          2HB       LEU  78  -1.489 -12.719  -6.743
  587   2HB   LEU  78          3HB       LEU  78  -1.741 -13.998  -5.573
  588    HG   LEU  78           HG       LEU  78  -3.863 -13.531  -6.129
  589   1HD1  LEU  78          1HD1      LEU  78  -5.074 -12.488  -4.407
  590   2HD1  LEU  78          2HD1      LEU  78  -3.612 -13.135  -3.639
  591   3HD1  LEU  78          3HD1      LEU  78  -3.767 -11.395  -3.972
  592   1HD2  LEU  78          1HD2      LEU  78  -4.807 -11.351  -6.733
  593   2HD2  LEU  78          2HD2      LEU  78  -3.245 -10.575  -6.429
  594   3HD2  LEU  78          3HD2      LEU  78  -3.385 -11.766  -7.714
  595    H    THR  79           H        THR  79   0.454 -10.513  -6.162
  596    HA   THR  79           HA       THR  79   2.545 -12.459  -6.762
  597    HB   THR  79           HB       THR  79   2.554  -9.506  -7.425
  598    HG1  THR  79           1HG      THR  79   2.273 -10.757  -9.525
  599   1HG2  THR  79          1HG2      THR  79   4.262 -10.322  -9.120
  600   2HG2  THR  79          2HG2      THR  79   4.803 -10.623  -7.473
  601   3HG2  THR  79          3HG2      THR  79   4.135 -11.944  -8.436
  602    H    GLU  80           H        GLU  80   3.797 -12.968  -5.209
  603    HA   GLU  80           HA       GLU  80   4.327 -11.541  -2.851
  604   1HB   GLU  80          2HB       GLU  80   6.100 -13.153  -2.426
  605   2HB   GLU  80          3HB       GLU  80   4.624 -13.915  -3.016
  606   1HG   GLU  80          2HG       GLU  80   5.704 -13.986  -5.346
  607   2HG   GLU  80          3HG       GLU  80   7.212 -13.466  -4.562
  608    H    SER  81           H        SER  81   6.212 -11.595  -5.888
  609    HA   SER  81           HA       SER  81   8.357  -9.967  -5.014
  610   1HB   SER  81          2HB       SER  81   7.167 -10.366  -7.774
  611   2HB   SER  81          3HB       SER  81   8.650  -9.457  -7.462
  612    HG   SER  81           HG       SER  81   8.133 -12.198  -6.922
  613    H    GLU  82           H        GLU  82   5.343  -8.850  -6.758
  614    HA   GLU  82           HA       GLU  82   5.987  -6.111  -6.535
  615   1HB   GLU  82          2HB       GLU  82   3.196  -7.338  -6.624
  616   2HB   GLU  82          3HB       GLU  82   3.664  -5.674  -6.966
  617   1HG   GLU  82          2HG       GLU  82   5.401  -6.961  -8.636
  618   2HG   GLU  82          3HG       GLU  82   4.120  -8.176  -8.586
  619    H    THR  83           H        THR  83   4.046  -8.225  -4.346
  620    HA   THR  83           HA       THR  83   3.447  -6.283  -2.522
  621    HB   THR  83           HB       THR  83   3.728  -9.244  -2.414
  622    HG1  THR  83           1HG      THR  83   1.798  -7.929  -1.001
  623   1HG2  THR  83          1HG2      THR  83   4.921  -8.910  -0.324
  624   2HG2  THR  83          2HG2      THR  83   3.763  -7.664   0.186
  625   3HG2  THR  83          3HG2      THR  83   3.252  -9.354   0.036
  626    H    LYS  84           H        LYS  84   6.389  -8.309  -2.788
  627    HA   LYS  84           HA       LYS  84   7.692  -7.357  -0.477
  628   1HB   LYS  84          2HB       LYS  84   8.668  -8.861  -2.896
  629   2HB   LYS  84          3HB       LYS  84   9.773  -8.385  -1.607
  630   1HG   LYS  84          2HG       LYS  84   7.201  -9.810  -0.907
  631   2HG   LYS  84          3HG       LYS  84   8.581 -10.737  -1.517
  632   1HD   LYS  84          2HD       LYS  84   9.919 -10.254   0.360
  633   2HD   LYS  84          3HD       LYS  84   9.046  -8.773   0.734
  634   1HE   LYS  84          2HE       LYS  84   8.564 -10.504   2.417
  635   2HE   LYS  84          3HE       LYS  84   7.112  -9.972   1.566
  636   1HZ   LYS  84          1HZ       LYS  84   7.058 -12.256   1.792
  637   2HZ   LYS  84          2HZ       LYS  84   7.281 -11.976   0.205
  638   3HZ   LYS  84          3HZ       LYS  84   8.549 -12.507   1.128
  639    H    SER  85           H        SER  85   7.655  -6.126  -3.801
  640    HA   SER  85           HA       SER  85   9.687  -4.190  -3.580
  641   1HB   SER  85          2HB       SER  85   8.322  -4.789  -5.633
  642   2HB   SER  85          3HB       SER  85   7.030  -3.749  -4.996
  643    HG   SER  85           HG       SER  85   8.560  -2.724  -6.470
  644    H    LEU  86           H        LEU  86   6.244  -4.025  -2.504
  645    HA   LEU  86           HA       LEU  86   6.495  -1.356  -1.383
  646   1HB   LEU  86          2HB       LEU  86   4.535  -3.628  -0.882
  647   2HB   LEU  86          3HB       LEU  86   4.436  -2.085  -0.049
  648    HG   LEU  86           HG       LEU  86   4.501  -2.171  -3.083
  649   1HD1  LEU  86          1HD1      LEU  86   1.963  -2.194  -2.944
  650   2HD1  LEU  86          2HD1      LEU  86   2.716  -3.708  -2.418
  651   3HD1  LEU  86          3HD1      LEU  86   2.133  -2.530  -1.224
  652   1HD2  LEU  86          1HD2      LEU  86   3.329  -0.017  -2.811
  653   2HD2  LEU  86          2HD2      LEU  86   3.198  -0.272  -1.064
  654   3HD2  LEU  86          3HD2      LEU  86   4.780   0.015  -1.807
  655    H    MET  87           H        MET  87   6.375  -4.606   0.144
  656    HA   MET  87           HA       MET  87   7.006  -4.074   2.737
  657   1HB   MET  87          2HB       MET  87   6.754  -6.347   1.585
  658   2HB   MET  87          3HB       MET  87   8.442  -6.162   1.083
  659   1HG   MET  87          2HG       MET  87   8.612  -7.540   2.832
  660   2HG   MET  87          3HG       MET  87   9.039  -6.007   3.580
  661   1HE   MET  87          1HE       MET  87   7.651  -9.189   4.350
  662   2HE   MET  87          2HE       MET  87   8.746  -8.211   5.330
  663   3HE   MET  87          3HE       MET  87   7.148  -8.687   5.982
  664    H    ALA  88           H        ALA  88   9.403  -4.391   0.138
  665    HA   ALA  88           HA       ALA  88  11.761  -4.296   1.540
  666   1HB   ALA  88          1HB       ALA  88  11.646  -4.976  -0.783
  667   2HB   ALA  88          2HB       ALA  88  11.101  -3.375  -1.295
  668   3HB   ALA  88          3HB       ALA  88  12.755  -3.598  -0.673
  669    H    ALA  89           H        ALA  89  10.024  -1.478   0.120
  670    HA   ALA  89           HA       ALA  89  12.034   0.382   1.232
  671   1HB   ALA  89          1HB       ALA  89  11.073   0.989  -0.851
  672   2HB   ALA  89          2HB       ALA  89   9.408   0.816  -0.208
  673   3HB   ALA  89          3HB       ALA  89  10.470   2.126   0.362
  674    H    ALA  90           H        ALA  90   8.607  -0.542   1.878
  675    HA   ALA  90           HA       ALA  90   8.065   1.430   3.836
  676   1HB   ALA  90          1HB       ALA  90   6.299  -0.146   4.565
  677   2HB   ALA  90          2HB       ALA  90   6.384  -0.061   2.787
  678   3HB   ALA  90          3HB       ALA  90   7.074  -1.453   3.646
  679    H    ASP  91           H        ASP  91   9.652  -1.770   4.112
  680    HA   ASP  91           HA       ASP  91   9.808  -1.577   6.972
  681   1HB   ASP  91          2HB       ASP  91   9.676  -3.752   5.696
  682   2HB   ASP  91          3HB       ASP  91  11.373  -3.511   5.226
  683    H    ASN  92           H        ASN  92  11.129  -0.071   7.856
  684    HA   ASN  92           HA       ASN  92  13.633   0.768   6.416
  685   1HB   ASN  92          2HB       ASN  92  12.019   2.143   8.598
  686   2HB   ASN  92          3HB       ASN  92  13.565   2.710   7.967
  687   1HD2  ASN  92          1HD2      ASN  92  10.207   1.870   6.768
  688   2HD2  ASN  92          2HD2      ASN  92  10.274   3.105   5.550
  689    H    ASP  93           H        ASP  93  13.288  -1.756   7.943
  690    HA   ASP  93           HA       ASP  93  15.394  -1.355  10.053
  691   1HB   ASP  93          2HB       ASP  93  13.145  -3.400   9.910
  692   2HB   ASP  93          3HB       ASP  93  14.483  -3.454  11.056
  693    H    GLY  94           H        GLY  94  13.902  -3.634   7.731
  694   1HA   GLY  94          1HA       GLY  94  15.014  -5.226   6.355
  695   2HA   GLY  94          2HA       GLY  94  16.485  -5.084   7.336
  696    H    ASP  95           H        ASP  95  13.024  -5.311   8.330
  697    HA   ASP  95           HA       ASP  95  13.555  -8.010   9.473
  698   1HB   ASP  95          2HB       ASP  95  12.093  -7.592  11.340
  699   2HB   ASP  95          3HB       ASP  95  13.590  -6.661  11.382
  700    H    GLY  96           H        GLY  96  10.788  -5.807   8.837
  701   1HA   GLY  96          1HA       GLY  96   9.501  -6.479   6.757
  702   2HA   GLY  96          2HA       GLY  96   9.451  -8.125   7.433
  703    H    LYS  97           H        LYS  97   9.132  -7.239  10.206
  704    HA   LYS  97           HA       LYS  97   6.339  -6.615  10.392
  705   1HB   LYS  97          2HB       LYS  97   6.761  -6.130  12.733
  706   2HB   LYS  97          3HB       LYS  97   7.396  -7.695  12.218
  707   1HG   LYS  97          2HG       LYS  97   9.694  -6.716  12.143
  708   2HG   LYS  97          3HG       LYS  97   9.046  -5.191  12.781
  709   1HD   LYS  97          2HD       LYS  97   8.101  -6.502  14.724
  710   2HD   LYS  97          3HD       LYS  97   8.988  -7.916  14.153
  711   1HE   LYS  97          2HE       LYS  97  10.192  -5.225  15.007
  712   2HE   LYS  97          3HE       LYS  97  10.152  -6.696  15.994
  713   1HZ   LYS  97          1HZ       LYS  97  11.546  -7.732  14.232
  714   2HZ   LYS  97          2HZ       LYS  97  11.624  -6.253  13.505
  715   3HZ   LYS  97          3HZ       LYS  97  12.272  -6.442  14.971
  716    H    ILE  98           H        ILE  98   5.702  -4.913   9.230
  717    HA   ILE  98           HA       ILE  98   7.084  -2.300   9.409
  718    HB   ILE  98           HB       ILE  98   4.881  -3.413   7.669
  719   1HG1  ILE  98          2HG1      ILE  98   7.501  -2.201   6.756
  720   2HG1  ILE  98          3HG1      ILE  98   7.503  -3.854   7.361
  721   1HG2  ILE  98          1HG2      ILE  98   5.997  -0.583   7.779
  722   2HG2  ILE  98          2HG2      ILE  98   5.068  -1.234   6.436
  723   3HG2  ILE  98          3HG2      ILE  98   4.309  -1.068   8.025
  724   1HD1  ILE  98          1HD1      ILE  98   5.798  -4.517   5.733
  725   2HD1  ILE  98          2HD1      ILE  98   5.785  -2.879   5.049
  726   3HD1  ILE  98          3HD1      ILE  98   7.263  -3.863   4.969
  727    H    GLY  99           H        GLY  99   6.002  -0.516  10.221
  728   1HA   GLY  99          1HA       GLY  99   3.577  -0.974  11.934
  729   2HA   GLY  99          2HA       GLY  99   4.923   0.094  12.373
  730    H    ALA 100           H        ALA 100   2.425   1.185  12.312
  731    HA   ALA 100           HA       ALA 100   1.576   2.229   9.820
  732   1HB   ALA 100          1HB       ALA 100   0.147   2.247  11.805
  733   2HB   ALA 100          2HB       ALA 100   1.257   3.385  12.615
  734   3HB   ALA 100          3HB       ALA 100   0.368   3.887  11.157
  735    H    GLU 101           H        GLU 101   3.698   3.578  12.404
  736    HA   GLU 101           HA       GLU 101   4.331   5.932  11.127
  737   1HB   GLU 101          2HB       GLU 101   6.358   5.988  12.572
  738   2HB   GLU 101          3HB       GLU 101   4.823   5.680  13.388
  739   1HG   GLU 101          2HG       GLU 101   5.418   3.165  13.255
  740   2HG   GLU 101          3HG       GLU 101   7.042   3.709  12.797
  741    H    GLU 102           H        GLU 102   6.205   2.907  10.998
  742    HA   GLU 102           HA       GLU 102   8.157   3.548   9.136
  743   1HB   GLU 102          2HB       GLU 102   6.909   1.089  10.133
  744   2HB   GLU 102          3HB       GLU 102   7.421   0.934   8.440
  745   1HG   GLU 102          2HG       GLU 102   9.689   1.677   9.094
  746   2HG   GLU 102          3HG       GLU 102   9.191   1.661  10.792
  747    H    PHE 103           H        PHE 103   4.812   2.314   8.334
  748    HA   PHE 103           HA       PHE 103   5.432   2.592   5.502
  749   1HB   PHE 103          2HB       PHE 103   3.173   1.562   7.020
  750   2HB   PHE 103          3HB       PHE 103   2.643   2.613   5.692
  751    HD1  PHE 103           1HD      PHE 103   2.638  -0.600   6.250
  752    HD2  PHE 103           2HD      PHE 103   4.279   2.230   3.447
  753    HE1  PHE 103           1HE      PHE 103   2.390  -2.261   4.433
  754    HE2  PHE 103           2HE      PHE 103   4.003   0.575   1.626
  755    HZ   PHE 103           HZ       PHE 103   3.045  -1.669   2.110
  756    H    GLN 104           H        GLN 104   3.860   4.734   7.891
  757    HA   GLN 104           HA       GLN 104   2.671   6.651   6.084
  758   1HB   GLN 104          2HB       GLN 104   2.358   6.459   8.654
  759   2HB   GLN 104          3HB       GLN 104   3.903   7.289   8.786
  760   1HG   GLN 104          2HG       GLN 104   2.417   8.783   6.857
  761   2HG   GLN 104          3HG       GLN 104   1.236   8.313   8.078
  762   1HE2  GLN 104          1HE2      GLN 104   3.797  10.458   7.272
  763   2HE2  GLN 104          2HE2      GLN 104   3.934  11.234   8.843
  764    H    GLU 105           H        GLU 105   5.951   6.555   7.707
  765    HA   GLU 105           HA       GLU 105   6.955   8.894   6.518
  766   1HB   GLU 105          2HB       GLU 105   8.216   6.276   7.403
  767   2HB   GLU 105          3HB       GLU 105   9.211   7.477   6.575
  768   1HG   GLU 105          2HG       GLU 105   7.550   8.308   8.971
  769   2HG   GLU 105          3HG       GLU 105   9.126   7.525   9.159
  770    H    MET 106           H        MET 106   7.136   5.551   5.225
  771    HA   MET 106           HA       MET 106   8.402   6.354   2.817
  772   1HB   MET 106          2HB       MET 106   7.483   3.886   3.977
  773   2HB   MET 106          3HB       MET 106   6.886   3.963   2.320
  774   1HG   MET 106          2HG       MET 106   9.147   2.981   2.403
  775   2HG   MET 106          3HG       MET 106   9.172   4.510   1.523
  776   1HE   MET 106          1HE       MET 106  11.764   4.812   1.628
  777   2HE   MET 106          2HE       MET 106  12.709   4.578   3.118
  778   3HE   MET 106          3HE       MET 106  11.861   3.203   2.384
  779    H    VAL 107           H        VAL 107   4.956   5.612   3.343
  780    HA   VAL 107           HA       VAL 107   3.974   6.292   0.818
  781    HB   VAL 107           HB       VAL 107   2.736   6.458   3.581
  782   1HG1  VAL 107          1HG1      VAL 107   0.543   6.597   2.279
  783   2HG1  VAL 107          2HG1      VAL 107   1.494   8.086   2.321
  784   3HG1  VAL 107          3HG1      VAL 107   1.527   7.064   0.870
  785   1HG2  VAL 107          1HG2      VAL 107   1.549   4.452   2.828
  786   2HG2  VAL 107          2HG2      VAL 107   2.246   4.600   1.202
  787   3HG2  VAL 107          3HG2      VAL 107   3.284   4.194   2.578
  788    H    HIS 108           H        HIS 108   4.701   8.434   3.571
  789    HA   HIS 108           HA       HIS 108   3.373  10.691   2.475
  790   1HB   HIS 108          2HB       HIS 108   3.590  10.262   4.856
  791   2HB   HIS 108          3HB       HIS 108   5.356  10.419   4.752
  792    HD1  HIS 108           1HD      HIS 108   5.832  12.564   6.070
  793    HD2  HIS 108           2HD      HIS 108   2.449  12.803   3.576
  794    HE1  HIS 108           1HE      HIS 108   4.848  14.904   6.385
  795    H    SER 109           H        SER 109   6.376   9.200   1.765
  796    HA   SER 109           HA       SER 109   7.982  11.516   1.303
  797   1HB   SER 109          2HB       SER 109   8.915   9.223   1.678
  798   2HB   SER 109          3HB       SER 109   8.223   8.737   0.108
  799    HG   SER 109           HG       SER 109   9.410  10.671  -0.688
  Start of MODEL   14
    1   1H    MET   1           H1       MET   1 -18.896   9.234   1.761
    2   2H    MET   1           H2       MET   1 -19.975   8.911   0.522
    3   3H    MET   1           H3       MET   1 -19.724   7.828   1.762
    4    HA   MET   1           HA       MET   1 -18.602   7.081  -0.185
    5   1HB   MET   1          2HB       MET   1 -16.973   9.654   0.216
    6   2HB   MET   1          3HB       MET   1 -16.614   8.372  -0.923
    7   1HG   MET   1          2HG       MET   1 -18.970  10.280  -1.018
    8   2HG   MET   1          3HG       MET   1 -17.654  10.108  -2.181
    9   1HE   MET   1          1HE       MET   1 -20.819  10.238  -2.899
   10   2HE   MET   1          2HE       MET   1 -19.518  10.148  -4.118
   11   3HE   MET   1          3HE       MET   1 -20.874   8.999  -4.176
   12    H    SER   2           H        SER   2 -16.328   6.238  -0.036
   13    HA   SER   2           HA       SER   2 -15.133   6.301   2.661
   14   1HB   SER   2          2HB       SER   2 -15.734   3.752   1.080
   15   2HB   SER   2          3HB       SER   2 -14.890   3.850   2.642
   16    HG   SER   2           HG       SER   2 -17.122   3.341   2.886
   17    H    ILE   3           H        ILE   3 -12.928   4.960   2.244
   18    HA   ILE   3           HA       ILE   3 -11.262   6.441   0.660
   19    HB   ILE   3           HB       ILE   3  -9.622   4.643   0.875
   20   1HG1  ILE   3          2HG1      ILE   3 -10.596   2.590   2.334
   21   2HG1  ILE   3          3HG1      ILE   3 -12.045   2.903   1.391
   22   1HG2  ILE   3          1HG2      ILE   3 -11.354   4.793   3.369
   23   2HG2  ILE   3          2HG2      ILE   3  -9.612   4.515   3.275
   24   3HG2  ILE   3          3HG2      ILE   3 -10.276   6.096   2.812
   25   1HD1  ILE   3          1HD1      ILE   3  -9.296   2.003   0.540
   26   2HD1  ILE   3          2HD1      ILE   3 -10.869   1.288   0.139
   27   3HD1  ILE   3          3HD1      ILE   3 -10.336   2.778  -0.666
   28    H    THR   4           H        THR   4 -13.136   3.624  -0.429
   29    HA   THR   4           HA       THR   4 -12.010   3.595  -3.114
   30    HB   THR   4           HB       THR   4 -12.330   1.440  -2.188
   31    HG1  THR   4           1HG      THR   4 -14.655   2.184  -3.519
   32   1HG2  THR   4          1HG2      THR   4 -13.663   1.790  -0.172
   33   2HG2  THR   4          2HG2      THR   4 -15.044   2.383  -1.141
   34   3HG2  THR   4          3HG2      THR   4 -14.540   0.688  -1.225
   35    H    ASP   5           H        ASP   5 -12.800   6.015  -2.786
   36    HA   ASP   5           HA       ASP   5 -14.629   6.577  -4.749
   37   1HB   ASP   5          2HB       ASP   5 -15.972   6.380  -2.052
   38   2HB   ASP   5          3HB       ASP   5 -16.347   7.799  -3.052
   39    H    VAL   6           H        VAL   6 -13.689   7.649  -1.509
   40    HA   VAL   6           HA       VAL   6 -13.959  10.316  -1.641
   41    HB   VAL   6           HB       VAL   6 -12.777   8.565   0.131
   42   1HG1  VAL   6          1HG1      VAL   6 -10.673   9.358   0.909
   43   2HG1  VAL   6          2HG1      VAL   6 -10.521   8.748  -0.739
   44   3HG1  VAL   6          3HG1      VAL   6 -10.550  10.509  -0.425
   45   1HG2  VAL   6          1HG2      VAL   6 -14.160  10.494   0.708
   46   2HG2  VAL   6          2HG2      VAL   6 -12.688  10.437   1.693
   47   3HG2  VAL   6          3HG2      VAL   6 -12.801  11.585   0.341
   48    H    LEU   7           H        LEU   7 -11.278   8.559  -2.974
   49    HA   LEU   7           HA       LEU   7 -10.368  10.534  -4.826
   50   1HB   LEU   7          2HB       LEU   7  -9.595  11.718  -2.829
   51   2HB   LEU   7          3HB       LEU   7  -8.910  10.252  -2.153
   52    HG   LEU   7           HG       LEU   7  -7.697  10.636  -4.758
   53   1HD1  LEU   7          1HD1      LEU   7  -7.687  13.056  -2.893
   54   2HD1  LEU   7          2HD1      LEU   7  -6.657  12.862  -4.337
   55   3HD1  LEU   7          3HD1      LEU   7  -8.426  12.991  -4.507
   56   1HD2  LEU   7          1HD2      LEU   7  -6.573  11.059  -1.958
   57   2HD2  LEU   7          2HD2      LEU   7  -6.696   9.480  -2.778
   58   3HD2  LEU   7          3HD2      LEU   7  -5.649  10.740  -3.438
   59    H    SER   8           H        SER   8  -9.036   8.157  -2.487
   60    HA   SER   8           HA       SER   8  -7.138   7.054  -3.966
   61   1HB   SER   8          2HB       SER   8  -8.789   5.441  -2.027
   62   2HB   SER   8          3HB       SER   8  -7.041   5.353  -2.363
   63    HG   SER   8           HG       SER   8  -6.841   7.436  -1.481
   64    H    ALA   9           H        ALA   9 -10.566   6.233  -4.383
   65    HA   ALA   9           HA       ALA   9 -10.387   3.857  -5.879
   66   1HB   ALA   9          1HB       ALA   9 -12.519   4.769  -5.284
   67   2HB   ALA   9          2HB       ALA   9 -12.210   6.269  -6.193
   68   3HB   ALA   9          3HB       ALA   9 -12.435   4.726  -7.047
   69    H    ASP  10           H        ASP  10  -9.856   7.243  -6.993
   70    HA   ASP  10           HA       ASP  10  -9.584   6.515  -9.784
   71   1HB   ASP  10          2HB       ASP  10 -10.219   8.779  -8.798
   72   2HB   ASP  10          3HB       ASP  10  -8.524   8.984  -8.337
   73    H    ASP  11           H        ASP  11  -7.429   7.006  -7.002
   74    HA   ASP  11           HA       ASP  11  -4.964   6.953  -8.449
   75   1HB   ASP  11          2HB       ASP  11  -5.489   6.330  -5.507
   76   2HB   ASP  11          3HB       ASP  11  -3.947   6.662  -6.297
   77    H    ILE  12           H        ILE  12  -6.707   4.416  -6.523
   78    HA   ILE  12           HA       ILE  12  -4.896   2.367  -7.159
   79    HB   ILE  12           HB       ILE  12  -6.529   0.839  -6.489
   80   1HG1  ILE  12          2HG1      ILE  12  -8.468   3.076  -6.540
   81   2HG1  ILE  12          3HG1      ILE  12  -8.567   1.544  -7.403
   82   1HG2  ILE  12          1HG2      ILE  12  -5.154   2.076  -4.842
   83   2HG2  ILE  12          2HG2      ILE  12  -6.521   3.159  -4.546
   84   3HG2  ILE  12          3HG2      ILE  12  -6.652   1.428  -4.182
   85   1HD1  ILE  12          1HD1      ILE  12 -10.136   1.356  -5.663
   86   2HD1  ILE  12          2HD1      ILE  12  -8.731   0.457  -5.059
   87   3HD1  ILE  12          3HD1      ILE  12  -9.051   2.123  -4.492
   88    H    ALA  13           H        ALA  13  -7.875   3.455  -8.909
   89    HA   ALA  13           HA       ALA  13  -7.819   1.491 -10.916
   90   1HB   ALA  13          1HB       ALA  13  -8.646   4.415 -11.051
   91   2HB   ALA  13          2HB       ALA  13  -8.882   3.255 -12.368
   92   3HB   ALA  13          3HB       ALA  13  -9.668   2.987 -10.797
   93    H    ALA  14           H        ALA  14  -5.902   4.552 -10.722
   94    HA   ALA  14           HA       ALA  14  -4.450   4.060 -13.159
   95   1HB   ALA  14          1HB       ALA  14  -3.481   5.548 -10.688
   96   2HB   ALA  14          2HB       ALA  14  -2.789   5.609 -12.315
   97   3HB   ALA  14          3HB       ALA  14  -4.425   6.249 -12.020
   98    H    ALA  15           H        ALA  15  -3.619   3.306  -9.737
   99    HA   ALA  15           HA       ALA  15  -1.124   2.220 -10.120
  100   1HB   ALA  15          1HB       ALA  15  -3.076   1.134  -8.060
  101   2HB   ALA  15          2HB       ALA  15  -1.314   1.320  -7.953
  102   3HB   ALA  15          3HB       ALA  15  -2.359   2.748  -7.909
  103    H    LEU  16           H        LEU  16  -4.230   0.608 -10.248
  104    HA   LEU  16           HA       LEU  16  -3.538  -2.056 -10.633
  105   1HB   LEU  16          2HB       LEU  16  -5.799  -1.569 -10.297
  106   2HB   LEU  16          3HB       LEU  16  -5.799  -0.265 -11.474
  107    HG   LEU  16           HG       LEU  16  -5.760  -1.857 -13.340
  108   1HD1  LEU  16          1HD1      LEU  16  -4.671  -3.816 -12.214
  109   2HD1  LEU  16          2HD1      LEU  16  -6.108  -4.002 -11.189
  110   3HD1  LEU  16          3HD1      LEU  16  -6.226  -4.237 -12.945
  111   1HD2  LEU  16          1HD2      LEU  16  -8.088  -2.560 -13.072
  112   2HD2  LEU  16          2HD2      LEU  16  -7.982  -2.328 -11.313
  113   3HD2  LEU  16          3HD2      LEU  16  -7.860  -0.935 -12.402
  114    H    GLN  17           H        GLN  17  -3.726   0.603 -13.037
  115    HA   GLN  17           HA       GLN  17  -2.879  -1.203 -15.214
  116   1HB   GLN  17          2HB       GLN  17  -3.883   1.630 -15.032
  117   2HB   GLN  17          3HB       GLN  17  -2.866   1.176 -16.408
  118   1HG   GLN  17          2HG       GLN  17  -4.324  -0.730 -16.933
  119   2HG   GLN  17          3HG       GLN  17  -5.401  -0.295 -15.594
  120   1HE2  GLN  17          1HE2      GLN  17  -6.686   1.666 -15.804
  121   2HE2  GLN  17          2HE2      GLN  17  -6.905   2.413 -17.380
  122    H    GLU  18           H        GLU  18  -1.311   1.215 -13.086
  123    HA   GLU  18           HA       GLU  18   0.999   1.281 -14.855
  124   1HB   GLU  18          2HB       GLU  18   1.971   2.769 -13.480
  125   2HB   GLU  18          3HB       GLU  18   0.260   3.057 -13.264
  126   1HG   GLU  18          2HG       GLU  18   0.848   3.164 -11.131
  127   2HG   GLU  18          3HG       GLU  18   0.626   1.402 -11.166
  128    H    CYS  19           H        CYS  19   0.054  -0.673 -12.046
  129    HA   CYS  19           HA       CYS  19   2.421  -2.445 -12.320
  130   1HB   CYS  19          2HB       CYS  19   0.117  -2.248 -10.344
  131   2HB   CYS  19          3HB       CYS  19   1.245  -3.610 -10.353
  132    HG   CYS  19           HG       CYS  19   2.233  -0.471 -10.206
  133    H    ARG  20           H        ARG  20   0.693  -2.442 -14.672
  134    HA   ARG  20           HA       ARG  20  -0.869  -4.930 -14.479
  135   1HB   ARG  20          2HB       ARG  20  -1.371  -4.872 -16.683
  136   2HB   ARG  20          3HB       ARG  20  -1.485  -3.196 -16.174
  137   1HG   ARG  20          2HG       ARG  20   0.987  -4.321 -17.665
  138   2HG   ARG  20          3HG       ARG  20  -0.468  -3.779 -18.485
  139   1HD   ARG  20          2HD       ARG  20  -0.417  -1.679 -17.547
  140   2HD   ARG  20          3HD       ARG  20   1.044  -2.006 -16.534
  141    HE   ARG  20           HE       ARG  20   2.148  -2.423 -18.829
  142   1HH1  ARG  20          2HH2      ARG  20   0.338   0.178 -17.387
  143   2HH1  ARG  20          1HH2      ARG  20   0.670   1.387 -18.601
  144   1HH2  ARG  20          2HH1      ARG  20   2.478  -0.926 -20.663
  145   2HH2  ARG  20          1HH1      ARG  20   1.969   0.735 -20.537
  146    H    ASP  21           H        ASP  21   2.339  -3.884 -15.457
  147    HA   ASP  21           HA       ASP  21   3.114  -6.481 -16.490
  148   1HB   ASP  21          2HB       ASP  21   4.381  -3.737 -16.202
  149   2HB   ASP  21          3HB       ASP  21   5.342  -5.151 -16.666
  150    HA   PRO  22           HA       PRO  22   4.426  -7.996 -12.526
  151   1HB   PRO  22          2HB       PRO  22   6.178  -9.993 -13.198
  152   2HB   PRO  22          3HB       PRO  22   4.436 -10.121 -13.559
  153   1HG   PRO  22          2HG       PRO  22   6.642  -9.163 -15.403
  154   2HG   PRO  22          3HG       PRO  22   5.397 -10.401 -15.753
  155   1HD   PRO  22          2HD       PRO  22   5.095  -7.825 -16.566
  156   2HD   PRO  22          3HD       PRO  22   3.694  -8.736 -15.929
  157    H    ASP  23           H        ASP  23   6.072  -8.022 -10.977
  158    HA   ASP  23           HA       ASP  23   7.633  -7.063  -9.860
  159   1HB   ASP  23          2HB       ASP  23   9.329  -7.652 -12.327
  160   2HB   ASP  23          3HB       ASP  23   9.944  -7.402 -10.693
  161    H    THR  24           H        THR  24   6.158  -5.169 -11.801
  162    HA   THR  24           HA       THR  24   8.132  -3.094 -12.430
  163    HB   THR  24           HB       THR  24   5.150  -3.410 -12.934
  164    HG1  THR  24           1HG      THR  24   5.855  -4.050 -14.901
  165   1HG2  THR  24          1HG2      THR  24   5.415  -1.573 -14.594
  166   2HG2  THR  24          2HG2      THR  24   5.562  -1.014 -12.926
  167   3HG2  THR  24          3HG2      THR  24   7.024  -1.227 -13.920
  168    H    PHE  25           H        PHE  25   5.775  -3.789  -9.983
  169    HA   PHE  25           HA       PHE  25   5.065  -1.288  -8.994
  170   1HB   PHE  25          2HB       PHE  25   4.342  -3.621  -8.288
  171   2HB   PHE  25          3HB       PHE  25   5.839  -3.734  -7.370
  172    HD1  PHE  25           1HD      PHE  25   2.429  -3.181  -7.029
  173    HD2  PHE  25           2HD      PHE  25   6.214  -1.583  -5.675
  174    HE1  PHE  25           1HE      PHE  25   1.344  -2.263  -5.012
  175    HE2  PHE  25           2HE      PHE  25   5.081  -0.498  -3.803
  176    HZ   PHE  25           HZ       PHE  25   2.638  -0.863  -3.441
  177    H    GLU  26           H        GLU  26   6.268   0.357  -8.302
  178    HA   GLU  26           HA       GLU  26   8.831  -0.160  -6.855
  179   1HB   GLU  26          2HB       GLU  26   8.248   1.722  -9.041
  180   2HB   GLU  26          3HB       GLU  26   8.671   2.580  -7.562
  181   1HG   GLU  26          2HG       GLU  26  10.698   0.716  -7.624
  182   2HG   GLU  26          3HG       GLU  26  10.389   0.982  -9.339
  183    HA   PRO  27           HA       PRO  27   6.775   1.364  -3.326
  184   1HB   PRO  27          2HB       PRO  27   8.747   2.587  -1.854
  185   2HB   PRO  27          3HB       PRO  27   8.616   0.829  -2.129
  186   1HG   PRO  27          2HG       PRO  27  10.390   2.783  -3.647
  187   2HG   PRO  27          3HG       PRO  27  10.841   1.205  -2.996
  188   1HD   PRO  27          2HD       PRO  27  10.174   1.512  -5.571
  189   2HD   PRO  27          3HD       PRO  27   9.713   0.036  -4.670
  190    H    GLN  28           H        GLN  28   9.061   4.089  -4.010
  191    HA   GLN  28           HA       GLN  28   7.304   6.147  -3.220
  192   1HB   GLN  28          2HB       GLN  28   9.641   6.136  -5.165
  193   2HB   GLN  28          3HB       GLN  28   8.798   7.603  -4.638
  194   1HG   GLN  28          2HG       GLN  28   9.327   7.150  -2.294
  195   2HG   GLN  28          3HG       GLN  28  10.148   5.643  -2.724
  196   1HE2  GLN  28          1HE2      GLN  28  12.008   5.921  -4.417
  197   2HE2  GLN  28          2HE2      GLN  28  13.006   7.341  -4.164
  198    H    LYS  29           H        LYS  29   7.888   4.762  -6.441
  199    HA   LYS  29           HA       LYS  29   6.145   6.239  -8.021
  200   1HB   LYS  29          2HB       LYS  29   7.663   4.344  -8.781
  201   2HB   LYS  29          3HB       LYS  29   6.511   3.208  -8.067
  202   1HG   LYS  29          2HG       LYS  29   5.897   3.185 -10.304
  203   2HG   LYS  29          3HG       LYS  29   4.730   4.287  -9.603
  204   1HD   LYS  29          2HD       LYS  29   6.663   6.097 -10.243
  205   2HD   LYS  29          3HD       LYS  29   7.104   4.813 -11.382
  206   1HE   LYS  29          2HE       LYS  29   4.720   4.821 -12.228
  207   2HE   LYS  29          3HE       LYS  29   4.346   6.130 -11.094
  208   1HZ   LYS  29          1HZ       LYS  29   6.200   6.206 -13.373
  209   2HZ   LYS  29          2HZ       LYS  29   4.772   7.010 -13.219
  210   3HZ   LYS  29          3HZ       LYS  29   6.057   7.431 -12.275
  211    H    PHE  30           H        PHE  30   5.309   3.147  -6.322
  212    HA   PHE  30           HA       PHE  30   2.571   3.324  -6.878
  213   1HB   PHE  30          2HB       PHE  30   3.686   1.258  -6.223
  214   2HB   PHE  30          3HB       PHE  30   3.993   1.901  -4.608
  215    HD1  PHE  30           1HD      PHE  30   2.184   2.066  -2.955
  216    HD2  PHE  30           2HD      PHE  30   1.429   0.638  -6.961
  217    HE1  PHE  30           1HE      PHE  30  -0.086   1.334  -2.271
  218    HE2  PHE  30           2HE      PHE  30  -0.828  -0.110  -6.256
  219    HZ   PHE  30           HZ       PHE  30  -1.638   0.390  -3.976
  220    H    PHE  31           H        PHE  31   4.380   4.461  -3.973
  221    HA   PHE  31           HA       PHE  31   2.106   5.149  -2.454
  222   1HB   PHE  31          2HB       PHE  31   4.884   6.391  -2.466
  223   2HB   PHE  31          3HB       PHE  31   3.648   6.715  -1.252
  224    HD1  PHE  31           1HD      PHE  31   2.473   4.246  -0.455
  225    HD2  PHE  31           2HD      PHE  31   6.595   5.202  -1.308
  226    HE1  PHE  31           1HE      PHE  31   3.212   2.707   1.317
  227    HE2  PHE  31           2HE      PHE  31   7.317   3.512   0.334
  228    HZ   PHE  31           HZ       PHE  31   5.632   2.362   1.746
  229    H    GLN  32           H        GLN  32   3.783   7.042  -5.013
  230    HA   GLN  32           HA       GLN  32   1.902   9.276  -4.641
  231   1HB   GLN  32          2HB       GLN  32   4.161   8.674  -6.503
  232   2HB   GLN  32          3HB       GLN  32   2.811   9.592  -7.185
  233   1HG   GLN  32          2HG       GLN  32   2.914  11.183  -5.259
  234   2HG   GLN  32          3HG       GLN  32   4.386  10.368  -4.700
  235   1HE2  GLN  32          1HE2      GLN  32   6.194  10.250  -6.427
  236   2HE2  GLN  32          2HE2      GLN  32   6.358  11.665  -7.459
  237    H    THR  33           H        THR  33   2.171   6.507  -6.955
  238    HA   THR  33           HA       THR  33   0.063   7.338  -8.559
  239    HB   THR  33           HB       THR  33   1.958   5.244  -8.545
  240    HG1  THR  33           1HG      THR  33  -0.158   5.924 -10.211
  241   1HG2  THR  33          1HG2      THR  33   0.290   3.751  -7.364
  242   2HG2  THR  33          2HG2      THR  33  -0.750   3.987  -8.791
  243   3HG2  THR  33          3HG2      THR  33   0.839   3.200  -8.937
  244    H    SER  34           H        SER  34   0.054   5.597  -5.564
  245    HA   SER  34           HA       SER  34  -2.726   4.760  -5.735
  246   1HB   SER  34          2HB       SER  34  -0.840   3.344  -4.881
  247   2HB   SER  34          3HB       SER  34  -0.716   4.422  -3.480
  248    HG   SER  34           HG       SER  34  -2.040   2.545  -3.138
  249    H    GLY  35           H        GLY  35  -1.215   7.670  -4.996
  250   1HA   GLY  35          1HA       GLY  35  -2.415   9.573  -4.460
  251   2HA   GLY  35          2HA       GLY  35  -3.695   8.612  -3.705
  252    H    LEU  36           H        LEU  36  -2.024   7.016  -2.072
  253    HA   LEU  36           HA       LEU  36  -1.945   8.079   0.331
  254   1HB   LEU  36          2HB       LEU  36  -0.091   6.086  -0.976
  255   2HB   LEU  36          3HB       LEU  36   0.275   6.657   0.637
  256    HG   LEU  36           HG       LEU  36  -2.259   6.127   1.159
  257   1HD1  LEU  36          1HD1      LEU  36  -1.682   4.210  -1.129
  258   2HD1  LEU  36          2HD1      LEU  36  -3.033   4.084   0.015
  259   3HD1  LEU  36          3HD1      LEU  36  -2.952   5.461  -1.080
  260   1HD2  LEU  36          1HD2      LEU  36  -1.602   3.929   1.951
  261   2HD2  LEU  36          2HD2      LEU  36  -0.147   3.954   0.921
  262   3HD2  LEU  36          3HD2      LEU  36  -0.317   5.105   2.266
  263    H    SER  37           H        SER  37   0.935   8.656  -1.809
  264    HA   SER  37           HA       SER  37   2.269  10.124   0.307
  265   1HB   SER  37          2HB       SER  37   3.411   8.936  -1.599
  266   2HB   SER  37          3HB       SER  37   2.848  10.235  -2.670
  267    HG   SER  37           HG       SER  37   4.512  10.514  -0.365
  268    H    LYS  38           H        LYS  38  -0.157  10.989  -2.034
  269    HA   LYS  38           HA       LYS  38   0.393  13.856  -1.871
  270   1HB   LYS  38          2HB       LYS  38  -0.714  12.241  -3.825
  271   2HB   LYS  38          3HB       LYS  38  -2.168  12.879  -3.069
  272   1HG   LYS  38          2HG       LYS  38   0.178  14.521  -4.129
  273   2HG   LYS  38          3HG       LYS  38  -1.317  14.166  -5.017
  274   1HD   LYS  38          2HD       LYS  38  -2.660  15.409  -3.362
  275   2HD   LYS  38          3HD       LYS  38  -1.244  15.646  -2.339
  276   1HE   LYS  38          2HE       LYS  38  -1.730  17.693  -3.545
  277   2HE   LYS  38          3HE       LYS  38  -0.141  17.047  -3.970
  278   1HZ   LYS  38          1HZ       LYS  38  -2.587  16.751  -5.594
  279   2HZ   LYS  38          2HZ       LYS  38  -1.353  17.797  -5.894
  280   3HZ   LYS  38          3HZ       LYS  38  -1.095  16.179  -5.993
  281    H    MET  39           H        MET  39  -1.800  11.330  -0.696
  282    HA   MET  39           HA       MET  39  -3.671  12.942   0.648
  283   1HB   MET  39          2HB       MET  39  -2.756  10.082   0.806
  284   2HB   MET  39          3HB       MET  39  -3.613  10.706   2.197
  285   1HG   MET  39          2HG       MET  39  -5.484  11.400   0.756
  286   2HG   MET  39          3HG       MET  39  -4.679  10.652  -0.639
  287   1HE   MET  39          1HE       MET  39  -7.596  10.251   1.200
  288   2HE   MET  39          2HE       MET  39  -7.477   9.575  -0.437
  289   3HE   MET  39          3HE       MET  39  -7.893   8.520   0.927
  290    H    SER  40           H        SER  40  -3.768  13.777   2.783
  291    HA   SER  40           HA       SER  40  -1.363  14.425   4.113
  292   1HB   SER  40          2HB       SER  40  -4.150  14.220   5.334
  293   2HB   SER  40          3HB       SER  40  -2.843  15.325   5.797
  294    HG   SER  40           HG       SER  40  -3.070  16.221   3.631
  295    H    ALA  41           H        ALA  41  -0.447  13.547   5.977
  296    HA   ALA  41           HA       ALA  41  -0.166  10.928   6.607
  297   1HB   ALA  41          1HB       ALA  41  -0.370  13.331   8.472
  298   2HB   ALA  41          2HB       ALA  41   0.205  11.737   8.978
  299   3HB   ALA  41          3HB       ALA  41   1.099  12.645   7.736
  300    H    ASN  42           H        ASN  42  -2.817  13.021   7.760
  301    HA   ASN  42           HA       ASN  42  -4.129  11.280   9.517
  302   1HB   ASN  42          2HB       ASN  42  -5.491  13.230   7.601
  303   2HB   ASN  42          3HB       ASN  42  -6.090  12.661   9.160
  304   1HD2  ASN  42          1HD2      ASN  42  -5.544  13.946  10.968
  305   2HD2  ASN  42          2HD2      ASN  42  -4.349  15.230  10.905
  306    H    GLN  43           H        GLN  43  -4.789  11.783   6.019
  307    HA   GLN  43           HA       GLN  43  -6.811   9.736   5.833
  308   1HB   GLN  43          2HB       GLN  43  -5.138  11.076   3.696
  309   2HB   GLN  43          3HB       GLN  43  -6.548  10.037   3.423
  310   1HG   GLN  43          2HG       GLN  43  -6.549  12.711   4.894
  311   2HG   GLN  43          3HG       GLN  43  -7.115  12.434   3.248
  312   1HE2  GLN  43          1HE2      GLN  43  -8.891  10.611   3.068
  313   2HE2  GLN  43          2HE2      GLN  43 -10.109  10.678   4.329
  314    H    VAL  44           H        VAL  44  -3.201   9.783   5.327
  315    HA   VAL  44           HA       VAL  44  -3.076   7.164   4.192
  316    HB   VAL  44           HB       VAL  44  -1.121   8.881   5.785
  317   1HG1  VAL  44          1HG1      VAL  44   0.667   7.419   4.904
  318   2HG1  VAL  44          2HG1      VAL  44  -0.368   6.576   6.054
  319   3HG1  VAL  44          3HG1      VAL  44  -0.565   6.281   4.312
  320   1HG2  VAL  44          1HG2      VAL  44  -1.871   9.739   3.540
  321   2HG2  VAL  44          2HG2      VAL  44  -0.156   9.359   3.604
  322   3HG2  VAL  44          3HG2      VAL  44  -1.290   8.232   2.817
  323    H    LYS  45           H        LYS  45  -2.981   8.364   7.587
  324    HA   LYS  45           HA       LYS  45  -2.476   5.775   8.688
  325   1HB   LYS  45          2HB       LYS  45  -1.951   8.006   9.659
  326   2HB   LYS  45          3HB       LYS  45  -3.655   8.206  10.092
  327   1HG   LYS  45          2HG       LYS  45  -3.542   6.414  11.677
  328   2HG   LYS  45          3HG       LYS  45  -2.058   5.755  10.952
  329   1HD   LYS  45          2HD       LYS  45  -0.794   7.748  11.588
  330   2HD   LYS  45          3HD       LYS  45  -2.232   8.467  12.335
  331   1HE   LYS  45          2HE       LYS  45  -2.265   6.697  14.038
  332   2HE   LYS  45          3HE       LYS  45  -0.981   5.806  13.198
  333   1HZ   LYS  45          1HZ       LYS  45   0.518   7.612  13.638
  334   2HZ   LYS  45          2HZ       LYS  45  -0.652   8.464  14.421
  335   3HZ   LYS  45          3HZ       LYS  45  -0.106   7.042  15.045
  336    H    ASP  46           H        ASP  46  -5.493   7.668   8.165
  337    HA   ASP  46           HA       ASP  46  -7.307   5.774   9.240
  338   1HB   ASP  46          2HB       ASP  46  -7.514   7.941   7.141
  339   2HB   ASP  46          3HB       ASP  46  -8.832   6.785   7.345
  340    H    VAL  47           H        VAL  47  -6.278   6.131   5.771
  341    HA   VAL  47           HA       VAL  47  -7.644   3.808   4.942
  342    HB   VAL  47           HB       VAL  47  -6.378   3.782   2.939
  343   1HG1  VAL  47          1HG1      VAL  47  -6.384   6.696   3.061
  344   2HG1  VAL  47          2HG1      VAL  47  -7.382   5.592   2.115
  345   3HG1  VAL  47          3HG1      VAL  47  -7.848   6.003   3.776
  346   1HG2  VAL  47          1HG2      VAL  47  -4.421   5.610   4.152
  347   2HG2  VAL  47          2HG2      VAL  47  -4.114   3.951   3.605
  348   3HG2  VAL  47          3HG2      VAL  47  -4.498   5.218   2.427
  349    H    PHE  48           H        PHE  48  -4.278   4.150   6.140
  350    HA   PHE  48           HA       PHE  48  -3.431   1.490   6.069
  351   1HB   PHE  48          2HB       PHE  48  -2.101   3.427   6.842
  352   2HB   PHE  48          3HB       PHE  48  -2.965   3.397   8.370
  353    HD1  PHE  48           1HD      PHE  48  -0.491   1.711   6.239
  354    HD2  PHE  48           2HD      PHE  48  -2.672   1.438   9.941
  355    HE1  PHE  48           1HE      PHE  48   1.244   0.192   7.144
  356    HE2  PHE  48           2HE      PHE  48  -1.009  -0.188  10.778
  357    HZ   PHE  48           HZ       PHE  48   1.015  -0.724   9.443
  358    H    ARG  49           H        ARG  49  -5.177   3.019   8.858
  359    HA   ARG  49           HA       ARG  49  -5.602   0.604  10.249
  360   1HB   ARG  49          2HB       ARG  49  -6.987   3.302  10.300
  361   2HB   ARG  49          3HB       ARG  49  -7.580   1.936  11.259
  362   1HG   ARG  49          2HG       ARG  49  -5.363   1.631  12.276
  363   2HG   ARG  49          3HG       ARG  49  -4.750   3.059  11.413
  364   1HD   ARG  49          2HD       ARG  49  -6.168   4.531  12.633
  365   2HD   ARG  49          3HD       ARG  49  -7.235   3.203  13.149
  366    HE   ARG  49           HE       ARG  49  -4.650   2.680  14.165
  367   1HH1  ARG  49          2HH2      ARG  49  -7.311   4.925  14.637
  368   2HH1  ARG  49          1HH2      ARG  49  -7.155   5.033  16.363
  369   1HH2  ARG  49          2HH1      ARG  49  -4.407   2.751  16.467
  370   2HH2  ARG  49          1HH1      ARG  49  -5.420   3.780  17.425
  371    H    PHE  50           H        PHE  50  -7.667   2.018   7.664
  372    HA   PHE  50           HA       PHE  50  -9.801   0.106   8.114
  373   1HB   PHE  50          2HB       PHE  50  -8.985   1.799   5.736
  374   2HB   PHE  50          3HB       PHE  50 -10.221   0.561   5.587
  375    HD1  PHE  50           1HD      PHE  50 -12.216   0.555   7.204
  376    HD2  PHE  50           2HD      PHE  50  -9.670   3.983   6.576
  377    HE1  PHE  50           1HE      PHE  50 -13.993   2.043   8.076
  378    HE2  PHE  50           2HE      PHE  50 -11.424   5.455   7.512
  379    HZ   PHE  50           HZ       PHE  50 -13.601   4.496   8.235
  380    H    ILE  51           H        ILE  51  -6.981   0.097   5.879
  381    HA   ILE  51           HA       ILE  51  -7.783  -2.485   4.827
  382    HB   ILE  51           HB       ILE  51  -5.240  -0.911   4.396
  383   1HG1  ILE  51          2HG1      ILE  51  -7.199   0.474   3.776
  384   2HG1  ILE  51          3HG1      ILE  51  -6.243  -0.006   2.397
  385   1HG2  ILE  51          1HG2      ILE  51  -6.554  -3.204   2.869
  386   2HG2  ILE  51          2HG2      ILE  51  -5.291  -2.187   2.174
  387   3HG2  ILE  51          3HG2      ILE  51  -4.952  -3.185   3.603
  388   1HD1  ILE  51          1HD1      ILE  51  -8.657  -0.085   1.961
  389   2HD1  ILE  51          2HD1      ILE  51  -7.970  -1.708   1.830
  390   3HD1  ILE  51          3HD1      ILE  51  -8.899  -1.235   3.279
  391    H    ASP  52           H        ASP  52  -5.763  -1.442   7.400
  392    HA   ASP  52           HA       ASP  52  -4.028  -3.455   8.002
  393   1HB   ASP  52          2HB       ASP  52  -4.375  -1.270   9.196
  394   2HB   ASP  52          3HB       ASP  52  -5.870  -1.928   9.890
  395    H    ASN  53           H        ASN  53  -7.495  -3.559   8.303
  396    HA   ASN  53           HA       ASN  53  -8.876  -5.272   8.133
  397   1HB   ASN  53          2HB       ASN  53  -7.059  -6.277   6.725
  398   2HB   ASN  53          3HB       ASN  53  -6.480  -7.164   8.138
  399   1HD2  ASN  53          1HD2      ASN  53  -9.696  -6.523   6.545
  400   2HD2  ASN  53          2HD2      ASN  53 -10.152  -8.217   6.563
  401    H    ASP  54           H        ASP  54  -6.300  -6.256  10.386
  402    HA   ASP  54           HA       ASP  54  -8.151  -7.392  12.357
  403   1HB   ASP  54          2HB       ASP  54  -6.108  -7.428  13.803
  404   2HB   ASP  54          3HB       ASP  54  -5.947  -8.325  12.288
  405    H    GLN  55           H        GLN  55  -6.335  -4.466  11.844
  406    HA   GLN  55           HA       GLN  55  -6.759  -2.282  12.273
  407   1HB   GLN  55          2HB       GLN  55  -8.552  -1.370  13.208
  408   2HB   GLN  55          3HB       GLN  55  -9.206  -2.940  12.777
  409   1HG   GLN  55          2HG       GLN  55  -8.597  -3.544  15.312
  410   2HG   GLN  55          3HG       GLN  55  -8.485  -1.799  15.481
  411   1HE2  GLN  55          1HE2      GLN  55 -10.318  -1.151  16.559
  412   2HE2  GLN  55          2HE2      GLN  55 -11.938  -1.644  16.094
  413    H    SER  56           H        SER  56  -4.853  -4.242  13.288
  414    HA   SER  56           HA       SER  56  -4.402  -3.689  16.118
  415   1HB   SER  56          2HB       SER  56  -2.455  -5.146  15.840
  416   2HB   SER  56          3HB       SER  56  -3.920  -5.879  15.164
  417    HG   SER  56           HG       SER  56  -2.731  -6.101  13.457
  418    H    GLY  57           H        GLY  57  -3.298  -2.261  13.124
  419   1HA   GLY  57          1HA       GLY  57  -2.082  -0.280  12.935
  420   2HA   GLY  57          2HA       GLY  57  -1.374  -0.490  14.538
  421    H    TYR  58           H        TYR  58  -1.458  -3.170  12.195
  422    HA   TYR  58           HA       TYR  58   1.397  -2.786  11.478
  423   1HB   TYR  58          2HB       TYR  58   0.281  -5.135  13.043
  424   2HB   TYR  58          3HB       TYR  58   1.731  -5.259  12.056
  425    HD1  TYR  58           HD1      TYR  58   0.522  -4.342  15.306
  426    HD2  TYR  58           HD2      TYR  58   3.654  -3.605  12.437
  427    HE1  TYR  58           HE1      TYR  58   2.007  -3.527  17.123
  428    HE2  TYR  58           HE2      TYR  58   5.107  -2.732  14.236
  429    HH   TYR  58           HH       TYR  58   5.307  -2.312  16.492
  430    H    LEU  59           H        LEU  59   1.796  -3.281   9.499
  431    HA   LEU  59           HA       LEU  59  -0.135  -4.838   7.833
  432   1HB   LEU  59          2HB       LEU  59   1.438  -2.298   7.442
  433   2HB   LEU  59          3HB       LEU  59   1.295  -3.355   6.050
  434    HG   LEU  59           HG       LEU  59  -0.455  -1.530   6.275
  435   1HD1  LEU  59          1HD1      LEU  59  -1.198  -4.438   5.826
  436   2HD1  LEU  59          2HD1      LEU  59  -2.232  -3.054   5.437
  437   3HD1  LEU  59          3HD1      LEU  59  -0.640  -3.242   4.638
  438   1HD2  LEU  59          1HD2      LEU  59  -1.884  -3.512   8.067
  439   2HD2  LEU  59          2HD2      LEU  59  -1.047  -2.136   8.750
  440   3HD2  LEU  59          3HD2      LEU  59  -2.375  -1.864   7.614
  441    H    ASP  60           H        ASP  60   1.104  -6.562   9.019
  442    HA   ASP  60           HA       ASP  60   3.647  -7.396   8.373
  443   1HB   ASP  60          2HB       ASP  60   1.119  -9.103   8.480
  444   2HB   ASP  60          3HB       ASP  60   2.766  -9.639   8.842
  445    H    GLU  61           H        GLU  61   4.447  -8.997   6.746
  446    HA   GLU  61           HA       GLU  61   4.301  -8.536   4.179
  447   1HB   GLU  61          2HB       GLU  61   5.670 -10.195   5.496
  448   2HB   GLU  61          3HB       GLU  61   4.354 -11.367   5.346
  449   1HG   GLU  61          2HG       GLU  61   5.285 -10.013   2.831
  450   2HG   GLU  61          3HG       GLU  61   6.417 -11.058   3.683
  451    H    GLU  62           H        GLU  62   2.179 -10.923   5.778
  452    HA   GLU  62           HA       GLU  62   0.837 -11.689   3.449
  453   1HB   GLU  62          2HB       GLU  62   0.981 -12.713   5.938
  454   2HB   GLU  62          3HB       GLU  62  -0.545 -11.839   6.149
  455   1HG   GLU  62          2HG       GLU  62  -1.406 -13.057   4.116
  456   2HG   GLU  62          3HG       GLU  62   0.120 -13.967   4.067
  457    H    GLU  63           H        GLU  63  -0.043  -9.210   5.891
  458    HA   GLU  63           HA       GLU  63  -2.608  -8.617   4.729
  459   1HB   GLU  63          2HB       GLU  63  -0.774  -6.868   6.423
  460   2HB   GLU  63          3HB       GLU  63  -2.468  -6.550   6.001
  461   1HG   GLU  63          2HG       GLU  63  -3.083  -8.758   7.102
  462   2HG   GLU  63          3HG       GLU  63  -1.407  -8.869   7.683
  463    H    LEU  64           H        LEU  64   0.706  -7.335   4.257
  464    HA   LEU  64           HA       LEU  64  -0.016  -5.378   2.325
  465   1HB   LEU  64          2HB       LEU  64   2.481  -6.761   3.133
  466   2HB   LEU  64          3HB       LEU  64   2.459  -6.135   1.482
  467    HG   LEU  64           HG       LEU  64   1.596  -4.416   3.825
  468   1HD1  LEU  64          1HD1      LEU  64   3.885  -5.147   4.293
  469   2HD1  LEU  64          2HD1      LEU  64   4.392  -4.706   2.646
  470   3HD1  LEU  64          3HD1      LEU  64   3.863  -3.447   3.784
  471   1HD2  LEU  64          1HD2      LEU  64   2.135  -2.593   2.284
  472   2HD2  LEU  64          2HD2      LEU  64   2.720  -3.746   1.061
  473   3HD2  LEU  64          3HD2      LEU  64   0.998  -3.666   1.464
  474    H    LYS  65           H        LYS  65   0.904  -8.788   1.952
  475    HA   LYS  65           HA       LYS  65   0.590  -9.027  -0.842
  476   1HB   LYS  65          2HB       LYS  65   1.772 -10.521   0.875
  477   2HB   LYS  65          3HB       LYS  65   0.172 -11.223   1.182
  478   1HG   LYS  65          2HG       LYS  65   0.071 -12.109  -1.076
  479   2HG   LYS  65          3HG       LYS  65   1.396 -11.063  -1.600
  480   1HD   LYS  65          2HD       LYS  65   2.289 -13.286  -1.350
  481   2HD   LYS  65          3HD       LYS  65   2.987 -12.201  -0.144
  482   1HE   LYS  65          2HE       LYS  65   1.031 -13.191   1.415
  483   2HE   LYS  65          3HE       LYS  65   1.049 -14.499   0.232
  484   1HZ   LYS  65          1HZ       LYS  65   3.269 -13.491   1.911
  485   2HZ   LYS  65          2HZ       LYS  65   2.512 -14.922   2.078
  486   3HZ   LYS  65          3HZ       LYS  65   3.489 -14.654   0.769
  487    H    PHE  66           H        PHE  66  -1.824  -8.828   1.647
  488    HA   PHE  66           HA       PHE  66  -3.883  -9.066  -0.507
  489   1HB   PHE  66          2HB       PHE  66  -4.162  -9.936   2.385
  490   2HB   PHE  66          3HB       PHE  66  -5.427  -9.998   1.161
  491    HD1  PHE  66           1HD      PHE  66  -4.839 -11.416  -1.038
  492    HD2  PHE  66           2HD      PHE  66  -2.887 -11.886   2.779
  493    HE1  PHE  66           1HE      PHE  66  -4.105 -13.681  -1.690
  494    HE2  PHE  66           2HE      PHE  66  -2.117 -14.138   2.101
  495    HZ   PHE  66           HZ       PHE  66  -2.724 -15.044  -0.134
  496    H    PHE  67           H        PHE  67  -2.585  -6.659   0.021
  497    HA   PHE  67           HA       PHE  67  -4.146  -5.068   1.867
  498   1HB   PHE  67          2HB       PHE  67  -1.800  -4.704   1.473
  499   2HB   PHE  67          3HB       PHE  67  -2.045  -4.274  -0.193
  500    HD1  PHE  67           1HD      PHE  67  -2.479  -3.293   3.299
  501    HD2  PHE  67           2HD      PHE  67  -2.854  -1.988  -0.749
  502    HE1  PHE  67           1HE      PHE  67  -2.639  -0.920   4.088
  503    HE2  PHE  67           2HE      PHE  67  -3.185   0.346   0.006
  504    HZ   PHE  67           HZ       PHE  67  -3.071   0.890   2.437
  505    H    LEU  68           H        LEU  68  -3.541  -4.286  -1.602
  506    HA   LEU  68           HA       LEU  68  -5.843  -2.710  -1.797
  507   1HB   LEU  68          2HB       LEU  68  -4.284  -4.097  -3.961
  508   2HB   LEU  68          3HB       LEU  68  -5.472  -2.815  -4.280
  509    HG   LEU  68           HG       LEU  68  -2.861  -2.531  -2.787
  510   1HD1  LEU  68          1HD1      LEU  68  -2.958  -2.928  -5.383
  511   2HD1  LEU  68          2HD1      LEU  68  -3.465  -1.241  -5.436
  512   3HD1  LEU  68          3HD1      LEU  68  -1.909  -1.712  -4.697
  513   1HD2  LEU  68          1HD2      LEU  68  -3.265  -0.159  -2.699
  514   2HD2  LEU  68          2HD2      LEU  68  -4.737  -0.306  -3.685
  515   3HD2  LEU  68          3HD2      LEU  68  -4.686  -0.916  -2.023
  516    H    GLN  69           H        GLN  69  -5.812  -6.080  -1.658
  517    HA   GLN  69           HA       GLN  69  -7.995  -6.875  -3.261
  518   1HB   GLN  69          2HB       GLN  69  -7.267  -7.700  -0.410
  519   2HB   GLN  69          3HB       GLN  69  -8.386  -8.564  -1.475
  520   1HG   GLN  69          2HG       GLN  69  -5.402  -8.134  -1.983
  521   2HG   GLN  69          3HG       GLN  69  -6.192  -9.618  -1.446
  522   1HE2  GLN  69          1HE2      GLN  69  -5.194  -7.821  -4.209
  523   2HE2  GLN  69          2HE2      GLN  69  -5.953  -8.875  -5.391
  524    H    LYS  70           H        LYS  70  -8.127  -5.595   0.143
  525    HA   LYS  70           HA       LYS  70 -11.062  -5.296  -0.186
  526   1HB   LYS  70          2HB       LYS  70 -11.165  -4.932   2.140
  527   2HB   LYS  70          3HB       LYS  70 -10.087  -6.295   1.849
  528   1HG   LYS  70          2HG       LYS  70  -8.338  -4.110   1.888
  529   2HG   LYS  70          3HG       LYS  70  -9.575  -3.634   3.041
  530   1HD   LYS  70          2HD       LYS  70  -7.898  -4.704   4.283
  531   2HD   LYS  70          3HD       LYS  70  -9.226  -5.875   4.230
  532   1HE   LYS  70          2HE       LYS  70  -8.017  -7.293   2.736
  533   2HE   LYS  70          3HE       LYS  70  -7.057  -5.944   2.124
  534   1HZ   LYS  70          1HZ       LYS  70  -5.650  -7.135   3.339
  535   2HZ   LYS  70          2HZ       LYS  70  -5.978  -5.860   4.345
  536   3HZ   LYS  70          3HZ       LYS  70  -6.644  -7.345   4.649
  537    H    PHE  71           H        PHE  71  -9.941  -3.770  -2.037
  538    HA   PHE  71           HA       PHE  71 -10.232  -0.965  -1.165
  539   1HB   PHE  71          2HB       PHE  71  -7.791  -2.061  -0.868
  540   2HB   PHE  71          3HB       PHE  71  -7.666  -1.631  -2.580
  541    HD1  PHE  71           1HD      PHE  71  -6.203  -0.648   0.114
  542    HD2  PHE  71           2HD      PHE  71  -9.123   0.983  -2.603
  543    HE1  PHE  71           1HE      PHE  71  -5.373   1.638   0.585
  544    HE2  PHE  71           2HE      PHE  71  -8.133   3.217  -2.322
  545    HZ   PHE  71           HZ       PHE  71  -6.291   3.577  -0.664
  546    H    GLU  72           H        GLU  72  -8.920  -2.986  -3.819
  547    HA   GLU  72           HA       GLU  72 -10.688  -1.642  -5.817
  548   1HB   GLU  72          2HB       GLU  72  -8.193  -1.525  -6.159
  549   2HB   GLU  72          3HB       GLU  72  -8.155  -3.292  -6.156
  550   1HG   GLU  72          2HG       GLU  72  -8.047  -2.659  -8.411
  551   2HG   GLU  72          3HG       GLU  72  -9.714  -3.197  -8.204
  552    H    SER  73           H        SER  73  -9.638  -4.772  -4.427
  553    HA   SER  73           HA       SER  73 -10.568  -6.800  -4.417
  554   1HB   SER  73          2HB       SER  73 -12.749  -7.232  -4.778
  555   2HB   SER  73          3HB       SER  73 -12.836  -5.474  -4.634
  556    HG   SER  73           HG       SER  73 -12.554  -5.519  -7.006
  557    H    GLY  74           H        GLY  74  -9.118  -8.035  -5.349
  558   1HA   GLY  74          1HA       GLY  74  -8.043  -9.252  -7.011
  559   2HA   GLY  74          2HA       GLY  74  -9.226  -8.666  -8.194
  560    H    ALA  75           H        ALA  75  -6.951  -6.991  -6.014
  561    HA   ALA  75           HA       ALA  75  -5.894  -5.272  -8.141
  562   1HB   ALA  75          1HB       ALA  75  -6.328  -4.521  -5.800
  563   2HB   ALA  75          2HB       ALA  75  -5.068  -5.641  -5.255
  564   3HB   ALA  75          3HB       ALA  75  -4.658  -4.258  -6.319
  565    H    ARG  76           H        ARG  76  -3.095  -5.445  -6.796
  566    HA   ARG  76           HA       ARG  76  -2.257  -7.607  -8.607
  567   1HB   ARG  76          2HB       ARG  76  -1.548  -5.305  -9.113
  568   2HB   ARG  76          3HB       ARG  76  -0.704  -5.212  -7.555
  569   1HG   ARG  76          2HG       ARG  76   0.767  -5.732  -9.514
  570   2HG   ARG  76          3HG       ARG  76   0.862  -6.943  -8.228
  571   1HD   ARG  76          2HD       ARG  76  -0.560  -8.487  -9.500
  572   2HD   ARG  76          3HD       ARG  76  -0.912  -7.239 -10.705
  573    HE   ARG  76           HE       ARG  76   1.749  -8.535 -10.095
  574   1HH1  ARG  76          2HH2      ARG  76   0.284  -6.348 -12.367
  575   2HH1  ARG  76          1HH2      ARG  76   0.716  -7.263 -13.778
  576   1HH2  ARG  76          2HH1      ARG  76   2.826  -9.263 -11.740
  577   2HH2  ARG  76          1HH1      ARG  76   2.398  -8.993 -13.436
  578    H    GLU  77           H        GLU  77  -1.819  -6.471  -5.339
  579    HA   GLU  77           HA       GLU  77   0.091  -7.432  -4.087
  580   1HB   GLU  77          2HB       GLU  77  -2.474  -8.441  -2.901
  581   2HB   GLU  77          3HB       GLU  77  -1.134  -7.551  -2.154
  582   1HG   GLU  77          2HG       GLU  77  -3.387  -6.477  -3.898
  583   2HG   GLU  77          3HG       GLU  77  -3.095  -6.210  -2.180
  584    H    LEU  78           H        LEU  78  -2.146  -9.759  -5.420
  585    HA   LEU  78           HA       LEU  78  -1.486 -12.186  -4.275
  586   1HB   LEU  78          2HB       LEU  78  -1.645 -11.857  -7.287
  587   2HB   LEU  78          3HB       LEU  78  -2.050 -13.242  -6.292
  588    HG   LEU  78           HG       LEU  78  -4.088 -12.563  -6.937
  589   1HD1  LEU  78          1HD1      LEU  78  -5.345 -11.561  -5.147
  590   2HD1  LEU  78          2HD1      LEU  78  -4.103 -12.622  -4.458
  591   3HD1  LEU  78          3HD1      LEU  78  -3.893 -10.857  -4.422
  592   1HD2  LEU  78          1HD2      LEU  78  -3.315 -10.514  -8.126
  593   2HD2  LEU  78          2HD2      LEU  78  -4.917 -10.404  -7.389
  594   3HD2  LEU  78          3HD2      LEU  78  -3.548  -9.602  -6.622
  595    H    THR  79           H        THR  79   0.427 -10.330  -6.769
  596    HA   THR  79           HA       THR  79   2.451 -12.409  -6.809
  597    HB   THR  79           HB       THR  79   2.983  -9.543  -7.580
  598    HG1  THR  79           1HG      THR  79   2.660 -10.149  -9.605
  599   1HG2  THR  79          1HG2      THR  79   4.587 -10.839  -9.160
  600   2HG2  THR  79          2HG2      THR  79   4.957 -10.906  -7.442
  601   3HG2  THR  79          3HG2      THR  79   4.182 -12.284  -8.245
  602    H    GLU  80           H        GLU  80   4.005 -12.713  -5.426
  603    HA   GLU  80           HA       GLU  80   4.289 -11.045  -3.080
  604   1HB   GLU  80          2HB       GLU  80   6.012 -12.586  -2.345
  605   2HB   GLU  80          3HB       GLU  80   4.472 -13.339  -2.757
  606   1HG   GLU  80          2HG       GLU  80   5.426 -14.135  -4.923
  607   2HG   GLU  80          3HG       GLU  80   6.980 -13.394  -4.489
  608    H    SER  81           H        SER  81   6.341 -11.461  -6.037
  609    HA   SER  81           HA       SER  81   8.364  -9.645  -5.430
  610   1HB   SER  81          2HB       SER  81   6.916 -10.076  -8.084
  611   2HB   SER  81          3HB       SER  81   8.223  -8.926  -7.864
  612    HG   SER  81           HG       SER  81   9.136 -10.693  -8.527
  613    H    GLU  82           H        GLU  82   5.463  -8.516  -7.325
  614    HA   GLU  82           HA       GLU  82   5.826  -5.912  -7.013
  615   1HB   GLU  82          2HB       GLU  82   3.146  -7.382  -7.021
  616   2HB   GLU  82          3HB       GLU  82   3.329  -5.646  -7.182
  617   1HG   GLU  82          2HG       GLU  82   3.071  -6.365  -9.395
  618   2HG   GLU  82          3HG       GLU  82   4.787  -6.020  -9.224
  619    H    THR  83           H        THR  83   4.150  -7.970  -4.555
  620    HA   THR  83           HA       THR  83   3.521  -5.783  -2.874
  621    HB   THR  83           HB       THR  83   3.703  -8.770  -2.538
  622    HG1  THR  83           1HG      THR  83   1.721  -7.170  -1.461
  623   1HG2  THR  83          1HG2      THR  83   3.675  -6.845  -0.190
  624   2HG2  THR  83          2HG2      THR  83   3.051  -8.507  -0.095
  625   3HG2  THR  83          3HG2      THR  83   4.757  -8.229  -0.444
  626    H    LYS  84           H        LYS  84   6.341  -7.958  -3.036
  627    HA   LYS  84           HA       LYS  84   7.495  -6.952  -0.677
  628   1HB   LYS  84          2HB       LYS  84   7.945  -9.182  -1.547
  629   2HB   LYS  84          3HB       LYS  84   8.871  -8.502  -2.905
  630   1HG   LYS  84          2HG       LYS  84  10.528  -7.604  -1.411
  631   2HG   LYS  84          3HG       LYS  84   9.461  -7.778  -0.024
  632   1HD   LYS  84          2HD       LYS  84  10.949  -9.525   0.348
  633   2HD   LYS  84          3HD       LYS  84   9.532 -10.302  -0.340
  634   1HE   LYS  84          2HE       LYS  84  11.411 -11.298  -1.406
  635   2HE   LYS  84          3HE       LYS  84  10.678 -10.238  -2.618
  636   1HZ   LYS  84          1HZ       LYS  84  13.019  -9.572  -0.940
  637   2HZ   LYS  84          2HZ       LYS  84  13.080 -10.038  -2.516
  638   3HZ   LYS  84          3HZ       LYS  84  12.377  -8.608  -2.111
  639    H    SER  85           H        SER  85   7.769  -5.915  -4.088
  640    HA   SER  85           HA       SER  85   9.829  -4.046  -3.792
  641   1HB   SER  85          2HB       SER  85   7.274  -3.688  -5.386
  642   2HB   SER  85          3HB       SER  85   8.865  -2.955  -5.688
  643    HG   SER  85           HG       SER  85   9.649  -4.982  -6.221
  644    H    LEU  86           H        LEU  86   6.450  -3.859  -2.598
  645    HA   LEU  86           HA       LEU  86   6.735  -1.076  -1.690
  646   1HB   LEU  86          2HB       LEU  86   4.543  -2.550  -2.183
  647   2HB   LEU  86          3HB       LEU  86   4.723  -2.987  -0.497
  648    HG   LEU  86           HG       LEU  86   4.467  -0.164  -1.623
  649   1HD1  LEU  86          1HD1      LEU  86   2.307  -0.099  -0.708
  650   2HD1  LEU  86          2HD1      LEU  86   2.378  -1.728  -1.418
  651   3HD1  LEU  86          3HD1      LEU  86   2.587  -1.507   0.319
  652   1HD2  LEU  86          1HD2      LEU  86   5.882   0.059   0.285
  653   2HD2  LEU  86          2HD2      LEU  86   4.248   0.455   0.827
  654   3HD2  LEU  86          3HD2      LEU  86   4.934  -1.129   1.222
  655    H    MET  87           H        MET  87   6.484  -4.281  -0.106
  656    HA   MET  87           HA       MET  87   6.990  -3.556   2.469
  657   1HB   MET  87          2HB       MET  87   6.440  -5.873   1.708
  658   2HB   MET  87          3HB       MET  87   8.111  -6.032   1.145
  659   1HG   MET  87          2HG       MET  87   8.337  -5.225   3.850
  660   2HG   MET  87          3HG       MET  87   7.063  -6.432   3.825
  661   1HE   MET  87          1HE       MET  87   7.844  -8.442   1.602
  662   2HE   MET  87          2HE       MET  87   8.912  -9.573   2.471
  663   3HE   MET  87          3HE       MET  87   7.449  -8.941   3.261
  664    H    ALA  88           H        ALA  88   9.491  -4.507   0.161
  665    HA   ALA  88           HA       ALA  88  11.846  -4.372   1.510
  666   1HB   ALA  88          1HB       ALA  88  11.199  -3.439  -1.326
  667   2HB   ALA  88          2HB       ALA  88  12.839  -3.765  -0.719
  668   3HB   ALA  88          3HB       ALA  88  11.649  -5.075  -0.821
  669    H    ALA  89           H        ALA  89   9.960  -1.544   0.402
  670    HA   ALA  89           HA       ALA  89  12.210   0.277   1.144
  671   1HB   ALA  89          1HB       ALA  89   9.608   1.120  -0.099
  672   2HB   ALA  89          2HB       ALA  89  11.225   1.847  -0.250
  673   3HB   ALA  89          3HB       ALA  89  10.863   0.305  -1.064
  674    H    ALA  90           H        ALA  90   8.760  -0.374   1.747
  675    HA   ALA  90           HA       ALA  90   8.174   1.645   3.680
  676   1HB   ALA  90          1HB       ALA  90   6.387   0.049   4.323
  677   2HB   ALA  90          2HB       ALA  90   6.513   0.259   2.550
  678   3HB   ALA  90          3HB       ALA  90   7.166  -1.196   3.316
  679    H    ASP  91           H        ASP  91   9.578  -1.602   4.008
  680    HA   ASP  91           HA       ASP  91   9.666  -1.558   6.860
  681   1HB   ASP  91          2HB       ASP  91   9.466  -3.613   5.450
  682   2HB   ASP  91          3HB       ASP  91  11.123  -3.361   4.882
  683    H    ASN  92           H        ASN  92  10.716   0.590   6.969
  684    HA   ASN  92           HA       ASN  92  13.396   0.992   5.944
  685   1HB   ASN  92          2HB       ASN  92  13.243   3.188   6.957
  686   2HB   ASN  92          3HB       ASN  92  11.784   2.804   6.035
  687   1HD2  ASN  92          1HD2      ASN  92  11.677   4.891   7.849
  688   2HD2  ASN  92          2HD2      ASN  92  10.684   4.398   9.210
  689    H    ASP  93           H        ASP  93  13.724  -1.202   7.342
  690    HA   ASP  93           HA       ASP  93  15.672  -0.588   9.390
  691   1HB   ASP  93          2HB       ASP  93  14.552  -1.954  11.161
  692   2HB   ASP  93          3HB       ASP  93  13.794  -0.392  10.840
  693    H    GLY  94           H        GLY  94  13.590  -3.176   7.982
  694   1HA   GLY  94          1HA       GLY  94  14.547  -4.731   6.396
  695   2HA   GLY  94          2HA       GLY  94  16.126  -4.587   7.163
  696    H    ASP  95           H        ASP  95  12.820  -5.255   8.153
  697    HA   ASP  95           HA       ASP  95  13.613  -7.820   9.454
  698   1HB   ASP  95          2HB       ASP  95  12.576  -7.419  11.422
  699   2HB   ASP  95          3HB       ASP  95  13.086  -5.765  11.071
  700    H    GLY  96           H        GLY  96  10.919  -5.830   8.128
  701   1HA   GLY  96          1HA       GLY  96   9.815  -6.783   6.168
  702   2HA   GLY  96          2HA       GLY  96   9.616  -8.308   7.044
  703    H    LYS  97           H        LYS  97   9.031  -6.943   9.652
  704    HA   LYS  97           HA       LYS  97   6.160  -6.627   9.279
  705   1HB   LYS  97          2HB       LYS  97   7.965  -6.207  11.691
  706   2HB   LYS  97          3HB       LYS  97   6.209  -6.205  11.744
  707   1HG   LYS  97          2HG       LYS  97   7.619  -8.621  10.564
  708   2HG   LYS  97          3HG       LYS  97   7.632  -8.392  12.308
  709   1HD   LYS  97          2HD       LYS  97   5.246  -8.397  12.467
  710   2HD   LYS  97          3HD       LYS  97   5.035  -8.262  10.717
  711   1HE   LYS  97          2HE       LYS  97   5.850 -10.486  10.326
  712   2HE   LYS  97          3HE       LYS  97   6.398 -10.675  12.003
  713   1HZ   LYS  97          1HZ       LYS  97   4.137 -10.657  12.718
  714   2HZ   LYS  97          2HZ       LYS  97   3.585 -10.245  11.262
  715   3HZ   LYS  97          3HZ       LYS  97   4.223 -11.750  11.481
  716    H    ILE  98           H        ILE  98   5.107  -4.733   8.953
  717    HA   ILE  98           HA       ILE  98   6.645  -2.168   9.061
  718    HB   ILE  98           HB       ILE  98   4.716  -3.358   7.081
  719   1HG1  ILE  98          2HG1      ILE  98   7.295  -1.844   6.583
  720   2HG1  ILE  98          3HG1      ILE  98   7.358  -3.538   7.069
  721   1HG2  ILE  98          1HG2      ILE  98   3.850  -1.080   7.494
  722   2HG2  ILE  98          2HG2      ILE  98   5.483  -0.413   7.264
  723   3HG2  ILE  98          3HG2      ILE  98   4.628  -1.199   5.925
  724   1HD1  ILE  98          1HD1      ILE  98   5.808  -2.570   4.647
  725   2HD1  ILE  98          2HD1      ILE  98   7.434  -3.259   4.641
  726   3HD1  ILE  98          3HD1      ILE  98   6.064  -4.251   5.175
  727    H    GLY  99           H        GLY  99   5.982  -0.925  10.641
  728   1HA   GLY  99          1HA       GLY  99   3.296  -1.147  11.841
  729   2HA   GLY  99          2HA       GLY  99   4.609  -0.058  12.314
  730    H    ALA 100           H        ALA 100   2.015   0.900  12.137
  731    HA   ALA 100           HA       ALA 100   1.399   2.235   9.673
  732   1HB   ALA 100          1HB       ALA 100   0.031   3.693  10.985
  733   2HB   ALA 100          2HB       ALA 100  -0.168   2.059  11.639
  734   3HB   ALA 100          3HB       ALA 100   0.860   3.228  12.496
  735    H    GLU 101           H        GLU 101   3.547   2.996  12.383
  736    HA   GLU 101           HA       GLU 101   4.342   5.561  11.602
  737   1HB   GLU 101          2HB       GLU 101   5.777   3.344  13.121
  738   2HB   GLU 101          3HB       GLU 101   6.377   5.004  13.006
  739   1HG   GLU 101          2HG       GLU 101   4.569   5.903  14.217
  740   2HG   GLU 101          3HG       GLU 101   3.516   4.515  13.946
  741    H    GLU 102           H        GLU 102   6.276   2.544  11.078
  742    HA   GLU 102           HA       GLU 102   8.062   3.334   9.201
  743   1HB   GLU 102          2HB       GLU 102   6.477   0.729   9.022
  744   2HB   GLU 102          3HB       GLU 102   8.036   1.082   8.277
  745   1HG   GLU 102          2HG       GLU 102   8.974   1.427  10.614
  746   2HG   GLU 102          3HG       GLU 102   7.468   0.752  11.254
  747    H    PHE 103           H        PHE 103   4.683   2.362   8.447
  748    HA   PHE 103           HA       PHE 103   5.015   2.717   5.630
  749   1HB   PHE 103          2HB       PHE 103   3.265   1.381   6.965
  750   2HB   PHE 103          3HB       PHE 103   2.353   2.877   7.071
  751    HD1  PHE 103           1HD      PHE 103   0.937   3.485   5.178
  752    HD2  PHE 103           2HD      PHE 103   4.033   0.539   4.661
  753    HE1  PHE 103           1HE      PHE 103  -0.257   2.555   3.215
  754    HE2  PHE 103           2HE      PHE 103   2.871  -0.344   2.667
  755    HZ   PHE 103           HZ       PHE 103   0.702   0.642   1.950
  756    H    GLN 104           H        GLN 104   3.431   4.847   8.063
  757    HA   GLN 104           HA       GLN 104   2.648   6.984   6.297
  758   1HB   GLN 104          2HB       GLN 104   1.970   6.533   8.773
  759   2HB   GLN 104          3HB       GLN 104   3.497   7.339   9.184
  760   1HG   GLN 104          2HG       GLN 104   2.615   9.212   7.544
  761   2HG   GLN 104          3HG       GLN 104   1.051   8.406   7.717
  762   1HE2  GLN 104          1HE2      GLN 104   2.972  10.848   8.927
  763   2HE2  GLN 104          2HE2      GLN 104   2.244  11.007  10.516
  764    H    GLU 105           H        GLU 105   5.706   6.442   8.210
  765    HA   GLU 105           HA       GLU 105   7.083   8.726   7.379
  766   1HB   GLU 105          2HB       GLU 105   7.904   5.916   8.133
  767   2HB   GLU 105          3HB       GLU 105   9.095   6.938   7.336
  768   1HG   GLU 105          2HG       GLU 105   9.371   7.176   9.704
  769   2HG   GLU 105          3HG       GLU 105   8.786   8.704   9.044
  770    H    MET 106           H        MET 106   7.209   5.513   5.708
  771    HA   MET 106           HA       MET 106   8.767   6.557   3.623
  772   1HB   MET 106          2HB       MET 106   7.879   4.032   4.327
  773   2HB   MET 106          3HB       MET 106   7.066   4.295   2.789
  774   1HG   MET 106          2HG       MET 106  10.064   4.350   3.375
  775   2HG   MET 106          3HG       MET 106   9.149   3.183   2.440
  776   1HE   MET 106          1HE       MET 106  11.204   6.807   0.733
  777   2HE   MET 106          2HE       MET 106  10.299   7.082   2.222
  778   3HE   MET 106          3HE       MET 106  11.614   5.882   2.193
  779    H    VAL 107           H        VAL 107   5.242   6.197   3.857
  780    HA   VAL 107           HA       VAL 107   4.500   7.096   1.266
  781    HB   VAL 107           HB       VAL 107   3.139   7.269   3.988
  782   1HG1  VAL 107          1HG1      VAL 107   2.100   7.949   1.228
  783   2HG1  VAL 107          2HG1      VAL 107   1.034   7.569   2.593
  784   3HG1  VAL 107          3HG1      VAL 107   2.082   8.991   2.669
  785   1HG2  VAL 107          1HG2      VAL 107   1.898   5.356   3.327
  786   2HG2  VAL 107          2HG2      VAL 107   2.416   5.500   1.639
  787   3HG2  VAL 107          3HG2      VAL 107   3.564   4.960   2.876
  788    H    HIS 108           H        HIS 108   5.085   8.891   4.298
  789    HA   HIS 108           HA       HIS 108   4.084  11.365   3.347
  790   1HB   HIS 108          2HB       HIS 108   3.955  10.740   5.669
  791   2HB   HIS 108          3HB       HIS 108   5.723  10.637   5.786
  792    HD1  HIS 108           1HD      HIS 108   6.934  12.808   6.493
  793    HD2  HIS 108           2HD      HIS 108   2.932  13.331   5.305
  794    HE1  HIS 108           1HE      HIS 108   6.300  15.211   7.090
  795    H    SER 109           H        SER 109   7.123   9.741   3.123
  796    HA   SER 109           HA       SER 109   8.995  11.795   3.077
  797   1HB   SER 109          2HB       SER 109   9.458   9.316   3.133
  798   2HB   SER 109          3HB       SER 109   8.990   9.257   1.412
  799    HG   SER 109           HG       SER 109  10.596  11.016   1.195
  Start of MODEL   15
    1   1H    MET   1           H1       MET   1 -15.587  -0.057   2.105
    2   2H    MET   1           H2       MET   1 -16.377   0.031   0.652
    3   3H    MET   1           H3       MET   1 -14.907   0.758   0.852
    4    HA   MET   1           HA       MET   1 -16.701   2.389   0.956
    5   1HB   MET   1          2HB       MET   1 -17.478   0.659   3.335
    6   2HB   MET   1          3HB       MET   1 -18.090   2.294   3.054
    7   1HG   MET   1          2HG       MET   1 -19.233   1.636   1.053
    8   2HG   MET   1          3HG       MET   1 -18.392   0.083   0.979
    9   1HE   MET   1          1HE       MET   1 -21.439   0.215   0.507
   10   2HE   MET   1          2HE       MET   1 -20.476  -1.285   0.524
   11   3HE   MET   1          3HE       MET   1 -21.966  -1.174   1.487
   12    H    SER   2           H        SER   2 -15.226   3.919   1.322
   13    HA   SER   2           HA       SER   2 -14.287   5.260   3.272
   14   1HB   SER   2          2HB       SER   2 -12.545   2.747   3.413
   15   2HB   SER   2          3HB       SER   2 -11.989   4.351   3.923
   16    HG   SER   2           HG       SER   2 -14.214   2.951   4.940
   17    H    ILE   3           H        ILE   3 -11.864   3.352   1.459
   18    HA   ILE   3           HA       ILE   3 -10.875   5.790   0.319
   19    HB   ILE   3           HB       ILE   3  -9.070   4.523  -0.471
   20   1HG1  ILE   3          2HG1      ILE   3  -9.290   1.884  -0.077
   21   2HG1  ILE   3          3HG1      ILE   3 -10.969   2.172  -0.486
   22   1HG2  ILE   3          1HG2      ILE   3  -9.448   4.741   2.018
   23   2HG2  ILE   3          2HG2      ILE   3  -9.915   3.031   2.036
   24   3HG2  ILE   3          3HG2      ILE   3  -8.292   3.495   1.501
   25   1HD1  ILE   3          1HD1      ILE   3 -10.157   3.256  -2.661
   26   2HD1  ILE   3          2HD1      ILE   3  -8.501   2.863  -2.164
   27   3HD1  ILE   3          3HD1      ILE   3  -9.669   1.570  -2.487
   28    H    THR   4           H        THR   4 -12.972   3.180  -0.965
   29    HA   THR   4           HA       THR   4 -12.626   3.650  -3.658
   30    HB   THR   4           HB       THR   4 -13.299   1.536  -2.530
   31    HG1  THR   4           1HG      THR   4 -14.898   2.905  -4.251
   32   1HG2  THR   4          1HG2      THR   4 -14.772   2.487  -0.687
   33   2HG2  THR   4          2HG2      THR   4 -15.945   2.969  -1.925
   34   3HG2  THR   4          3HG2      THR   4 -15.588   1.257  -1.675
   35    H    ASP   5           H        ASP   5 -14.078   5.697  -1.333
   36    HA   ASP   5           HA       ASP   5 -15.544   7.144  -3.403
   37   1HB   ASP   5          2HB       ASP   5 -17.201   5.505  -2.480
   38   2HB   ASP   5          3HB       ASP   5 -16.922   6.169  -0.856
   39    H    VAL   6           H        VAL   6 -13.320   7.987  -2.672
   40    HA   VAL   6           HA       VAL   6 -13.908  10.333  -1.016
   41    HB   VAL   6           HB       VAL   6 -12.898   8.545   0.503
   42   1HG1  VAL   6          1HG1      VAL   6 -11.010   7.839  -1.023
   43   2HG1  VAL   6          2HG1      VAL   6 -10.249   9.414  -0.721
   44   3HG1  VAL   6          3HG1      VAL   6 -10.516   8.291   0.612
   45   1HG2  VAL   6          1HG2      VAL   6 -11.592  11.281   0.318
   46   2HG2  VAL   6          2HG2      VAL   6 -13.114  10.880   1.144
   47   3HG2  VAL   6          3HG2      VAL   6 -11.584  10.215   1.741
   48    H    LEU   7           H        LEU   7 -11.467   8.640  -2.914
   49    HA   LEU   7           HA       LEU   7 -11.083  10.610  -4.909
   50   1HB   LEU   7          2HB       LEU   7 -10.053  12.079  -3.433
   51   2HB   LEU   7          3HB       LEU   7  -9.331  10.813  -2.452
   52    HG   LEU   7           HG       LEU   7  -8.243  10.893  -5.218
   53   1HD1  LEU   7          1HD1      LEU   7  -8.617  13.298  -4.970
   54   2HD1  LEU   7          2HD1      LEU   7  -7.820  13.276  -3.377
   55   3HD1  LEU   7          3HD1      LEU   7  -6.890  12.909  -4.845
   56   1HD2  LEU   7          1HD2      LEU   7  -6.108  10.846  -3.938
   57   2HD2  LEU   7          2HD2      LEU   7  -6.995  11.096  -2.426
   58   3HD2  LEU   7          3HD2      LEU   7  -7.192   9.591  -3.340
   59    H    SER   8           H        SER   8  -9.407   8.220  -2.821
   60    HA   SER   8           HA       SER   8  -7.596   7.276  -4.441
   61   1HB   SER   8          2HB       SER   8  -9.123   5.465  -2.605
   62   2HB   SER   8          3HB       SER   8  -7.396   5.425  -2.997
   63    HG   SER   8           HG       SER   8  -7.237   7.515  -2.016
   64    H    ALA   9           H        ALA   9 -10.977   6.504  -4.998
   65    HA   ALA   9           HA       ALA   9 -10.664   4.148  -6.562
   66   1HB   ALA   9          1HB       ALA   9 -12.584   6.493  -6.905
   67   2HB   ALA   9          2HB       ALA   9 -12.772   4.888  -7.649
   68   3HB   ALA   9          3HB       ALA   9 -12.854   5.059  -5.884
   69    H    ASP  10           H        ASP  10 -10.146   7.607  -7.413
   70    HA   ASP  10           HA       ASP  10  -9.685   6.969 -10.231
   71   1HB   ASP  10          2HB       ASP  10 -10.601   9.157  -9.310
   72   2HB   ASP  10          3HB       ASP  10  -8.953   9.524  -8.764
   73    H    ASP  11           H        ASP  11  -7.796   7.445  -7.277
   74    HA   ASP  11           HA       ASP  11  -5.164   7.655  -8.314
   75   1HB   ASP  11          2HB       ASP  11  -6.123   6.243  -5.749
   76   2HB   ASP  11          3HB       ASP  11  -4.498   6.606  -6.149
   77    H    ILE  12           H        ILE  12  -7.073   4.807  -7.191
   78    HA   ILE  12           HA       ILE  12  -5.075   3.002  -7.881
   79    HB   ILE  12           HB       ILE  12  -6.691   1.290  -7.647
   80   1HG1  ILE  12          2HG1      ILE  12  -8.783   3.370  -7.259
   81   2HG1  ILE  12          3HG1      ILE  12  -8.688   2.239  -8.613
   82   1HG2  ILE  12          1HG2      ILE  12  -7.101   1.591  -5.254
   83   2HG2  ILE  12          2HG2      ILE  12  -5.510   2.204  -5.710
   84   3HG2  ILE  12          3HG2      ILE  12  -6.838   3.332  -5.408
   85   1HD1  ILE  12          1HD1      ILE  12 -10.347   1.410  -7.132
   86   2HD1  ILE  12          2HD1      ILE  12  -8.934   0.354  -6.948
   87   3HD1  ILE  12          3HD1      ILE  12  -9.307   1.590  -5.715
   88    H    ALA  13           H        ALA  13  -7.859   4.235  -9.779
   89    HA   ALA  13           HA       ALA  13  -7.628   2.552 -12.007
   90   1HB   ALA  13          1HB       ALA  13  -8.690   4.292 -13.295
   91   2HB   ALA  13          2HB       ALA  13  -9.418   4.249 -11.678
   92   3HB   ALA  13          3HB       ALA  13  -8.264   5.528 -12.106
   93    H    ALA  14           H        ALA  14  -5.767   5.568 -11.295
   94    HA   ALA  14           HA       ALA  14  -4.117   5.437 -13.630
   95   1HB   ALA  14          1HB       ALA  14  -4.192   7.444 -12.265
   96   2HB   ALA  14          2HB       ALA  14  -3.475   6.598 -10.882
   97   3HB   ALA  14          3HB       ALA  14  -2.525   6.832 -12.363
   98    H    ALA  15           H        ALA  15  -3.340   4.322 -10.285
   99    HA   ALA  15           HA       ALA  15  -0.918   3.104 -10.745
  100   1HB   ALA  15          1HB       ALA  15  -1.370   1.752  -8.770
  101   2HB   ALA  15          2HB       ALA  15  -1.960   3.408  -8.523
  102   3HB   ALA  15          3HB       ALA  15  -3.105   2.098  -8.890
  103    H    LEU  16           H        LEU  16  -4.111   1.714 -11.217
  104    HA   LEU  16           HA       LEU  16  -3.418  -0.925 -11.759
  105   1HB   LEU  16          2HB       LEU  16  -5.806   0.797 -12.211
  106   2HB   LEU  16          3HB       LEU  16  -5.642  -0.443 -13.424
  107    HG   LEU  16           HG       LEU  16  -7.113  -1.135 -11.650
  108   1HD1  LEU  16          1HD1      LEU  16  -6.256  -3.354 -11.301
  109   2HD1  LEU  16          2HD1      LEU  16  -5.827  -2.816 -12.933
  110   3HD1  LEU  16          3HD1      LEU  16  -4.595  -2.844 -11.651
  111   1HD2  LEU  16          1HD2      LEU  16  -4.721  -0.954  -9.777
  112   2HD2  LEU  16          2HD2      LEU  16  -6.238  -0.028  -9.707
  113   3HD2  LEU  16          3HD2      LEU  16  -6.260  -1.766  -9.416
  114    H    GLN  17           H        GLN  17  -3.333   1.915 -13.860
  115    HA   GLN  17           HA       GLN  17  -2.833   0.254 -16.255
  116   1HB   GLN  17          2HB       GLN  17  -4.335   2.229 -16.352
  117   2HB   GLN  17          3HB       GLN  17  -2.956   3.277 -16.004
  118   1HG   GLN  17          2HG       GLN  17  -2.344   1.413 -18.221
  119   2HG   GLN  17          3HG       GLN  17  -3.839   2.290 -18.525
  120   1HE2  GLN  17          1HE2      GLN  17  -0.441   2.925 -17.388
  121   2HE2  GLN  17          2HE2      GLN  17  -0.335   4.463 -18.226
  122    H    GLU  18           H        GLU  18  -1.152   2.607 -14.095
  123    HA   GLU  18           HA       GLU  18   1.173   2.673 -15.769
  124   1HB   GLU  18          2HB       GLU  18   2.050   4.200 -14.310
  125   2HB   GLU  18          3HB       GLU  18   0.323   4.398 -14.124
  126   1HG   GLU  18          2HG       GLU  18   0.763   4.393 -11.962
  127   2HG   GLU  18          3HG       GLU  18   0.746   2.637 -12.100
  128    H    CYS  19           H        CYS  19   0.286   0.671 -12.974
  129    HA   CYS  19           HA       CYS  19   2.636  -1.133 -13.549
  130   1HB   CYS  19          2HB       CYS  19   1.263  -0.462 -10.933
  131   2HB   CYS  19          3HB       CYS  19   2.236  -1.928 -11.192
  132    HG   CYS  19           HG       CYS  19   3.092   1.226 -11.406
  133    H    ARG  20           H        ARG  20   1.007  -1.688 -15.339
  134    HA   ARG  20           HA       ARG  20  -1.280  -3.303 -14.412
  135   1HB   ARG  20          2HB       ARG  20  -1.272  -1.675 -16.324
  136   2HB   ARG  20          3HB       ARG  20  -0.343  -2.861 -17.258
  137   1HG   ARG  20          2HG       ARG  20  -2.216  -4.468 -17.059
  138   2HG   ARG  20          3HG       ARG  20  -3.063  -3.363 -15.950
  139   1HD   ARG  20          2HD       ARG  20  -3.111  -1.631 -17.719
  140   2HD   ARG  20          3HD       ARG  20  -2.398  -2.789 -18.872
  141    HE   ARG  20           HE       ARG  20  -4.621  -4.090 -17.862
  142   1HH1  ARG  20          2HH2      ARG  20  -4.070  -1.030 -19.519
  143   2HH1  ARG  20          1HH2      ARG  20  -5.668  -0.899 -20.185
  144   1HH2  ARG  20          2HH1      ARG  20  -6.757  -3.985 -18.771
  145   2HH2  ARG  20          1HH1      ARG  20  -7.219  -2.648 -19.772
  146    H    ASP  21           H        ASP  21   1.741  -3.762 -16.303
  147    HA   ASP  21           HA       ASP  21   1.522  -6.612 -16.521
  148   1HB   ASP  21          2HB       ASP  21   4.207  -6.109 -16.789
  149   2HB   ASP  21          3HB       ASP  21   3.014  -5.996 -18.111
  150    HA   PRO  22           HA       PRO  22   2.695  -7.507 -12.328
  151   1HB   PRO  22          2HB       PRO  22   3.426 -10.110 -12.458
  152   2HB   PRO  22          3HB       PRO  22   1.741  -9.577 -12.730
  153   1HG   PRO  22          2HG       PRO  22   3.859 -10.141 -14.829
  154   2HG   PRO  22          3HG       PRO  22   2.195 -10.795 -14.764
  155   1HD   PRO  22          2HD       PRO  22   2.815  -8.615 -16.274
  156   2HD   PRO  22          3HD       PRO  22   1.266  -8.689 -15.377
  157    H    ASP  23           H        ASP  23   4.476  -7.409 -11.026
  158    HA   ASP  23           HA       ASP  23   6.532  -7.657 -10.232
  159   1HB   ASP  23          2HB       ASP  23   6.865  -9.534 -12.002
  160   2HB   ASP  23          3HB       ASP  23   7.827  -8.317 -12.862
  161    H    THR  24           H        THR  24   5.248  -5.527 -12.297
  162    HA   THR  24           HA       THR  24   7.463  -3.763 -12.694
  163    HB   THR  24           HB       THR  24   4.518  -3.302 -13.230
  164    HG1  THR  24           1HG      THR  24   5.020  -4.097 -15.209
  165   1HG2  THR  24          1HG2      THR  24   7.057  -2.040 -14.368
  166   2HG2  THR  24          2HG2      THR  24   5.435  -1.852 -15.054
  167   3HG2  THR  24          3HG2      THR  24   5.779  -1.192 -13.461
  168    H    PHE  25           H        PHE  25   5.772  -4.323  -9.732
  169    HA   PHE  25           HA       PHE  25   4.774  -1.637  -9.587
  170   1HB   PHE  25          2HB       PHE  25   3.633  -3.800  -8.951
  171   2HB   PHE  25          3HB       PHE  25   4.481  -3.699  -7.411
  172    HD1  PHE  25           1HD      PHE  25   3.504  -0.344  -8.527
  173    HD2  PHE  25           2HD      PHE  25   1.997  -3.921  -6.656
  174    HE1  PHE  25           1HE      PHE  25   1.257   0.606  -8.541
  175    HE2  PHE  25           2HE      PHE  25  -0.265  -2.919  -6.600
  176    HZ   PHE  25           HZ       PHE  25  -0.649  -0.651  -7.538
  177    H    GLU  26           H        GLU  26   6.702  -0.382  -9.411
  178    HA   GLU  26           HA       GLU  26   8.527  -0.623  -7.247
  179   1HB   GLU  26          2HB       GLU  26   7.918   1.475  -9.292
  180   2HB   GLU  26          3HB       GLU  26   8.655   2.038  -7.786
  181   1HG   GLU  26          2HG       GLU  26  10.461   0.282  -8.110
  182   2HG   GLU  26          3HG       GLU  26   9.842   0.096  -9.764
  183    HA   PRO  27           HA       PRO  27   5.952   0.823  -4.047
  184   1HB   PRO  27          2HB       PRO  27   7.816   1.631  -2.109
  185   2HB   PRO  27          3HB       PRO  27   7.398  -0.058  -2.494
  186   1HG   PRO  27          2HG       PRO  27   9.776   1.518  -3.478
  187   2HG   PRO  27          3HG       PRO  27   9.695  -0.194  -2.967
  188   1HD   PRO  27          2HD       PRO  27   9.685   0.544  -5.586
  189   2HD   PRO  27          3HD       PRO  27   8.815  -0.897  -4.973
  190    H    GLN  28           H        GLN  28   8.758   3.200  -4.153
  191    HA   GLN  28           HA       GLN  28   7.359   5.396  -3.432
  192   1HB   GLN  28          2HB       GLN  28   9.980   4.813  -4.070
  193   2HB   GLN  28          3HB       GLN  28   9.506   5.764  -5.488
  194   1HG   GLN  28          2HG       GLN  28   8.501   7.377  -3.791
  195   2HG   GLN  28          3HG       GLN  28   9.377   6.497  -2.532
  196   1HE2  GLN  28          1HE2      GLN  28  10.798   8.269  -1.940
  197   2HE2  GLN  28          2HE2      GLN  28  12.007   8.851  -3.062
  198    H    LYS  29           H        LYS  29   7.801   4.031  -6.689
  199    HA   LYS  29           HA       LYS  29   6.534   6.011  -8.236
  200   1HB   LYS  29          2HB       LYS  29   7.778   3.960  -9.072
  201   2HB   LYS  29          3HB       LYS  29   6.344   3.005  -8.679
  202   1HG   LYS  29          2HG       LYS  29   5.521   3.495 -10.730
  203   2HG   LYS  29          3HG       LYS  29   5.296   5.142 -10.188
  204   1HD   LYS  29          2HD       LYS  29   6.596   5.419 -12.093
  205   2HD   LYS  29          3HD       LYS  29   7.796   5.520 -10.792
  206   1HE   LYS  29          2HE       LYS  29   7.696   2.756 -11.357
  207   2HE   LYS  29          3HE       LYS  29   7.369   3.468 -12.938
  208   1HZ   LYS  29          1HZ       LYS  29   9.744   3.678 -11.231
  209   2HZ   LYS  29          2HZ       LYS  29   9.661   3.162 -12.730
  210   3HZ   LYS  29          3HZ       LYS  29   9.507   4.788 -12.453
  211    H    PHE  30           H        PHE  30   5.074   2.966  -6.932
  212    HA   PHE  30           HA       PHE  30   2.450   3.475  -7.658
  213   1HB   PHE  30          2HB       PHE  30   3.166   1.324  -6.878
  214   2HB   PHE  30          3HB       PHE  30   3.682   1.965  -5.335
  215    HD1  PHE  30           1HD      PHE  30   0.417   2.490  -7.163
  216    HD2  PHE  30           2HD      PHE  30   2.417   0.885  -3.688
  217    HE1  PHE  30           1HE      PHE  30  -1.750   2.277  -6.010
  218    HE2  PHE  30           2HE      PHE  30   0.254   0.770  -2.508
  219    HZ   PHE  30           HZ       PHE  30  -1.833   1.547  -3.650
  220    H    PHE  31           H        PHE  31   4.005   4.100  -4.548
  221    HA   PHE  31           HA       PHE  31   2.098   5.325  -3.008
  222   1HB   PHE  31          2HB       PHE  31   4.205   4.921  -2.084
  223   2HB   PHE  31          3HB       PHE  31   5.053   5.651  -3.431
  224    HD1  PHE  31           1HD      PHE  31   2.426   6.881  -1.104
  225    HD2  PHE  31           2HD      PHE  31   6.293   7.542  -2.872
  226    HE1  PHE  31           1HE      PHE  31   2.552   9.124  -0.066
  227    HE2  PHE  31           2HE      PHE  31   6.518   9.651  -1.580
  228    HZ   PHE  31           HZ       PHE  31   4.698  10.334  -0.023
  229    H    GLN  32           H        GLN  32   4.195   7.043  -5.379
  230    HA   GLN  32           HA       GLN  32   2.866   9.564  -5.039
  231   1HB   GLN  32          2HB       GLN  32   5.289   9.160  -5.783
  232   2HB   GLN  32          3HB       GLN  32   4.625   8.682  -7.351
  233   1HG   GLN  32          2HG       GLN  32   3.375  11.034  -7.210
  234   2HG   GLN  32          3HG       GLN  32   4.565  11.382  -5.954
  235   1HE2  GLN  32          1HE2      GLN  32   4.260  10.190  -9.350
  236   2HE2  GLN  32          2HE2      GLN  32   5.733  10.967  -9.908
  237    H    THR  33           H        THR  33   2.613   6.831  -7.434
  238    HA   THR  33           HA       THR  33   1.261   8.357  -9.317
  239    HB   THR  33           HB       THR  33   2.415   5.989  -9.615
  240    HG1  THR  33           1HG      THR  33   0.091   7.095 -10.622
  241   1HG2  THR  33          1HG2      THR  33   0.598   4.764  -8.122
  242   2HG2  THR  33          2HG2      THR  33  -0.489   5.088  -9.465
  243   3HG2  THR  33          3HG2      THR  33   0.968   4.106  -9.697
  244    H    SER  34           H        SER  34   0.059   6.345  -6.620
  245    HA   SER  34           HA       SER  34  -2.691   6.688  -7.245
  246   1HB   SER  34          2HB       SER  34  -1.173   6.349  -4.617
  247   2HB   SER  34          3HB       SER  34  -2.934   6.462  -4.657
  248    HG   SER  34           HG       SER  34  -2.841   4.709  -6.229
  249    H    GLY  35           H        GLY  35  -0.402   8.562  -5.206
  250   1HA   GLY  35          1HA       GLY  35  -0.409  10.972  -5.175
  251   2HA   GLY  35          2HA       GLY  35  -2.177  10.977  -5.276
  252    H    LEU  36           H        LEU  36  -0.577   8.524  -3.242
  253    HA   LEU  36           HA       LEU  36  -1.914   9.501  -0.904
  254   1HB   LEU  36          2HB       LEU  36   0.383   7.570  -1.152
  255   2HB   LEU  36          3HB       LEU  36  -0.643   7.810   0.270
  256    HG   LEU  36           HG       LEU  36  -2.188   7.110  -2.157
  257   1HD1  LEU  36          1HD1      LEU  36  -0.154   5.779  -2.600
  258   2HD1  LEU  36          2HD1      LEU  36  -0.233   5.093  -0.966
  259   3HD1  LEU  36          3HD1      LEU  36  -1.512   4.738  -2.149
  260   1HD2  LEU  36          1HD2      LEU  36  -3.136   7.180   0.144
  261   2HD2  LEU  36          2HD2      LEU  36  -3.263   5.565  -0.581
  262   3HD2  LEU  36          3HD2      LEU  36  -2.015   5.891   0.637
  263    H    SER  37           H        SER  37   1.160  10.217  -2.467
  264    HA   SER  37           HA       SER  37   2.513  11.483  -0.227
  265   1HB   SER  37          2HB       SER  37   3.567  10.813  -2.506
  266   2HB   SER  37          3HB       SER  37   2.701  12.175  -3.191
  267    HG   SER  37           HG       SER  37   4.871  12.258  -1.328
  268    H    LYS  38           H        LYS  38  -0.353  12.325  -1.993
  269    HA   LYS  38           HA       LYS  38  -0.077  15.169  -1.285
  270   1HB   LYS  38          2HB       LYS  38  -1.117  13.885  -3.611
  271   2HB   LYS  38          3HB       LYS  38  -2.506  14.460  -2.711
  272   1HG   LYS  38          2HG       LYS  38  -1.846  16.182  -4.217
  273   2HG   LYS  38          3HG       LYS  38  -1.438  16.751  -2.598
  274   1HD   LYS  38          2HD       LYS  38   0.764  15.240  -3.908
  275   2HD   LYS  38          3HD       LYS  38   0.237  16.629  -4.865
  276   1HE   LYS  38          2HE       LYS  38   0.654  18.167  -3.008
  277   2HE   LYS  38          3HE       LYS  38   1.071  16.839  -1.922
  278   1HZ   LYS  38          1HZ       LYS  38   2.934  16.314  -3.302
  279   2HZ   LYS  38          2HZ       LYS  38   2.589  17.568  -4.322
  280   3HZ   LYS  38          3HZ       LYS  38   3.014  17.860  -2.760
  281    H    MET  39           H        MET  39  -1.665  12.137  -0.460
  282    HA   MET  39           HA       MET  39  -3.752  13.424   1.088
  283   1HB   MET  39          2HB       MET  39  -2.622  10.624   0.997
  284   2HB   MET  39          3HB       MET  39  -3.865  11.100   2.131
  285   1HG   MET  39          2HG       MET  39  -4.210  11.402  -0.882
  286   2HG   MET  39          3HG       MET  39  -4.667   9.988   0.061
  287   1HE   MET  39          1HE       MET  39  -5.823  13.301  -1.325
  288   2HE   MET  39          2HE       MET  39  -7.213  13.739  -0.312
  289   3HE   MET  39          3HE       MET  39  -5.583  14.056   0.271
  290    H    SER  40           H        SER  40  -3.759  14.144   3.132
  291    HA   SER  40           HA       SER  40  -1.307  14.571   4.539
  292   1HB   SER  40          2HB       SER  40  -4.229  14.726   5.410
  293   2HB   SER  40          3HB       SER  40  -2.871  15.265   6.413
  294    HG   SER  40           HG       SER  40  -2.322  16.731   4.741
  295    H    ALA  41           H        ALA  41  -0.539  13.651   6.415
  296    HA   ALA  41           HA       ALA  41  -0.412  11.023   6.987
  297   1HB   ALA  41          1HB       ALA  41  -0.540  13.298   9.005
  298   2HB   ALA  41          2HB       ALA  41   0.096  11.673   9.322
  299   3HB   ALA  41          3HB       ALA  41   0.904  12.720   8.140
  300    H    ASN  42           H        ASN  42  -2.996  13.196   8.097
  301    HA   ASN  42           HA       ASN  42  -4.474  11.540   9.795
  302   1HB   ASN  42          2HB       ASN  42  -5.623  13.450   7.712
  303   2HB   ASN  42          3HB       ASN  42  -6.424  12.880   9.181
  304   1HD2  ASN  42          1HD2      ASN  42  -5.576  15.663   8.149
  305   2HD2  ASN  42          2HD2      ASN  42  -4.664  16.321   9.494
  306    H    GLN  43           H        GLN  43  -4.840  11.876   6.220
  307    HA   GLN  43           HA       GLN  43  -6.950   9.908   6.181
  308   1HB   GLN  43          2HB       GLN  43  -6.435  12.035   4.636
  309   2HB   GLN  43          3HB       GLN  43  -5.695  10.798   3.619
  310   1HG   GLN  43          2HG       GLN  43  -8.540  10.618   4.767
  311   2HG   GLN  43          3HG       GLN  43  -8.154  11.392   3.234
  312   1HE2  GLN  43          1HE2      GLN  43  -9.204   8.355   4.530
  313   2HE2  GLN  43          2HE2      GLN  43  -8.835   7.510   3.053
  314    H    VAL  44           H        VAL  44  -3.427  10.036   5.489
  315    HA   VAL  44           HA       VAL  44  -3.161   7.450   4.340
  316    HB   VAL  44           HB       VAL  44  -1.333   9.216   6.010
  317   1HG1  VAL  44          1HG1      VAL  44  -0.432   6.955   6.115
  318   2HG1  VAL  44          2HG1      VAL  44  -0.644   6.775   4.357
  319   3HG1  VAL  44          3HG1      VAL  44   0.527   7.946   5.006
  320   1HG2  VAL  44          1HG2      VAL  44  -0.405   9.908   3.868
  321   2HG2  VAL  44          2HG2      VAL  44  -1.440   8.752   2.995
  322   3HG2  VAL  44          3HG2      VAL  44  -2.142  10.159   3.790
  323    H    LYS  45           H        LYS  45  -3.219   8.571   7.785
  324    HA   LYS  45           HA       LYS  45  -2.714   5.952   8.815
  325   1HB   LYS  45          2HB       LYS  45  -2.402   8.248   9.951
  326   2HB   LYS  45          3HB       LYS  45  -4.112   8.107  10.399
  327   1HG   LYS  45          2HG       LYS  45  -3.530   5.842  11.422
  328   2HG   LYS  45          3HG       LYS  45  -1.837   6.148  10.985
  329   1HD   LYS  45          2HD       LYS  45  -1.984   8.308  12.343
  330   2HD   LYS  45          3HD       LYS  45  -3.564   7.737  12.922
  331   1HE   LYS  45          2HE       LYS  45  -2.401   5.618  13.744
  332   2HE   LYS  45          3HE       LYS  45  -0.856   6.332  13.256
  333   1HZ   LYS  45          1HZ       LYS  45  -1.244   6.659  15.569
  334   2HZ   LYS  45          2HZ       LYS  45  -1.273   8.122  14.823
  335   3HZ   LYS  45          3HZ       LYS  45  -2.681   7.410  15.301
  336    H    ASP  46           H        ASP  46  -5.713   7.837   8.232
  337    HA   ASP  46           HA       ASP  46  -7.661   5.998   9.115
  338   1HB   ASP  46          2HB       ASP  46  -8.324   8.178   8.415
  339   2HB   ASP  46          3HB       ASP  46  -7.544   7.980   6.846
  340    H    VAL  47           H        VAL  47  -6.393   6.247   5.721
  341    HA   VAL  47           HA       VAL  47  -7.540   3.820   4.916
  342    HB   VAL  47           HB       VAL  47  -6.083   3.765   3.013
  343   1HG1  VAL  47          1HG1      VAL  47  -6.605   6.695   3.386
  344   2HG1  VAL  47          2HG1      VAL  47  -6.891   5.677   1.975
  345   3HG1  VAL  47          3HG1      VAL  47  -7.963   5.566   3.393
  346   1HG2  VAL  47          1HG2      VAL  47  -4.341   5.408   2.587
  347   2HG2  VAL  47          2HG2      VAL  47  -4.497   5.900   4.280
  348   3HG2  VAL  47          3HG2      VAL  47  -3.908   4.271   3.881
  349    H    PHE  48           H        PHE  48  -4.241   4.299   6.309
  350    HA   PHE  48           HA       PHE  48  -3.277   1.696   6.290
  351   1HB   PHE  48          2HB       PHE  48  -1.924   3.381   7.208
  352   2HB   PHE  48          3HB       PHE  48  -3.089   3.795   8.433
  353    HD1  PHE  48           1HD      PHE  48  -3.407   2.499  10.460
  354    HD2  PHE  48           2HD      PHE  48  -0.543   1.296   7.475
  355    HE1  PHE  48           1HE      PHE  48  -2.644   0.657  11.934
  356    HE2  PHE  48           2HE      PHE  48   0.325  -0.448   9.030
  357    HZ   PHE  48           HZ       PHE  48  -0.769  -0.809  11.225
  358    H    ARG  49           H        ARG  49  -5.585   3.027   8.761
  359    HA   ARG  49           HA       ARG  49  -5.793   0.515  10.145
  360   1HB   ARG  49          2HB       ARG  49  -7.791   2.806   9.980
  361   2HB   ARG  49          3HB       ARG  49  -7.897   1.414  11.068
  362   1HG   ARG  49          2HG       ARG  49  -5.602   2.061  11.993
  363   2HG   ARG  49          3HG       ARG  49  -5.714   3.538  11.028
  364   1HD   ARG  49          2HD       ARG  49  -6.475   4.100  13.218
  365   2HD   ARG  49          3HD       ARG  49  -7.896   4.054  12.145
  366    HE   ARG  49           HE       ARG  49  -7.396   1.497  13.414
  367   1HH1  ARG  49          2HH2      ARG  49  -8.811   4.665  13.996
  368   2HH1  ARG  49          1HH2      ARG  49  -9.845   4.160  15.295
  369   1HH2  ARG  49          2HH1      ARG  49  -8.739   0.767  15.147
  370   2HH2  ARG  49          1HH1      ARG  49  -9.790   1.871  15.968
  371    H    PHE  50           H        PHE  50  -7.499   1.808   7.304
  372    HA   PHE  50           HA       PHE  50  -9.494  -0.287   7.225
  373   1HB   PHE  50          2HB       PHE  50  -9.471   2.032   6.039
  374   2HB   PHE  50          3HB       PHE  50  -8.503   1.237   4.803
  375    HD1  PHE  50           1HD      PHE  50  -9.538  -0.507   3.344
  376    HD2  PHE  50           2HD      PHE  50 -11.804   1.435   6.459
  377    HE1  PHE  50           1HE      PHE  50 -11.636  -1.465   2.423
  378    HE2  PHE  50           2HE      PHE  50 -13.876   0.401   5.597
  379    HZ   PHE  50           HZ       PHE  50 -13.794  -1.098   3.620
  380    H    ILE  51           H        ILE  51  -6.162   0.086   6.025
  381    HA   ILE  51           HA       ILE  51  -6.180  -2.347   4.474
  382    HB   ILE  51           HB       ILE  51  -3.724  -1.063   5.678
  383   1HG1  ILE  51          2HG1      ILE  51  -4.508   0.765   4.467
  384   2HG1  ILE  51          3HG1      ILE  51  -3.429  -0.035   3.364
  385   1HG2  ILE  51          1HG2      ILE  51  -2.623  -2.150   3.754
  386   2HG2  ILE  51          2HG2      ILE  51  -3.508  -3.360   4.690
  387   3HG2  ILE  51          3HG2      ILE  51  -4.202  -2.741   3.196
  388   1HD1  ILE  51          1HD1      ILE  51  -5.406   0.730   2.211
  389   2HD1  ILE  51          2HD1      ILE  51  -5.371  -1.041   2.164
  390   3HD1  ILE  51          3HD1      ILE  51  -6.478  -0.194   3.268
  391    H    ASP  52           H        ASP  52  -4.968  -1.565   7.781
  392    HA   ASP  52           HA       ASP  52  -4.195  -4.307   8.208
  393   1HB   ASP  52          2HB       ASP  52  -3.084  -2.153   9.160
  394   2HB   ASP  52          3HB       ASP  52  -4.303  -2.240  10.439
  395    H    ASN  53           H        ASN  53  -6.477  -4.861   7.612
  396    HA   ASN  53           HA       ASN  53  -8.766  -4.503   9.067
  397   1HB   ASN  53          2HB       ASN  53  -8.632  -5.509   6.860
  398   2HB   ASN  53          3HB       ASN  53  -7.823  -6.942   7.505
  399   1HD2  ASN  53          1HD2      ASN  53  -9.083  -8.572   8.555
  400   2HD2  ASN  53          2HD2      ASN  53 -10.835  -8.508   8.537
  401    H    ASP  54           H        ASP  54  -6.120  -6.687   9.924
  402    HA   ASP  54           HA       ASP  54  -7.602  -8.331  11.810
  403   1HB   ASP  54          2HB       ASP  54  -5.381  -9.208  12.291
  404   2HB   ASP  54          3HB       ASP  54  -5.550  -9.066  10.531
  405    H    GLN  55           H        GLN  55  -5.713  -5.348  11.830
  406    HA   GLN  55           HA       GLN  55  -5.311  -3.777  13.258
  407   1HB   GLN  55          2HB       GLN  55  -6.914  -3.084  14.631
  408   2HB   GLN  55          3HB       GLN  55  -7.808  -4.388  13.862
  409   1HG   GLN  55          2HG       GLN  55  -6.976  -5.813  15.942
  410   2HG   GLN  55          3HG       GLN  55  -6.621  -4.233  16.647
  411   1HE2  GLN  55          1HE2      GLN  55  -8.359  -5.819  17.964
  412   2HE2  GLN  55          2HE2      GLN  55  -9.979  -5.160  17.805
  413    H    SER  56           H        SER  56  -3.718  -6.445  13.495
  414    HA   SER  56           HA       SER  56  -2.682  -6.698  16.029
  415   1HB   SER  56          2HB       SER  56  -0.543  -7.326  15.067
  416   2HB   SER  56          3HB       SER  56  -1.857  -8.067  14.159
  417    HG   SER  56           HG       SER  56  -0.007  -6.999  12.958
  418    H    GLY  57           H        GLY  57  -2.296  -3.914  13.926
  419   1HA   GLY  57          1HA       GLY  57  -1.654  -1.759  14.879
  420   2HA   GLY  57          2HA       GLY  57  -0.490  -2.579  15.929
  421    H    TYR  58           H        TYR  58   0.079  -4.524  13.606
  422    HA   TYR  58           HA       TYR  58   1.901  -2.758  12.066
  423   1HB   TYR  58          2HB       TYR  58   2.303  -5.555  13.155
  424   2HB   TYR  58          3HB       TYR  58   3.373  -4.792  11.983
  425    HD1  TYR  58           HD1      TYR  58   4.802  -2.869  12.633
  426    HD2  TYR  58           HD2      TYR  58   2.200  -4.775  15.495
  427    HE1  TYR  58           HE1      TYR  58   5.720  -1.431  14.426
  428    HE2  TYR  58           HE2      TYR  58   3.146  -3.365  17.291
  429    HH   TYR  58           HH       TYR  58   4.565  -1.616  17.805
  430    H    LEU  59           H        LEU  59   1.887  -2.970   9.923
  431    HA   LEU  59           HA       LEU  59   0.016  -4.821   8.582
  432   1HB   LEU  59          2HB       LEU  59   1.616  -2.413   7.794
  433   2HB   LEU  59          3HB       LEU  59   1.512  -3.682   6.580
  434    HG   LEU  59           HG       LEU  59  -0.939  -2.592   7.979
  435   1HD1  LEU  59          1HD1      LEU  59   0.197  -1.802   5.260
  436   2HD1  LEU  59          2HD1      LEU  59  -1.326  -1.227   5.966
  437   3HD1  LEU  59          3HD1      LEU  59   0.229  -0.783   6.697
  438   1HD2  LEU  59          1HD2      LEU  59  -2.197  -3.785   6.422
  439   2HD2  LEU  59          2HD2      LEU  59  -0.879  -3.883   5.232
  440   3HD2  LEU  59          3HD2      LEU  59  -0.873  -4.922   6.651
  441    H    ASP  60           H        ASP  60   1.018  -6.558   9.797
  442    HA   ASP  60           HA       ASP  60   3.700  -7.388   9.186
  443   1HB   ASP  60          2HB       ASP  60   1.325  -9.078  10.046
  444   2HB   ASP  60          3HB       ASP  60   3.031  -9.523  10.125
  445    H    GLU  61           H        GLU  61   4.201  -9.316   7.838
  446    HA   GLU  61           HA       GLU  61   3.772  -8.749   5.207
  447   1HB   GLU  61          2HB       GLU  61   4.601 -11.382   6.466
  448   2HB   GLU  61          3HB       GLU  61   4.659 -11.046   4.729
  449   1HG   GLU  61          2HG       GLU  61   6.136  -9.114   5.105
  450   2HG   GLU  61          3HG       GLU  61   6.145  -9.428   6.847
  451    H    GLU  62           H        GLU  62   1.787 -11.019   7.140
  452    HA   GLU  62           HA       GLU  62   0.587 -12.202   4.816
  453   1HB   GLU  62          2HB       GLU  62   0.726 -13.222   7.172
  454   2HB   GLU  62          3HB       GLU  62  -0.606 -12.149   7.638
  455   1HG   GLU  62          2HG       GLU  62  -2.009 -13.156   5.834
  456   2HG   GLU  62          3HG       GLU  62  -0.651 -14.203   5.369
  457    H    GLU  63           H        GLU  63  -0.669  -9.701   7.134
  458    HA   GLU  63           HA       GLU  63  -2.951  -9.095   5.558
  459   1HB   GLU  63          2HB       GLU  63  -1.394  -7.115   7.257
  460   2HB   GLU  63          3HB       GLU  63  -3.097  -7.039   6.766
  461   1HG   GLU  63          2HG       GLU  63  -3.418  -8.000   8.805
  462   2HG   GLU  63          3HG       GLU  63  -3.110  -9.500   7.955
  463    H    LEU  64           H        LEU  64   0.432  -8.034   5.232
  464    HA   LEU  64           HA       LEU  64   0.045  -6.163   3.167
  465   1HB   LEU  64          2HB       LEU  64   2.260  -7.444   4.347
  466   2HB   LEU  64          3HB       LEU  64   2.363  -7.864   2.638
  467    HG   LEU  64           HG       LEU  64   1.993  -5.288   2.251
  468   1HD1  LEU  64          1HD1      LEU  64   1.360  -4.932   4.706
  469   2HD1  LEU  64          2HD1      LEU  64   3.033  -5.313   5.134
  470   3HD1  LEU  64          3HD1      LEU  64   2.687  -3.880   4.152
  471   1HD2  LEU  64          1HD2      LEU  64   4.554  -6.361   3.492
  472   2HD2  LEU  64          2HD2      LEU  64   4.121  -6.351   1.767
  473   3HD2  LEU  64          3HD2      LEU  64   4.406  -4.823   2.610
  474    H    LYS  65           H        LYS  65  -0.071  -9.731   3.014
  475    HA   LYS  65           HA       LYS  65  -0.241  -9.986   0.175
  476   1HB   LYS  65          2HB       LYS  65   0.097 -11.794   2.002
  477   2HB   LYS  65          3HB       LYS  65  -1.678 -11.741   2.143
  478   1HG   LYS  65          2HG       LYS  65  -1.929 -12.427  -0.197
  479   2HG   LYS  65          3HG       LYS  65  -0.179 -12.365  -0.422
  480   1HD   LYS  65          2HD       LYS  65  -0.947 -14.663  -0.099
  481   2HD   LYS  65          3HD       LYS  65   0.124 -14.170   1.227
  482   1HE   LYS  65          2HE       LYS  65  -1.828 -13.805   2.719
  483   2HE   LYS  65          3HE       LYS  65  -2.937 -14.140   1.373
  484   1HZ   LYS  65          1HZ       LYS  65  -1.045 -16.043   2.592
  485   2HZ   LYS  65          2HZ       LYS  65  -2.658 -15.981   2.879
  486   3HZ   LYS  65          3HZ       LYS  65  -2.112 -16.393   1.380
  487    H    PHE  66           H        PHE  66  -2.438  -8.443   2.330
  488    HA   PHE  66           HA       PHE  66  -4.438  -8.371   0.160
  489   1HB   PHE  66          2HB       PHE  66  -4.950  -8.689   3.142
  490   2HB   PHE  66          3HB       PHE  66  -6.183  -8.128   2.032
  491    HD1  PHE  66           1HD      PHE  66  -4.235 -11.087   3.065
  492    HD2  PHE  66           2HD      PHE  66  -7.310  -9.567   0.448
  493    HE1  PHE  66           1HE      PHE  66  -4.974 -13.401   2.552
  494    HE2  PHE  66           2HE      PHE  66  -7.885 -11.868  -0.228
  495    HZ   PHE  66           HZ       PHE  66  -6.735 -13.799   0.834
  496    H    PHE  67           H        PHE  67  -2.131  -6.600   0.830
  497    HA   PHE  67           HA       PHE  67  -3.016  -4.359   2.256
  498   1HB   PHE  67          2HB       PHE  67  -0.667  -4.949   1.379
  499   2HB   PHE  67          3HB       PHE  67  -1.121  -4.143  -0.089
  500    HD1  PHE  67           1HD      PHE  67   0.422  -3.716   3.017
  501    HD2  PHE  67           2HD      PHE  67  -2.023  -1.657   0.150
  502    HE1  PHE  67           1HE      PHE  67   1.812  -1.686   3.298
  503    HE2  PHE  67           2HE      PHE  67  -0.701   0.406   0.502
  504    HZ   PHE  67           HZ       PHE  67   1.334   0.324   1.949
  505    H    LEU  68           H        LEU  68  -2.794  -4.604  -1.329
  506    HA   LEU  68           HA       LEU  68  -4.815  -2.468  -1.650
  507   1HB   LEU  68          2HB       LEU  68  -3.216  -3.985  -3.711
  508   2HB   LEU  68          3HB       LEU  68  -4.122  -2.487  -3.973
  509    HG   LEU  68           HG       LEU  68  -1.692  -2.757  -2.125
  510   1HD1  LEU  68          1HD1      LEU  68  -0.453  -1.575  -3.839
  511   2HD1  LEU  68          2HD1      LEU  68  -1.115  -3.073  -4.493
  512   3HD1  LEU  68          3HD1      LEU  68  -1.883  -1.523  -4.896
  513   1HD2  LEU  68          1HD2      LEU  68  -1.751  -0.320  -2.068
  514   2HD2  LEU  68          2HD2      LEU  68  -3.140  -0.301  -3.182
  515   3HD2  LEU  68          3HD2      LEU  68  -3.320  -0.901  -1.523
  516    H    GLN  69           H        GLN  69  -4.916  -5.865  -1.452
  517    HA   GLN  69           HA       GLN  69  -7.043  -6.520  -3.227
  518   1HB   GLN  69          2HB       GLN  69  -6.437  -7.476  -0.409
  519   2HB   GLN  69          3HB       GLN  69  -7.677  -8.190  -1.443
  520   1HG   GLN  69          2HG       GLN  69  -4.748  -8.087  -2.259
  521   2HG   GLN  69          3HG       GLN  69  -5.501  -9.459  -1.445
  522   1HE2  GLN  69          1HE2      GLN  69  -5.210  -7.813  -4.533
  523   2HE2  GLN  69          2HE2      GLN  69  -6.191  -9.015  -5.389
  524    H    LYS  70           H        LYS  70  -7.039  -4.738  -0.134
  525    HA   LYS  70           HA       LYS  70  -9.845  -4.793   0.303
  526   1HB   LYS  70          2HB       LYS  70  -8.145  -2.356   0.879
  527   2HB   LYS  70          3HB       LYS  70  -9.566  -2.910   1.743
  528   1HG   LYS  70          2HG       LYS  70  -6.728  -3.963   1.816
  529   2HG   LYS  70          3HG       LYS  70  -7.655  -3.237   3.108
  530   1HD   LYS  70          2HD       LYS  70  -8.139  -6.023   1.946
  531   2HD   LYS  70          3HD       LYS  70  -7.239  -5.614   3.397
  532   1HE   LYS  70          2HE       LYS  70  -9.295  -6.261   4.262
  533   2HE   LYS  70          3HE       LYS  70  -9.343  -4.495   4.332
  534   1HZ   LYS  70          1HZ       LYS  70 -10.589  -6.189   2.257
  535   2HZ   LYS  70          2HZ       LYS  70 -11.378  -5.449   3.496
  536   3HZ   LYS  70          3HZ       LYS  70 -10.669  -4.546   2.319
  537    H    PHE  71           H        PHE  71  -7.913  -3.047  -2.056
  538    HA   PHE  71           HA       PHE  71 -10.062  -1.143  -2.720
  539   1HB   PHE  71          2HB       PHE  71  -7.427  -1.615  -4.158
  540   2HB   PHE  71          3HB       PHE  71  -8.507  -0.240  -4.278
  541    HD1  PHE  71           1HD      PHE  71  -5.678   0.179  -3.971
  542    HD2  PHE  71           2HD      PHE  71  -8.662  -0.402  -0.906
  543    HE1  PHE  71           1HE      PHE  71  -4.384   1.603  -2.408
  544    HE2  PHE  71           2HE      PHE  71  -7.236   0.783   0.704
  545    HZ   PHE  71           HZ       PHE  71  -5.106   1.831  -0.045
  546    H    GLU  72           H        GLU  72  -8.143  -3.750  -4.328
  547    HA   GLU  72           HA       GLU  72 -10.474  -4.331  -6.081
  548   1HB   GLU  72          2HB       GLU  72  -8.739  -2.594  -7.011
  549   2HB   GLU  72          3HB       GLU  72  -7.686  -3.984  -7.242
  550   1HG   GLU  72          2HG       GLU  72  -8.780  -4.517  -9.154
  551   2HG   GLU  72          3HG       GLU  72 -10.340  -4.586  -8.323
  552    H    SER  73           H        SER  73 -10.745  -6.524  -6.313
  553    HA   SER  73           HA       SER  73  -9.277  -8.392  -4.812
  554   1HB   SER  73          2HB       SER  73 -10.535 -10.026  -6.367
  555   2HB   SER  73          3HB       SER  73 -11.503  -8.883  -5.421
  556    HG   SER  73           HG       SER  73 -10.826  -8.668  -8.168
  557    H    GLY  74           H        GLY  74  -8.618  -7.075  -7.974
  558   1HA   GLY  74          1HA       GLY  74  -6.561  -9.193  -8.550
  559   2HA   GLY  74          2HA       GLY  74  -7.347  -8.154  -9.734
  560    H    ALA  75           H        ALA  75  -6.412  -6.603  -6.704
  561    HA   ALA  75           HA       ALA  75  -5.005  -4.624  -7.989
  562   1HB   ALA  75          1HB       ALA  75  -5.811  -4.371  -5.713
  563   2HB   ALA  75          2HB       ALA  75  -4.634  -5.562  -5.114
  564   3HB   ALA  75          3HB       ALA  75  -4.082  -4.018  -5.811
  565    H    ARG  76           H        ARG  76  -3.252  -7.063  -5.955
  566    HA   ARG  76           HA       ARG  76  -1.412  -7.719  -8.012
  567   1HB   ARG  76          2HB       ARG  76  -0.771  -5.190  -7.081
  568   2HB   ARG  76          3HB       ARG  76   0.080  -6.164  -5.895
  569   1HG   ARG  76          2HG       ARG  76   1.603  -5.865  -7.583
  570   2HG   ARG  76          3HG       ARG  76   1.055  -7.526  -7.810
  571   1HD   ARG  76          2HD       ARG  76  -0.158  -6.969  -9.781
  572   2HD   ARG  76          3HD       ARG  76  -0.351  -5.265  -9.298
  573    HE   ARG  76           HE       ARG  76   2.423  -5.861  -9.559
  574   1HH1  ARG  76          2HH2      ARG  76  -0.389  -5.640 -11.599
  575   2HH1  ARG  76          1HH2      ARG  76   0.465  -5.047 -12.977
  576   1HH2  ARG  76          2HH1      ARG  76   3.498  -4.910 -10.995
  577   2HH2  ARG  76          1HH1      ARG  76   2.878  -4.511 -12.592
  578    H    GLU  77           H        GLU  77  -1.575  -7.131  -4.614
  579    HA   GLU  77           HA       GLU  77   0.239  -8.328  -3.376
  580   1HB   GLU  77          2HB       GLU  77  -2.480  -9.015  -2.305
  581   2HB   GLU  77          3HB       GLU  77  -1.045  -8.402  -1.456
  582   1HG   GLU  77          2HG       GLU  77  -3.083  -6.883  -3.122
  583   2HG   GLU  77          3HG       GLU  77  -2.642  -6.672  -1.427
  584    H    LEU  78           H        LEU  78  -2.264 -10.262  -4.777
  585    HA   LEU  78           HA       LEU  78  -1.981 -12.864  -4.091
  586   1HB   LEU  78          2HB       LEU  78  -1.706 -12.006  -6.996
  587   2HB   LEU  78          3HB       LEU  78  -2.425 -13.457  -6.327
  588    HG   LEU  78           HG       LEU  78  -4.230 -12.330  -7.041
  589   1HD1  LEU  78          1HD1      LEU  78  -4.146 -11.213  -4.205
  590   2HD1  LEU  78          2HD1      LEU  78  -5.565 -11.543  -5.209
  591   3HD1  LEU  78          3HD1      LEU  78  -4.558 -12.887  -4.642
  592   1HD2  LEU  78          1HD2      LEU  78  -4.697 -10.069  -7.193
  593   2HD2  LEU  78          2HD2      LEU  78  -3.496  -9.590  -6.007
  594   3HD2  LEU  78          3HD2      LEU  78  -2.983 -10.188  -7.602
  595    H    THR  79           H        THR  79   0.409 -11.057  -6.139
  596    HA   THR  79           HA       THR  79   2.220 -13.392  -6.139
  597    HB   THR  79           HB       THR  79   2.283 -12.477  -8.211
  598    HG1  THR  79           1HG      THR  79   4.254 -11.277  -8.325
  599   1HG2  THR  79          1HG2      THR  79   0.989 -10.493  -8.064
  600   2HG2  THR  79          2HG2      THR  79   2.181  -9.702  -6.997
  601   3HG2  THR  79          3HG2      THR  79   2.556 -10.024  -8.706
  602    H    GLU  80           H        GLU  80   3.629 -13.750  -4.574
  603    HA   GLU  80           HA       GLU  80   4.093 -12.063  -2.397
  604   1HB   GLU  80          2HB       GLU  80   5.902 -13.478  -1.795
  605   2HB   GLU  80          3HB       GLU  80   4.562 -14.477  -2.339
  606   1HG   GLU  80          2HG       GLU  80   5.702 -15.070  -4.369
  607   2HG   GLU  80          3HG       GLU  80   6.905 -13.788  -4.183
  608    H    SER  81           H        SER  81   5.599 -12.061  -5.592
  609    HA   SER  81           HA       SER  81   8.033 -10.787  -4.916
  610   1HB   SER  81          2HB       SER  81   7.431 -11.869  -7.158
  611   2HB   SER  81          3HB       SER  81   6.560 -10.375  -7.557
  612    HG   SER  81           HG       SER  81   8.544  -9.948  -8.266
  613    H    GLU  82           H        GLU  82   5.008  -9.336  -6.241
  614    HA   GLU  82           HA       GLU  82   5.925  -6.668  -5.958
  615   1HB   GLU  82          2HB       GLU  82   3.088  -7.706  -6.155
  616   2HB   GLU  82          3HB       GLU  82   3.623  -6.049  -6.467
  617   1HG   GLU  82          2HG       GLU  82   4.924  -8.279  -8.086
  618   2HG   GLU  82          3HG       GLU  82   3.275  -7.805  -8.453
  619    H    THR  83           H        THR  83   3.840  -8.723  -3.837
  620    HA   THR  83           HA       THR  83   3.369  -6.853  -1.767
  621    HB   THR  83           HB       THR  83   3.639  -9.843  -1.892
  622    HG1  THR  83           1HG      THR  83   1.679  -8.307  -0.585
  623   1HG2  THR  83          1HG2      THR  83   3.550  -8.296   0.722
  624   2HG2  THR  83          2HG2      THR  83   3.126 -10.007   0.549
  625   3HG2  THR  83          3HG2      THR  83   4.783  -9.479   0.239
  626    H    LYS  84           H        LYS  84   6.292  -8.960  -2.266
  627    HA   LYS  84           HA       LYS  84   7.567  -7.754   0.010
  628   1HB   LYS  84          2HB       LYS  84   8.566  -9.640  -2.111
  629   2HB   LYS  84          3HB       LYS  84   9.631  -8.915  -0.893
  630   1HG   LYS  84          2HG       LYS  84   8.126  -9.712   0.934
  631   2HG   LYS  84          3HG       LYS  84   7.153 -10.578  -0.259
  632   1HD   LYS  84          2HD       LYS  84  10.159 -11.007   0.109
  633   2HD   LYS  84          3HD       LYS  84   8.936 -11.889   1.047
  634   1HE   LYS  84          2HE       LYS  84   7.917 -12.798  -0.960
  635   2HE   LYS  84          3HE       LYS  84   8.983 -11.875  -2.023
  636   1HZ   LYS  84          1HZ       LYS  84  10.794 -13.201  -1.330
  637   2HZ   LYS  84          2HZ       LYS  84   9.906 -13.943  -0.144
  638   3HZ   LYS  84          3HZ       LYS  84   9.517 -14.184  -1.717
  639    H    SER  85           H        SER  85   7.622  -6.891  -3.476
  640    HA   SER  85           HA       SER  85   9.670  -4.963  -3.307
  641   1HB   SER  85          2HB       SER  85   7.066  -4.671  -4.875
  642   2HB   SER  85          3HB       SER  85   8.627  -3.929  -5.224
  643    HG   SER  85           HG       SER  85   9.431  -6.166  -5.403
  644    H    LEU  86           H        LEU  86   6.170  -4.720  -2.494
  645    HA   LEU  86           HA       LEU  86   6.282  -2.006  -1.606
  646   1HB   LEU  86          2HB       LEU  86   4.270  -3.784  -2.013
  647   2HB   LEU  86          3HB       LEU  86   4.351  -3.865  -0.254
  648    HG   LEU  86           HG       LEU  86   3.987  -1.365  -1.971
  649   1HD1  LEU  86          1HD1      LEU  86   2.031  -2.799  -0.126
  650   2HD1  LEU  86          2HD1      LEU  86   1.707  -1.337  -1.081
  651   3HD1  LEU  86          3HD1      LEU  86   2.017  -2.876  -1.899
  652   1HD2  LEU  86          1HD2      LEU  86   3.478  -0.210   0.187
  653   2HD2  LEU  86          2HD2      LEU  86   4.018  -1.654   1.068
  654   3HD2  LEU  86          3HD2      LEU  86   5.163  -0.720   0.078
  655    H    MET  87           H        MET  87   6.322  -5.060   0.285
  656    HA   MET  87           HA       MET  87   6.808  -4.110   2.785
  657   1HB   MET  87          2HB       MET  87   6.552  -6.561   2.049
  658   2HB   MET  87          3HB       MET  87   8.259  -6.507   1.630
  659   1HG   MET  87          2HG       MET  87   8.531  -5.686   4.168
  660   2HG   MET  87          3HG       MET  87   6.964  -6.478   4.331
  661   1HE   MET  87          1HE       MET  87  10.989  -8.509   3.347
  662   2HE   MET  87          2HE       MET  87  10.233  -7.425   2.162
  663   3HE   MET  87          3HE       MET  87  10.771  -6.789   3.737
  664    H    ALA  88           H        ALA  88   9.288  -4.893   0.383
  665    HA   ALA  88           HA       ALA  88  11.609  -4.623   1.826
  666   1HB   ALA  88          1HB       ALA  88  11.567  -5.592  -0.395
  667   2HB   ALA  88          2HB       ALA  88  11.042  -4.066  -1.122
  668   3HB   ALA  88          3HB       ALA  88  12.675  -4.209  -0.426
  669    H    ALA  89           H        ALA  89   9.837  -2.025   0.100
  670    HA   ALA  89           HA       ALA  89  11.803   0.000   0.993
  671   1HB   ALA  89          1HB       ALA  89  10.839   0.338  -1.150
  672   2HB   ALA  89          2HB       ALA  89   9.176   0.214  -0.504
  673   3HB   ALA  89          3HB       ALA  89  10.213   1.594  -0.067
  674    H    ALA  90           H        ALA  90   8.358  -0.834   1.636
  675    HA   ALA  90           HA       ALA  90   7.694   1.226   3.407
  676   1HB   ALA  90          1HB       ALA  90   6.851  -1.696   3.481
  677   2HB   ALA  90          2HB       ALA  90   6.002  -0.348   4.266
  678   3HB   ALA  90          3HB       ALA  90   6.099  -0.426   2.488
  679    H    ASP  91           H        ASP  91   9.297  -1.888   4.161
  680    HA   ASP  91           HA       ASP  91   9.405  -1.326   6.982
  681   1HB   ASP  91          2HB       ASP  91   9.367  -3.644   6.109
  682   2HB   ASP  91          3HB       ASP  91  10.950  -3.384   5.358
  683    H    ASN  92           H        ASN  92  10.315   0.844   6.845
  684    HA   ASN  92           HA       ASN  92  13.074   1.182   5.914
  685   1HB   ASN  92          2HB       ASN  92  12.885   3.461   6.749
  686   2HB   ASN  92          3HB       ASN  92  11.558   3.012   5.674
  687   1HD2  ASN  92          1HD2      ASN  92  11.087   5.333   7.202
  688   2HD2  ASN  92          2HD2      ASN  92   9.998   4.879   8.467
  689    H    ASP  93           H        ASP  93  13.225  -0.928   7.458
  690    HA   ASP  93           HA       ASP  93  14.787  -0.078   9.858
  691   1HB   ASP  93          2HB       ASP  93  12.707  -2.310   9.715
  692   2HB   ASP  93          3HB       ASP  93  13.937  -2.191  10.970
  693    H    GLY  94           H        GLY  94  13.718  -2.943   7.974
  694   1HA   GLY  94          1HA       GLY  94  15.206  -4.489   6.863
  695   2HA   GLY  94          2HA       GLY  94  16.491  -4.075   8.008
  696    H    ASP  95           H        ASP  95  12.989  -4.734   8.472
  697    HA   ASP  95           HA       ASP  95  13.624  -7.236   9.930
  698   1HB   ASP  95          2HB       ASP  95  12.034  -6.854  11.662
  699   2HB   ASP  95          3HB       ASP  95  13.264  -5.588  11.677
  700    H    GLY  96           H        GLY  96  10.764  -5.371   8.693
  701   1HA   GLY  96          1HA       GLY  96   9.891  -6.281   6.511
  702   2HA   GLY  96          2HA       GLY  96   9.861  -7.872   7.278
  703    H    LYS  97           H        LYS  97   9.140  -6.295   9.888
  704    HA   LYS  97           HA       LYS  97   6.216  -6.566   9.617
  705   1HB   LYS  97          2HB       LYS  97   7.948  -5.847  12.012
  706   2HB   LYS  97          3HB       LYS  97   6.246  -6.317  12.028
  707   1HG   LYS  97          2HG       LYS  97   6.849  -8.613  11.337
  708   2HG   LYS  97          3HG       LYS  97   8.535  -8.133  11.101
  709   1HD   LYS  97          2HD       LYS  97   8.672  -9.124  13.188
  710   2HD   LYS  97          3HD       LYS  97   8.601  -7.406  13.534
  711   1HE   LYS  97          2HE       LYS  97   7.064  -8.203  15.084
  712   2HE   LYS  97          3HE       LYS  97   5.977  -7.799  13.747
  713   1HZ   LYS  97          1HZ       LYS  97   5.488  -9.938  14.605
  714   2HZ   LYS  97          2HZ       LYS  97   6.062 -10.110  13.081
  715   3HZ   LYS  97          3HZ       LYS  97   7.029 -10.474  14.374
  716    H    ILE  98           H        ILE  98   5.240  -4.731   8.818
  717    HA   ILE  98           HA       ILE  98   6.587  -2.089   9.097
  718    HB   ILE  98           HB       ILE  98   4.507  -3.266   7.257
  719   1HG1  ILE  98          2HG1      ILE  98   6.993  -1.923   6.286
  720   2HG1  ILE  98          3HG1      ILE  98   7.273  -3.392   7.207
  721   1HG2  ILE  98          1HG2      ILE  98   5.481  -0.390   7.201
  722   2HG2  ILE  98          2HG2      ILE  98   4.437  -1.186   6.015
  723   3HG2  ILE  98          3HG2      ILE  98   3.843  -0.915   7.657
  724   1HD1  ILE  98          1HD1      ILE  98   5.481  -3.209   4.769
  725   2HD1  ILE  98          2HD1      ILE  98   7.114  -3.920   4.902
  726   3HD1  ILE  98          3HD1      ILE  98   5.753  -4.665   5.762
  727    H    GLY  99           H        GLY  99   5.564  -0.392  10.177
  728   1HA   GLY  99          1HA       GLY  99   2.959  -0.995  11.549
  729   2HA   GLY  99          2HA       GLY  99   4.261  -0.023  12.238
  730    H    ALA 100           H        ALA 100   1.927   1.200  12.250
  731    HA   ALA 100           HA       ALA 100   1.137   2.557   9.862
  732   1HB   ALA 100          1HB       ALA 100   0.878   3.528  12.730
  733   2HB   ALA 100          2HB       ALA 100  -0.051   4.058  11.302
  734   3HB   ALA 100          3HB       ALA 100  -0.249   2.409  11.927
  735    H    GLU 101           H        GLU 101   3.518   3.270  12.441
  736    HA   GLU 101           HA       GLU 101   4.317   5.803  11.526
  737   1HB   GLU 101          2HB       GLU 101   5.789   3.611  13.051
  738   2HB   GLU 101          3HB       GLU 101   6.563   5.139  12.610
  739   1HG   GLU 101          2HG       GLU 101   4.829   6.425  13.764
  740   2HG   GLU 101          3HG       GLU 101   3.979   4.934  14.219
  741    H    GLU 102           H        GLU 102   5.972   2.667  10.864
  742    HA   GLU 102           HA       GLU 102   7.745   3.507   8.933
  743   1HB   GLU 102          2HB       GLU 102   6.265   0.861   8.830
  744   2HB   GLU 102          3HB       GLU 102   7.874   1.228   8.208
  745   1HG   GLU 102          2HG       GLU 102   8.644   1.658  10.558
  746   2HG   GLU 102          3HG       GLU 102   7.079   1.099  11.170
  747    H    PHE 103           H        PHE 103   4.357   2.453   8.420
  748    HA   PHE 103           HA       PHE 103   4.373   2.674   5.575
  749   1HB   PHE 103          2HB       PHE 103   2.703   1.359   6.678
  750   2HB   PHE 103          3HB       PHE 103   2.169   2.722   7.651
  751    HD1  PHE 103           1HD      PHE 103   0.378   4.076   6.936
  752    HD2  PHE 103           2HD      PHE 103   2.517   1.736   4.021
  753    HE1  PHE 103           1HE      PHE 103  -1.330   4.635   5.221
  754    HE2  PHE 103           2HE      PHE 103   0.889   2.465   2.280
  755    HZ   PHE 103           HZ       PHE 103  -1.090   3.803   2.906
  756    H    GLN 104           H        GLN 104   3.124   4.978   8.060
  757    HA   GLN 104           HA       GLN 104   2.401   7.129   6.316
  758   1HB   GLN 104          2HB       GLN 104   1.836   6.910   8.744
  759   2HB   GLN 104          3HB       GLN 104   3.521   7.309   9.136
  760   1HG   GLN 104          2HG       GLN 104   3.217   9.466   7.809
  761   2HG   GLN 104          3HG       GLN 104   1.508   9.051   7.633
  762   1HE2  GLN 104          1HE2      GLN 104   0.724   8.188  10.112
  763   2HE2  GLN 104          2HE2      GLN 104   1.029   9.452  11.301
  764    H    GLU 105           H        GLU 105   5.550   6.237   7.845
  765    HA   GLU 105           HA       GLU 105   7.046   8.460   7.058
  766   1HB   GLU 105          2HB       GLU 105   7.560   5.912   8.242
  767   2HB   GLU 105          3HB       GLU 105   8.605   5.985   6.833
  768   1HG   GLU 105          2HG       GLU 105   8.426   8.241   8.887
  769   2HG   GLU 105          3HG       GLU 105   9.534   6.880   9.053
  770    H    MET 106           H        MET 106   6.703   5.335   5.264
  771    HA   MET 106           HA       MET 106   8.031   6.241   2.897
  772   1HB   MET 106          2HB       MET 106   6.292   3.960   3.610
  773   2HB   MET 106          3HB       MET 106   6.119   4.505   1.936
  774   1HG   MET 106          2HG       MET 106   7.848   2.863   2.019
  775   2HG   MET 106          3HG       MET 106   8.562   4.400   1.601
  776   1HE   MET 106          1HE       MET 106  10.133   5.867   3.375
  777   2HE   MET 106          2HE       MET 106  11.370   4.785   4.023
  778   3HE   MET 106          3HE       MET 106  10.911   4.663   2.313
  779    H    VAL 107           H        VAL 107   4.601   6.248   3.806
  780    HA   VAL 107           HA       VAL 107   3.851   7.459   1.372
  781    HB   VAL 107           HB       VAL 107   2.291   6.820   3.876
  782   1HG1  VAL 107          1HG1      VAL 107   0.288   7.022   2.351
  783   2HG1  VAL 107          2HG1      VAL 107   1.047   8.575   2.735
  784   3HG1  VAL 107          3HG1      VAL 107   1.351   7.795   1.170
  785   1HG2  VAL 107          1HG2      VAL 107   1.417   5.041   2.314
  786   2HG2  VAL 107          2HG2      VAL 107   2.593   5.546   1.105
  787   3HG2  VAL 107          3HG2      VAL 107   3.143   4.853   2.642
  788    H    HIS 108           H        HIS 108   5.226   8.920   4.079
  789    HA   HIS 108           HA       HIS 108   4.043  11.553   3.611
  790   1HB   HIS 108          2HB       HIS 108   4.551  10.867   5.870
  791   2HB   HIS 108          3HB       HIS 108   6.207  10.435   5.437
  792    HD1  HIS 108           1HD      HIS 108   4.107  13.699   5.563
  793    HD2  HIS 108           2HD      HIS 108   7.984  12.156   6.109
  794    HE1  HIS 108           1HE      HIS 108   5.543  15.617   6.461
  795    H    SER 109           H        SER 109   6.414   9.651   2.056
  796    HA   SER 109           HA       SER 109   8.506  11.579   1.894
  797   1HB   SER 109          2HB       SER 109   8.793   9.091   1.784
  798   2HB   SER 109          3HB       SER 109   8.051   9.129   0.170
  799    HG   SER 109           HG       SER 109   9.707  10.899  -0.156
  Start of MODEL   16
    1   1H    MET   1           H1       MET   1 -17.590   7.615   2.333
    2   2H    MET   1           H2       MET   1 -19.000   7.106   1.593
    3   3H    MET   1           H3       MET   1 -18.289   6.223   2.814
    4    HA   MET   1           HA       MET   1 -17.783   5.170   0.737
    5   1HB   MET   1          2HB       MET   1 -16.394   7.822   0.087
    6   2HB   MET   1          3HB       MET   1 -16.422   6.314  -0.833
    7   1HG   MET   1          2HG       MET   1 -18.711   8.235  -0.458
    8   2HG   MET   1          3HG       MET   1 -17.901   7.744  -1.946
    9   1HE   MET   1          1HE       MET   1 -20.117   7.285  -3.214
   10   2HE   MET   1          2HE       MET   1 -21.460   6.332  -2.543
   11   3HE   MET   1          3HE       MET   1 -21.005   7.879  -1.784
   12    H    SER   2           H        SER   2 -15.535   4.444   0.189
   13    HA   SER   2           HA       SER   2 -13.859   4.558   2.676
   14   1HB   SER   2          2HB       SER   2 -13.910   2.508   0.419
   15   2HB   SER   2          3HB       SER   2 -12.892   2.447   1.875
   16    HG   SER   2           HG       SER   2 -15.724   2.453   1.839
   17    H    ILE   3           H        ILE   3 -11.437   3.921   1.659
   18    HA   ILE   3           HA       ILE   3 -10.501   6.384   0.711
   19    HB   ILE   3           HB       ILE   3  -8.363   5.384   0.607
   20   1HG1  ILE   3          2HG1      ILE   3  -8.318   2.729   0.966
   21   2HG1  ILE   3          3HG1      ILE   3  -9.807   2.797   0.035
   22   1HG2  ILE   3          1HG2      ILE   3  -9.887   3.824   2.746
   23   2HG2  ILE   3          2HG2      ILE   3  -8.186   4.228   2.723
   24   3HG2  ILE   3          3HG2      ILE   3  -9.385   5.527   2.870
   25   1HD1  ILE   3          1HD1      ILE   3  -7.014   3.769  -0.733
   26   2HD1  ILE   3          2HD1      ILE   3  -7.987   2.509  -1.523
   27   3HD1  ILE   3          3HD1      ILE   3  -8.441   4.192  -1.688
   28    H    THR   4           H        THR   4 -11.717   3.580  -1.112
   29    HA   THR   4           HA       THR   4 -10.387   4.292  -3.597
   30    HB   THR   4           HB       THR   4 -10.272   1.996  -2.939
   31    HG1  THR   4           1HG      THR   4 -12.472   2.389  -4.575
   32   1HG2  THR   4          1HG2      THR   4 -13.230   2.249  -2.222
   33   2HG2  THR   4          2HG2      THR   4 -12.479   0.690  -2.549
   34   3HG2  THR   4          3HG2      THR   4 -11.891   1.650  -1.202
   35    H    ASP   5           H        ASP   5 -11.854   6.359  -2.991
   36    HA   ASP   5           HA       ASP   5 -14.099   6.581  -4.843
   37   1HB   ASP   5          2HB       ASP   5 -14.543   6.130  -1.876
   38   2HB   ASP   5          3HB       ASP   5 -15.615   7.217  -2.781
   39    H    VAL   6           H        VAL   6 -12.967   7.633  -1.663
   40    HA   VAL   6           HA       VAL   6 -13.653  10.297  -1.617
   41    HB   VAL   6           HB       VAL   6 -11.368   8.702  -0.423
   42   1HG1  VAL   6          1HG1      VAL   6 -10.413  10.940  -0.490
   43   2HG1  VAL   6          2HG1      VAL   6 -11.921  11.638   0.153
   44   3HG1  VAL   6          3HG1      VAL   6 -10.927  10.556   1.154
   45   1HG2  VAL   6          1HG2      VAL   6 -13.755  10.078   0.882
   46   2HG2  VAL   6          2HG2      VAL   6 -13.798   8.408   0.314
   47   3HG2  VAL   6          3HG2      VAL   6 -12.673   8.868   1.604
   48    H    LEU   7           H        LEU   7 -10.825   8.863  -3.104
   49    HA   LEU   7           HA       LEU   7 -10.553  10.909  -5.094
   50   1HB   LEU   7          2HB       LEU   7  -9.463  12.262  -3.507
   51   2HB   LEU   7          3HB       LEU   7  -8.694  10.881  -2.717
   52    HG   LEU   7           HG       LEU   7  -7.075  10.635  -4.468
   53   1HD1  LEU   7          1HD1      LEU   7  -8.377  11.186  -6.490
   54   2HD1  LEU   7          2HD1      LEU   7  -8.469  12.885  -5.980
   55   3HD1  LEU   7          3HD1      LEU   7  -6.906  12.138  -6.398
   56   1HD2  LEU   7          1HD2      LEU   7  -7.361  13.119  -2.975
   57   2HD2  LEU   7          2HD2      LEU   7  -5.903  12.180  -3.370
   58   3HD2  LEU   7          3HD2      LEU   7  -6.489  13.402  -4.487
   59    H    SER   8           H        SER   8  -8.649   8.570  -3.164
   60    HA   SER   8           HA       SER   8  -6.991   7.719  -4.986
   61   1HB   SER   8          2HB       SER   8  -7.701   5.484  -3.293
   62   2HB   SER   8          3HB       SER   8  -6.235   6.463  -3.348
   63    HG   SER   8           HG       SER   8  -8.638   6.941  -1.919
   64    H    ALA   9           H        ALA   9 -10.320   6.919  -5.367
   65    HA   ALA   9           HA       ALA   9 -10.184   4.460  -6.817
   66   1HB   ALA   9          1HB       ALA   9 -12.331   5.455  -6.248
   67   2HB   ALA   9          2HB       ALA   9 -11.949   6.923  -7.170
   68   3HB   ALA   9          3HB       ALA   9 -12.185   5.373  -8.005
   69    H    ASP  10           H        ASP  10  -9.682   7.893  -7.807
   70    HA   ASP  10           HA       ASP  10  -9.296   7.262 -10.601
   71   1HB   ASP  10          2HB       ASP  10  -9.975   9.500  -9.725
   72   2HB   ASP  10          3HB       ASP  10  -8.376   9.680  -8.978
   73    H    ASP  11           H        ASP  11  -7.194   7.624  -7.767
   74    HA   ASP  11           HA       ASP  11  -4.717   7.633  -9.175
   75   1HB   ASP  11          2HB       ASP  11  -5.331   6.947  -6.270
   76   2HB   ASP  11          3HB       ASP  11  -3.760   7.269  -6.986
   77    H    ILE  12           H        ILE  12  -6.517   4.989  -7.398
   78    HA   ILE  12           HA       ILE  12  -4.681   2.997  -8.119
   79    HB   ILE  12           HB       ILE  12  -6.301   1.428  -7.594
   80   1HG1  ILE  12          2HG1      ILE  12  -8.321   3.584  -7.325
   81   2HG1  ILE  12          3HG1      ILE  12  -8.349   2.236  -8.461
   82   1HG2  ILE  12          1HG2      ILE  12  -4.954   2.492  -5.830
   83   2HG2  ILE  12          2HG2      ILE  12  -6.293   3.593  -5.478
   84   3HG2  ILE  12          3HG2      ILE  12  -6.481   1.850  -5.225
   85   1HD1  ILE  12          1HD1      ILE  12  -8.746   2.105  -5.451
   86   2HD1  ILE  12          2HD1      ILE  12  -9.905   1.734  -6.734
   87   3HD1  ILE  12          3HD1      ILE  12  -8.508   0.672  -6.488
   88    H    ALA  13           H        ALA  13  -7.616   4.236  -9.823
   89    HA   ALA  13           HA       ALA  13  -7.559   2.406 -11.956
   90   1HB   ALA  13          1HB       ALA  13  -8.682   4.104 -13.287
   91   2HB   ALA  13          2HB       ALA  13  -9.341   4.075 -11.640
   92   3HB   ALA  13          3HB       ALA  13  -8.233   5.371 -12.136
   93    H    ALA  14           H        ALA  14  -5.696   5.495 -11.648
   94    HA   ALA  14           HA       ALA  14  -4.222   5.178 -14.070
   95   1HB   ALA  14          1HB       ALA  14  -3.350   6.538 -11.480
   96   2HB   ALA  14          2HB       ALA  14  -2.613   6.742 -13.079
   97   3HB   ALA  14          3HB       ALA  14  -4.282   7.279 -12.795
   98    H    ALA  15           H        ALA  15  -3.243   4.358 -10.738
   99    HA   ALA  15           HA       ALA  15  -0.793   3.206 -11.095
  100   1HB   ALA  15          1HB       ALA  15  -2.771   2.003  -9.140
  101   2HB   ALA  15          2HB       ALA  15  -1.059   2.420  -8.914
  102   3HB   ALA  15          3HB       ALA  15  -2.262   3.687  -8.948
  103    H    LEU  16           H        LEU  16  -3.910   1.681 -11.328
  104    HA   LEU  16           HA       LEU  16  -3.171  -1.004 -11.608
  105   1HB   LEU  16          2HB       LEU  16  -5.410  -0.311 -11.054
  106   2HB   LEU  16          3HB       LEU  16  -5.602   0.563 -12.569
  107    HG   LEU  16           HG       LEU  16  -6.872  -1.542 -12.328
  108   1HD1  LEU  16          1HD1      LEU  16  -6.705  -2.268 -14.564
  109   2HD1  LEU  16          2HD1      LEU  16  -6.366  -0.529 -14.554
  110   3HD1  LEU  16          3HD1      LEU  16  -5.046  -1.701 -14.743
  111   1HD2  LEU  16          1HD2      LEU  16  -5.810  -3.711 -12.625
  112   2HD2  LEU  16          2HD2      LEU  16  -4.200  -2.969 -12.639
  113   3HD2  LEU  16          3HD2      LEU  16  -5.196  -2.907 -11.169
  114    H    GLN  17           H        GLN  17  -3.322   1.691 -13.972
  115    HA   GLN  17           HA       GLN  17  -3.093  -0.261 -16.212
  116   1HB   GLN  17          2HB       GLN  17  -4.622   1.624 -16.470
  117   2HB   GLN  17          3HB       GLN  17  -3.288   2.774 -16.274
  118   1HG   GLN  17          2HG       GLN  17  -2.178   1.950 -18.278
  119   2HG   GLN  17          3HG       GLN  17  -3.303   0.592 -18.416
  120   1HE2  GLN  17          1HE2      GLN  17  -5.754   1.365 -18.489
  121   2HE2  GLN  17          2HE2      GLN  17  -6.022   2.670 -19.632
  122    H    GLU  18           H        GLU  18  -1.345   2.465 -14.696
  123    HA   GLU  18           HA       GLU  18   0.802   2.401 -16.513
  124   1HB   GLU  18          2HB       GLU  18   1.732   4.113 -15.210
  125   2HB   GLU  18          3HB       GLU  18  -0.022   4.262 -15.085
  126   1HG   GLU  18          2HG       GLU  18   0.426   4.570 -12.900
  127   2HG   GLU  18          3HG       GLU  18   0.302   2.805 -12.905
  128    H    CYS  19           H        CYS  19   0.340   0.655 -13.434
  129    HA   CYS  19           HA       CYS  19   2.665  -1.108 -14.198
  130   1HB   CYS  19          2HB       CYS  19   1.699  -0.352 -11.458
  131   2HB   CYS  19          3HB       CYS  19   2.812  -1.694 -11.838
  132    HG   CYS  19           HG       CYS  19   3.173   1.529 -12.187
  133    H    ARG  20           H        ARG  20   0.530  -1.802 -15.597
  134    HA   ARG  20           HA       ARG  20  -1.185  -3.573 -14.010
  135   1HB   ARG  20          2HB       ARG  20  -1.730  -2.247 -16.229
  136   2HB   ARG  20          3HB       ARG  20  -1.108  -3.696 -17.017
  137   1HG   ARG  20          2HG       ARG  20  -2.786  -5.077 -15.802
  138   2HG   ARG  20          3HG       ARG  20  -3.243  -3.690 -14.818
  139   1HD   ARG  20          2HD       ARG  20  -4.950  -3.873 -16.348
  140   2HD   ARG  20          3HD       ARG  20  -3.977  -2.500 -16.925
  141    HE   ARG  20           HE       ARG  20  -2.985  -4.796 -18.208
  142   1HH1  ARG  20          2HH2      ARG  20  -5.962  -2.931 -18.105
  143   2HH1  ARG  20          1HH2      ARG  20  -6.596  -3.500 -19.619
  144   1HH2  ARG  20          2HH1      ARG  20  -3.795  -5.632 -20.224
  145   2HH2  ARG  20          1HH1      ARG  20  -5.310  -5.080 -20.862
  146    H    ASP  21           H        ASP  21   1.965  -3.919 -14.967
  147    HA   ASP  21           HA       ASP  21   1.694  -6.715 -15.885
  148   1HB   ASP  21          2HB       ASP  21   3.466  -4.380 -16.545
  149   2HB   ASP  21          3HB       ASP  21   4.103  -6.016 -16.780
  150    HA   PRO  22           HA       PRO  22   3.413  -8.531 -12.490
  151   1HB   PRO  22          2HB       PRO  22   5.067 -10.538 -13.430
  152   2HB   PRO  22          3HB       PRO  22   3.283 -10.562 -13.530
  153   1HG   PRO  22          2HG       PRO  22   5.241  -9.675 -15.664
  154   2HG   PRO  22          3HG       PRO  22   3.866 -10.805 -15.845
  155   1HD   PRO  22          2HD       PRO  22   3.611  -8.220 -16.546
  156   2HD   PRO  22          3HD       PRO  22   2.285  -9.018 -15.656
  157    H    ASP  23           H        ASP  23   4.781  -7.700 -11.068
  158    HA   ASP  23           HA       ASP  23   6.557  -7.029 -10.004
  159   1HB   ASP  23          2HB       ASP  23   7.402  -9.253 -11.370
  160   2HB   ASP  23          3HB       ASP  23   8.598  -8.085 -11.927
  161    H    THR  24           H        THR  24   5.503  -5.479 -12.460
  162    HA   THR  24           HA       THR  24   7.675  -3.701 -13.158
  163    HB   THR  24           HB       THR  24   4.665  -3.431 -13.515
  164    HG1  THR  24           1HG      THR  24   5.188  -4.403 -15.542
  165   1HG2  THR  24          1HG2      THR  24   6.994  -2.169 -15.028
  166   2HG2  THR  24          2HG2      THR  24   5.305  -2.148 -15.570
  167   3HG2  THR  24          3HG2      THR  24   5.755  -1.314 -14.084
  168    H    PHE  25           H        PHE  25   5.689  -3.969 -10.380
  169    HA   PHE  25           HA       PHE  25   5.010  -1.166 -10.301
  170   1HB   PHE  25          2HB       PHE  25   3.664  -3.432  -9.849
  171   2HB   PHE  25          3HB       PHE  25   4.125  -3.124  -8.205
  172    HD1  PHE  25           1HD      PHE  25   1.366  -3.343  -9.395
  173    HD2  PHE  25           2HD      PHE  25   3.813   0.160  -8.893
  174    HE1  PHE  25           1HE      PHE  25  -0.663  -1.989  -9.162
  175    HE2  PHE  25           2HE      PHE  25   1.770   1.544  -8.947
  176    HZ   PHE  25           HZ       PHE  25  -0.483   0.436  -8.900
  177    H    GLU  26           H        GLU  26   6.733   0.107  -9.500
  178    HA   GLU  26           HA       GLU  26   8.390  -0.804  -7.295
  179   1HB   GLU  26          2HB       GLU  26   8.484   1.370  -9.302
  180   2HB   GLU  26          3HB       GLU  26   8.796   1.975  -7.686
  181   1HG   GLU  26          2HG       GLU  26  10.474  -0.143  -7.604
  182   2HG   GLU  26          3HG       GLU  26  10.447   0.144  -9.346
  183    HA   PRO  27           HA       PRO  27   6.027   0.880  -4.066
  184   1HB   PRO  27          2HB       PRO  27   7.867   1.676  -2.151
  185   2HB   PRO  27          3HB       PRO  27   7.486  -0.019  -2.532
  186   1HG   PRO  27          2HG       PRO  27   9.860   1.573  -3.476
  187   2HG   PRO  27          3HG       PRO  27   9.770  -0.147  -3.006
  188   1HD   PRO  27          2HD       PRO  27   9.771   0.717  -5.609
  189   2HD   PRO  27          3HD       PRO  27   9.006  -0.805  -5.067
  190    H    GLN  28           H        GLN  28   8.859   3.147  -4.341
  191    HA   GLN  28           HA       GLN  28   7.403   5.443  -3.526
  192   1HB   GLN  28          2HB       GLN  28   9.962   5.103  -5.125
  193   2HB   GLN  28          3HB       GLN  28   9.293   6.692  -4.707
  194   1HG   GLN  28          2HG       GLN  28   9.338   6.164  -2.326
  195   2HG   GLN  28          3HG       GLN  28   9.922   4.526  -2.654
  196   1HE2  GLN  28          1HE2      GLN  28  10.806   8.001  -3.220
  197   2HE2  GLN  28          2HE2      GLN  28  12.529   7.708  -3.073
  198    H    LYS  29           H        LYS  29   7.933   4.022  -6.737
  199    HA   LYS  29           HA       LYS  29   6.611   5.979  -8.295
  200   1HB   LYS  29          2HB       LYS  29   7.867   4.147  -9.311
  201   2HB   LYS  29          3HB       LYS  29   6.792   2.957  -8.574
  202   1HG   LYS  29          2HG       LYS  29   6.290   3.166 -10.899
  203   2HG   LYS  29          3HG       LYS  29   4.916   3.657  -9.952
  204   1HD   LYS  29          2HD       LYS  29   6.618   6.012 -10.595
  205   2HD   LYS  29          3HD       LYS  29   6.328   5.030 -12.021
  206   1HE   LYS  29          2HE       LYS  29   4.467   6.316 -12.229
  207   2HE   LYS  29          3HE       LYS  29   3.809   5.034 -11.219
  208   1HZ   LYS  29          1HZ       LYS  29   4.195   6.426  -9.293
  209   2HZ   LYS  29          2HZ       LYS  29   4.591   7.682 -10.296
  210   3HZ   LYS  29          3HZ       LYS  29   3.092   6.971 -10.370
  211    H    PHE  30           H        PHE  30   5.259   2.922  -6.917
  212    HA   PHE  30           HA       PHE  30   2.628   3.331  -7.667
  213   1HB   PHE  30          2HB       PHE  30   3.559   1.213  -6.814
  214   2HB   PHE  30          3HB       PHE  30   3.728   1.900  -5.208
  215    HD1  PHE  30           1HD      PHE  30   2.607  -0.393  -4.824
  216    HD2  PHE  30           2HD      PHE  30   0.569   2.817  -6.851
  217    HE1  PHE  30           1HE      PHE  30   0.427  -1.466  -4.365
  218    HE2  PHE  30           2HE      PHE  30  -1.592   1.777  -6.336
  219    HZ   PHE  30           HZ       PHE  30  -1.663  -0.380  -5.135
  220    H    PHE  31           H        PHE  31   4.113   4.039  -4.551
  221    HA   PHE  31           HA       PHE  31   2.285   5.101  -2.919
  222   1HB   PHE  31          2HB       PHE  31   4.534   4.896  -2.239
  223   2HB   PHE  31          3HB       PHE  31   5.125   5.793  -3.625
  224    HD1  PHE  31           1HD      PHE  31   6.275   7.717  -2.971
  225    HD2  PHE  31           2HD      PHE  31   2.581   6.617  -1.025
  226    HE1  PHE  31           1HE      PHE  31   6.323   9.820  -1.669
  227    HE2  PHE  31           2HE      PHE  31   2.503   8.850   0.014
  228    HZ   PHE  31           HZ       PHE  31   4.482  10.293  -0.031
  229    H    GLN  32           H        GLN  32   4.098   7.276  -5.184
  230    HA   GLN  32           HA       GLN  32   2.340   9.503  -4.715
  231   1HB   GLN  32          2HB       GLN  32   4.476   8.820  -6.748
  232   2HB   GLN  32          3HB       GLN  32   3.375  10.170  -7.078
  233   1HG   GLN  32          2HG       GLN  32   3.956  11.281  -5.020
  234   2HG   GLN  32          3HG       GLN  32   4.942   9.906  -4.490
  235   1HE2  GLN  32          1HE2      GLN  32   4.653  12.057  -7.415
  236   2HE2  GLN  32          2HE2      GLN  32   6.390  12.266  -7.577
  237    H    THR  33           H        THR  33   2.451   6.957  -7.207
  238    HA   THR  33           HA       THR  33   0.429   8.058  -8.843
  239    HB   THR  33           HB       THR  33   2.082   5.628  -8.698
  240    HG1  THR  33           1HG      THR  33   0.517   6.691 -10.733
  241   1HG2  THR  33          1HG2      THR  33   0.797   4.100  -9.899
  242   2HG2  THR  33          2HG2      THR  33   0.013   4.399  -8.345
  243   3HG2  THR  33          3HG2      THR  33  -0.651   5.145  -9.825
  244    H    SER  34           H        SER  34   0.247   6.135  -5.945
  245    HA   SER  34           HA       SER  34  -2.561   5.440  -6.269
  246   1HB   SER  34          2HB       SER  34  -0.922   3.945  -5.153
  247   2HB   SER  34          3HB       SER  34  -0.689   5.150  -3.889
  248    HG   SER  34           HG       SER  34  -3.121   4.978  -3.717
  249    H    GLY  35           H        GLY  35  -0.864   8.254  -5.434
  250   1HA   GLY  35          1HA       GLY  35  -1.809  10.310  -4.908
  251   2HA   GLY  35          2HA       GLY  35  -3.355   9.531  -4.529
  252    H    LEU  36           H        LEU  36  -0.905   7.822  -2.986
  253    HA   LEU  36           HA       LEU  36  -2.003   8.502  -0.450
  254   1HB   LEU  36          2HB       LEU  36   0.391   6.857  -1.298
  255   2HB   LEU  36          3HB       LEU  36  -0.279   6.892   0.331
  256    HG   LEU  36           HG       LEU  36  -1.825   5.953  -2.083
  257   1HD1  LEU  36          1HD1      LEU  36  -0.484   4.377   0.159
  258   2HD1  LEU  36          2HD1      LEU  36  -1.455   3.698  -1.167
  259   3HD1  LEU  36          3HD1      LEU  36   0.098   4.474  -1.517
  260   1HD2  LEU  36          1HD2      LEU  36  -3.375   6.731  -0.405
  261   2HD2  LEU  36          2HD2      LEU  36  -3.334   4.972  -0.326
  262   3HD2  LEU  36          3HD2      LEU  36  -2.462   5.926   0.892
  263    H    SER  37           H        SER  37   0.620   9.835  -2.280
  264    HA   SER  37           HA       SER  37   2.011  11.158  -0.052
  265   1HB   SER  37          2HB       SER  37   2.999  10.630  -2.390
  266   2HB   SER  37          3HB       SER  37   1.960  11.910  -3.003
  267    HG   SER  37           HG       SER  37   4.154  12.189  -1.181
  268    H    LYS  38           H        LYS  38  -0.913  11.682  -1.911
  269    HA   LYS  38           HA       LYS  38  -1.030  14.572  -1.325
  270   1HB   LYS  38          2HB       LYS  38  -2.013  12.892  -3.442
  271   2HB   LYS  38          3HB       LYS  38  -3.422  13.454  -2.540
  272   1HG   LYS  38          2HG       LYS  38  -2.568  15.806  -2.756
  273   2HG   LYS  38          3HG       LYS  38  -1.207  15.181  -3.718
  274   1HD   LYS  38          2HD       LYS  38  -2.905  14.156  -5.303
  275   2HD   LYS  38          3HD       LYS  38  -4.182  14.975  -4.381
  276   1HE   LYS  38          2HE       LYS  38  -3.096  17.186  -4.893
  277   2HE   LYS  38          3HE       LYS  38  -1.852  16.339  -5.831
  278   1HZ   LYS  38          1HZ       LYS  38  -3.601  15.549  -7.296
  279   2HZ   LYS  38          2HZ       LYS  38  -4.734  16.386  -6.447
  280   3HZ   LYS  38          3HZ       LYS  38  -3.550  17.192  -7.254
  281    H    MET  39           H        MET  39  -2.487  11.380  -0.500
  282    HA   MET  39           HA       MET  39  -4.543  12.350   1.168
  283   1HB   MET  39          2HB       MET  39  -2.804   9.877   1.162
  284   2HB   MET  39          3HB       MET  39  -4.013  10.105   2.397
  285   1HG   MET  39          2HG       MET  39  -4.507   8.739   0.212
  286   2HG   MET  39          3HG       MET  39  -5.763   9.639   1.039
  287   1HE   MET  39          1HE       MET  39  -6.573  11.764   0.536
  288   2HE   MET  39          2HE       MET  39  -6.016  12.802  -0.802
  289   3HE   MET  39          3HE       MET  39  -7.387  11.691  -1.021
  290    H    SER  40           H        SER  40  -4.631  13.327   3.060
  291    HA   SER  40           HA       SER  40  -2.261  14.332   4.357
  292   1HB   SER  40          2HB       SER  40  -4.391  15.533   4.473
  293   2HB   SER  40          3HB       SER  40  -5.180  14.137   5.229
  294    HG   SER  40           HG       SER  40  -3.214  15.851   6.328
  295    H    ALA  41           H        ALA  41  -1.473  13.757   6.460
  296    HA   ALA  41           HA       ALA  41  -0.916  11.174   7.155
  297   1HB   ALA  41          1HB       ALA  41   0.075  13.116   8.271
  298   2HB   ALA  41          2HB       ALA  41  -1.481  13.497   9.048
  299   3HB   ALA  41          3HB       ALA  41  -0.618  12.005   9.471
  300    H    ASN  42           H        ASN  42  -3.799  13.016   8.088
  301    HA   ASN  42           HA       ASN  42  -5.205  11.253   9.739
  302   1HB   ASN  42          2HB       ASN  42  -6.311  12.988   7.465
  303   2HB   ASN  42          3HB       ASN  42  -7.246  12.282   8.785
  304   1HD2  ASN  42          1HD2      ASN  42  -4.974  14.889   7.872
  305   2HD2  ASN  42          2HD2      ASN  42  -5.135  15.712   9.408
  306    H    GLN  43           H        GLN  43  -5.410  11.437   6.167
  307    HA   GLN  43           HA       GLN  43  -7.150   9.132   5.924
  308   1HB   GLN  43          2HB       GLN  43  -5.708  10.987   4.038
  309   2HB   GLN  43          3HB       GLN  43  -6.445   9.494   3.430
  310   1HG   GLN  43          2HG       GLN  43  -8.607  10.071   4.062
  311   2HG   GLN  43          3HG       GLN  43  -8.084  11.300   5.222
  312   1HE2  GLN  43          1HE2      GLN  43 -10.054  11.595   3.061
  313   2HE2  GLN  43          2HE2      GLN  43  -9.442  12.901   2.066
  314    H    VAL  44           H        VAL  44  -3.573   9.692   5.599
  315    HA   VAL  44           HA       VAL  44  -3.033   7.116   4.499
  316    HB   VAL  44           HB       VAL  44  -1.421   9.081   6.205
  317   1HG1  VAL  44          1HG1      VAL  44  -0.303   6.931   6.369
  318   2HG1  VAL  44          2HG1      VAL  44  -0.477   6.688   4.615
  319   3HG1  VAL  44          3HG1      VAL  44   0.574   7.982   5.242
  320   1HG2  VAL  44          1HG2      VAL  44  -0.479   9.818   4.071
  321   2HG2  VAL  44          2HG2      VAL  44  -1.424   8.590   3.191
  322   3HG2  VAL  44          3HG2      VAL  44  -2.227   9.943   3.979
  323    H    LYS  45           H        LYS  45  -3.158   8.304   7.885
  324    HA   LYS  45           HA       LYS  45  -2.479   5.812   9.075
  325   1HB   LYS  45          2HB       LYS  45  -2.476   8.193   9.997
  326   2HB   LYS  45          3HB       LYS  45  -4.190   7.986  10.347
  327   1HG   LYS  45          2HG       LYS  45  -3.730   6.655  12.171
  328   2HG   LYS  45          3HG       LYS  45  -2.448   5.761  11.331
  329   1HD   LYS  45          2HD       LYS  45  -0.912   7.657  11.540
  330   2HD   LYS  45          3HD       LYS  45  -2.156   8.614  12.368
  331   1HE   LYS  45          2HE       LYS  45  -2.124   7.064  14.273
  332   2HE   LYS  45          3HE       LYS  45  -1.025   5.971  13.412
  333   1HZ   LYS  45          1HZ       LYS  45   0.174   7.343  14.952
  334   2HZ   LYS  45          2HZ       LYS  45   0.629   7.717  13.414
  335   3HZ   LYS  45          3HZ       LYS  45  -0.373   8.721  14.242
  336    H    ASP  46           H        ASP  46  -5.570   7.301   8.070
  337    HA   ASP  46           HA       ASP  46  -7.277   5.273   9.037
  338   1HB   ASP  46          2HB       ASP  46  -7.849   7.606   8.082
  339   2HB   ASP  46          3HB       ASP  46  -7.797   6.832   6.486
  340    H    VAL  47           H        VAL  47  -5.770   5.591   5.750
  341    HA   VAL  47           HA       VAL  47  -6.845   3.219   4.748
  342    HB   VAL  47           HB       VAL  47  -5.575   3.302   2.926
  343   1HG1  VAL  47          1HG1      VAL  47  -5.917   5.321   2.040
  344   2HG1  VAL  47          2HG1      VAL  47  -6.720   5.658   3.586
  345   3HG1  VAL  47          3HG1      VAL  47  -5.046   6.176   3.305
  346   1HG2  VAL  47          1HG2      VAL  47  -3.321   3.043   3.764
  347   2HG2  VAL  47          2HG2      VAL  47  -3.440   4.271   2.503
  348   3HG2  VAL  47          3HG2      VAL  47  -3.287   4.773   4.187
  349    H    PHE  48           H        PHE  48  -3.749   3.786   6.397
  350    HA   PHE  48           HA       PHE  48  -2.640   1.233   6.645
  351   1HB   PHE  48          2HB       PHE  48  -1.473   3.058   7.421
  352   2HB   PHE  48          3HB       PHE  48  -2.760   3.605   8.454
  353    HD1  PHE  48           1HD      PHE  48  -0.031   1.116   8.122
  354    HD2  PHE  48           2HD      PHE  48  -3.067   2.794  10.661
  355    HE1  PHE  48           1HE      PHE  48   0.850  -0.175  10.063
  356    HE2  PHE  48           2HE      PHE  48  -2.409   1.232  12.491
  357    HZ   PHE  48           HZ       PHE  48  -0.445  -0.258  12.167
  358    H    ARG  49           H        ARG  49  -5.113   2.608   8.954
  359    HA   ARG  49           HA       ARG  49  -5.460   0.051  10.238
  360   1HB   ARG  49          2HB       ARG  49  -7.063   2.615  10.280
  361   2HB   ARG  49          3HB       ARG  49  -7.656   1.142  11.068
  362   1HG   ARG  49          2HG       ARG  49  -5.585   0.952  12.405
  363   2HG   ARG  49          3HG       ARG  49  -4.951   2.391  11.600
  364   1HD   ARG  49          2HD       ARG  49  -5.708   3.115  13.693
  365   2HD   ARG  49          3HD       ARG  49  -6.874   3.711  12.484
  366    HE   ARG  49           HE       ARG  49  -7.755   1.177  13.539
  367   1HH1  ARG  49          2HH2      ARG  49  -7.391   4.548  14.475
  368   2HH1  ARG  49          1HH2      ARG  49  -8.568   4.501  15.753
  369   1HH2  ARG  49          2HH1      ARG  49  -9.267   1.037  15.216
  370   2HH2  ARG  49          1HH1      ARG  49  -9.731   2.437  16.155
  371    H    PHE  50           H        PHE  50  -7.136   1.506   7.449
  372    HA   PHE  50           HA       PHE  50  -9.291  -0.363   7.290
  373   1HB   PHE  50          2HB       PHE  50  -7.952   1.512   5.432
  374   2HB   PHE  50          3HB       PHE  50  -8.587   0.097   4.642
  375    HD1  PHE  50           1HD      PHE  50 -10.988  -0.357   4.512
  376    HD2  PHE  50           2HD      PHE  50  -9.483   3.204   6.449
  377    HE1  PHE  50           1HE      PHE  50 -13.184   0.759   4.197
  378    HE2  PHE  50           2HE      PHE  50 -11.676   4.281   6.158
  379    HZ   PHE  50           HZ       PHE  50 -13.528   3.080   5.010
  380    H    ILE  51           H        ILE  51  -5.904  -0.533   6.051
  381    HA   ILE  51           HA       ILE  51  -6.370  -3.210   5.038
  382    HB   ILE  51           HB       ILE  51  -3.829  -1.643   5.356
  383   1HG1  ILE  51          2HG1      ILE  51  -4.009  -2.371   2.748
  384   2HG1  ILE  51          3HG1      ILE  51  -5.718  -2.433   3.085
  385   1HG2  ILE  51          1HG2      ILE  51  -2.778  -3.613   4.129
  386   2HG2  ILE  51          2HG2      ILE  51  -3.253  -3.954   5.786
  387   3HG2  ILE  51          3HG2      ILE  51  -4.261  -4.527   4.431
  388   1HD1  ILE  51          1HD1      ILE  51  -5.772  -0.100   3.568
  389   2HD1  ILE  51          2HD1      ILE  51  -3.994  -0.006   3.759
  390   3HD1  ILE  51          3HD1      ILE  51  -4.694  -0.285   2.165
  391    H    ASP  52           H        ASP  52  -4.808  -1.998   8.033
  392    HA   ASP  52           HA       ASP  52  -4.184  -4.654   8.952
  393   1HB   ASP  52          2HB       ASP  52  -2.991  -2.545   9.650
  394   2HB   ASP  52          3HB       ASP  52  -4.400  -2.122  10.623
  395    H    ASN  53           H        ASN  53  -6.354  -5.424   8.365
  396    HA   ASN  53           HA       ASN  53  -8.786  -4.879   9.636
  397   1HB   ASN  53          2HB       ASN  53  -8.620  -6.225   7.648
  398   2HB   ASN  53          3HB       ASN  53  -7.612  -7.434   8.461
  399   1HD2  ASN  53          1HD2      ASN  53  -8.652  -9.216   9.332
  400   2HD2  ASN  53          2HD2      ASN  53 -10.387  -9.297   9.563
  401    H    ASP  54           H        ASP  54  -6.114  -7.043  10.632
  402    HA   ASP  54           HA       ASP  54  -7.460  -8.152  12.929
  403   1HB   ASP  54          2HB       ASP  54  -5.146  -8.948  13.438
  404   2HB   ASP  54          3HB       ASP  54  -5.731  -9.401  11.832
  405    H    GLN  55           H        GLN  55  -6.089  -5.046  12.278
  406    HA   GLN  55           HA       GLN  55  -5.368  -3.339  13.533
  407   1HB   GLN  55          2HB       GLN  55  -7.809  -4.379  14.910
  408   2HB   GLN  55          3HB       GLN  55  -6.871  -3.148  15.767
  409   1HG   GLN  55          2HG       GLN  55  -6.893  -1.694  13.757
  410   2HG   GLN  55          3HG       GLN  55  -7.965  -2.848  12.945
  411   1HE2  GLN  55          1HE2      GLN  55  -9.774  -3.524  14.930
  412   2HE2  GLN  55          2HE2      GLN  55 -10.638  -2.100  15.471
  413    H    SER  56           H        SER  56  -3.427  -4.786  13.603
  414    HA   SER  56           HA       SER  56  -2.660  -5.600  16.375
  415   1HB   SER  56          2HB       SER  56  -0.742  -6.646  15.324
  416   2HB   SER  56          3HB       SER  56  -2.240  -7.208  14.580
  417    HG   SER  56           HG       SER  56  -0.208  -5.573  13.565
  418    H    GLY  57           H        GLY  57  -2.387  -3.055  14.004
  419   1HA   GLY  57          1HA       GLY  57  -1.369  -0.985  14.225
  420   2HA   GLY  57          2HA       GLY  57  -0.498  -1.501  15.676
  421    H    TYR  58           H        TYR  58  -0.577  -3.618  12.865
  422    HA   TYR  58           HA       TYR  58   2.015  -2.733  11.810
  423   1HB   TYR  58          2HB       TYR  58   1.682  -5.455  13.120
  424   2HB   TYR  58          3HB       TYR  58   2.924  -5.063  11.949
  425    HD1  TYR  58           HD1      TYR  58   4.768  -3.542  12.455
  426    HD2  TYR  58           HD2      TYR  58   1.800  -4.527  15.421
  427    HE1  TYR  58           HE1      TYR  58   6.196  -2.540  14.220
  428    HE2  TYR  58           HE2      TYR  58   3.216  -3.520  17.178
  429    HH   TYR  58           HH       TYR  58   5.172  -2.382  17.636
  430    H    LEU  59           H        LEU  59   2.088  -2.930   9.767
  431    HA   LEU  59           HA       LEU  59   0.223  -4.648   8.203
  432   1HB   LEU  59          2HB       LEU  59   2.300  -2.530   7.610
  433   2HB   LEU  59          3HB       LEU  59   1.896  -3.716   6.376
  434    HG   LEU  59           HG       LEU  59   0.697  -1.375   6.479
  435   1HD1  LEU  59          1HD1      LEU  59   0.245  -3.086   4.794
  436   2HD1  LEU  59          2HD1      LEU  59  -0.801  -3.957   5.938
  437   3HD1  LEU  59          3HD1      LEU  59  -1.255  -2.335   5.357
  438   1HD2  LEU  59          1HD2      LEU  59  -1.416  -1.308   7.616
  439   2HD2  LEU  59          2HD2      LEU  59  -1.271  -2.987   8.157
  440   3HD2  LEU  59          3HD2      LEU  59  -0.204  -1.750   8.826
  441    H    ASP  60           H        ASP  60   0.823  -6.428   9.375
  442    HA   ASP  60           HA       ASP  60   3.494  -7.604   9.206
  443   1HB   ASP  60          2HB       ASP  60   0.873  -9.082   9.609
  444   2HB   ASP  60          3HB       ASP  60   2.490  -9.553  10.133
  445    H    GLU  61           H        GLU  61   3.747  -9.736   7.824
  446    HA   GLU  61           HA       GLU  61   3.665  -8.999   5.226
  447   1HB   GLU  61          2HB       GLU  61   4.823 -11.090   6.610
  448   2HB   GLU  61          3HB       GLU  61   3.546 -11.954   5.748
  449   1HG   GLU  61          2HG       GLU  61   4.487 -10.405   3.754
  450   2HG   GLU  61          3HG       GLU  61   5.967 -10.509   4.706
  451    H    GLU  62           H        GLU  62   1.259 -11.070   6.852
  452    HA   GLU  62           HA       GLU  62   0.032 -11.936   4.499
  453   1HB   GLU  62          2HB       GLU  62  -2.023 -11.970   6.404
  454   2HB   GLU  62          3HB       GLU  62  -0.961 -13.286   5.882
  455   1HG   GLU  62          2HG       GLU  62   0.648 -12.731   7.617
  456   2HG   GLU  62          3HG       GLU  62  -0.402 -11.380   8.156
  457    H    GLU  63           H        GLU  63  -0.818  -9.067   6.528
  458    HA   GLU  63           HA       GLU  63  -2.940  -8.136   5.038
  459   1HB   GLU  63          2HB       GLU  63  -0.657  -6.467   6.176
  460   2HB   GLU  63          3HB       GLU  63  -2.208  -5.862   5.575
  461   1HG   GLU  63          2HG       GLU  63  -2.636  -5.988   7.833
  462   2HG   GLU  63          3HG       GLU  63  -3.289  -7.542   7.295
  463    H    LEU  64           H        LEU  64   0.471  -8.075   4.029
  464    HA   LEU  64           HA       LEU  64  -0.050  -6.319   1.759
  465   1HB   LEU  64          2HB       LEU  64   2.235  -8.259   2.069
  466   2HB   LEU  64          3HB       LEU  64   2.142  -6.819   1.041
  467    HG   LEU  64           HG       LEU  64   2.228  -6.888   4.093
  468   1HD1  LEU  64          1HD1      LEU  64   4.198  -5.617   2.186
  469   2HD1  LEU  64          2HD1      LEU  64   4.358  -6.006   3.916
  470   3HD1  LEU  64          3HD1      LEU  64   4.338  -7.314   2.715
  471   1HD2  LEU  64          1HD2      LEU  64   2.408  -4.391   3.914
  472   2HD2  LEU  64          2HD2      LEU  64   1.981  -4.504   2.194
  473   3HD2  LEU  64          3HD2      LEU  64   0.813  -4.991   3.443
  474    H    LYS  65           H        LYS  65  -0.358  -9.743   2.464
  475    HA   LYS  65           HA       LYS  65  -0.782 -10.556  -0.283
  476   1HB   LYS  65          2HB       LYS  65  -0.080 -11.998   1.783
  477   2HB   LYS  65          3HB       LYS  65  -1.822 -12.007   2.137
  478   1HG   LYS  65          2HG       LYS  65  -2.272 -13.019  -0.078
  479   2HG   LYS  65          3HG       LYS  65  -0.547 -12.953  -0.456
  480   1HD   LYS  65          2HD       LYS  65  -1.245 -15.194   0.259
  481   2HD   LYS  65          3HD       LYS  65  -0.029 -14.510   1.353
  482   1HE   LYS  65          2HE       LYS  65  -1.695 -14.011   3.051
  483   2HE   LYS  65          3HE       LYS  65  -3.030 -14.350   1.931
  484   1HZ   LYS  65          1HZ       LYS  65  -2.378 -16.649   1.962
  485   2HZ   LYS  65          2HZ       LYS  65  -1.099 -16.325   2.954
  486   3HZ   LYS  65          3HZ       LYS  65  -2.634 -16.115   3.498
  487    H    PHE  66           H        PHE  66  -2.621  -8.537   1.821
  488    HA   PHE  66           HA       PHE  66  -4.632  -8.681  -0.268
  489   1HB   PHE  66          2HB       PHE  66  -6.545  -8.642   1.416
  490   2HB   PHE  66          3HB       PHE  66  -5.712 -10.153   1.161
  491    HD1  PHE  66           1HD      PHE  66  -4.769 -11.366   2.956
  492    HD2  PHE  66           2HD      PHE  66  -5.709  -7.215   3.592
  493    HE1  PHE  66           1HE      PHE  66  -4.500 -11.660   5.400
  494    HE2  PHE  66           2HE      PHE  66  -5.466  -7.536   6.024
  495    HZ   PHE  66           HZ       PHE  66  -4.883  -9.756   6.934
  496    H    PHE  67           H        PHE  67  -2.813  -6.628  -0.114
  497    HA   PHE  67           HA       PHE  67  -3.659  -4.541   1.717
  498   1HB   PHE  67          2HB       PHE  67  -1.398  -4.668   1.298
  499   2HB   PHE  67          3HB       PHE  67  -1.567  -4.813  -0.434
  500    HD1  PHE  67           1HD      PHE  67  -1.841  -2.409   2.427
  501    HD2  PHE  67           2HD      PHE  67  -1.075  -2.968  -1.761
  502    HE1  PHE  67           1HE      PHE  67  -1.394   0.011   2.204
  503    HE2  PHE  67           2HE      PHE  67  -0.416  -0.580  -1.946
  504    HZ   PHE  67           HZ       PHE  67  -0.641   0.931   0.010
  505    H    LEU  68           H        LEU  68  -3.522  -4.511  -1.861
  506    HA   LEU  68           HA       LEU  68  -5.626  -2.474  -2.059
  507   1HB   LEU  68          2HB       LEU  68  -3.711  -3.795  -3.901
  508   2HB   LEU  68          3HB       LEU  68  -5.330  -3.596  -4.576
  509    HG   LEU  68           HG       LEU  68  -5.293  -1.211  -4.056
  510   1HD1  LEU  68          1HD1      LEU  68  -2.373  -1.719  -3.357
  511   2HD1  LEU  68          2HD1      LEU  68  -3.168  -0.126  -3.416
  512   3HD1  LEU  68          3HD1      LEU  68  -3.622  -1.293  -2.172
  513   1HD2  LEU  68          1HD2      LEU  68  -2.999  -2.208  -5.776
  514   2HD2  LEU  68          2HD2      LEU  68  -4.698  -2.089  -6.265
  515   3HD2  LEU  68          3HD2      LEU  68  -3.798  -0.616  -5.892
  516    H    GLN  69           H        GLN  69  -5.682  -5.853  -1.575
  517    HA   GLN  69           HA       GLN  69  -7.843  -6.577  -3.168
  518   1HB   GLN  69          2HB       GLN  69  -6.388  -7.834  -1.123
  519   2HB   GLN  69          3HB       GLN  69  -8.008  -7.809  -0.489
  520   1HG   GLN  69          2HG       GLN  69  -8.416  -9.646  -1.669
  521   2HG   GLN  69          3HG       GLN  69  -8.380  -8.682  -3.145
  522   1HE2  GLN  69          1HE2      GLN  69  -6.895  -9.420  -4.710
  523   2HE2  GLN  69          2HE2      GLN  69  -5.516 -10.402  -4.294
  524    H    LYS  70           H        LYS  70  -7.749  -4.608  -0.326
  525    HA   LYS  70           HA       LYS  70 -10.674  -4.650   0.112
  526   1HB   LYS  70          2HB       LYS  70  -8.928  -2.812   1.660
  527   2HB   LYS  70          3HB       LYS  70 -10.271  -3.833   2.181
  528   1HG   LYS  70          2HG       LYS  70  -8.641  -5.842   1.923
  529   2HG   LYS  70          3HG       LYS  70  -7.382  -4.625   1.640
  530   1HD   LYS  70          2HD       LYS  70  -7.063  -4.838   3.834
  531   2HD   LYS  70          3HD       LYS  70  -8.260  -3.531   3.841
  532   1HE   LYS  70          2HE       LYS  70  -9.174  -4.885   5.460
  533   2HE   LYS  70          3HE       LYS  70  -9.994  -5.557   4.045
  534   1HZ   LYS  70          1HZ       LYS  70  -8.192  -7.244   3.995
  535   2HZ   LYS  70          2HZ       LYS  70  -7.567  -6.594   5.369
  536   3HZ   LYS  70          3HZ       LYS  70  -9.056  -7.290   5.396
  537    H    PHE  71           H        PHE  71  -8.330  -2.898  -1.718
  538    HA   PHE  71           HA       PHE  71  -9.852  -0.354  -1.768
  539   1HB   PHE  71          2HB       PHE  71  -7.398  -1.290  -3.311
  540   2HB   PHE  71          3HB       PHE  71  -8.191   0.262  -3.494
  541    HD1  PHE  71           1HD      PHE  71  -5.667   0.855  -3.254
  542    HD2  PHE  71           2HD      PHE  71  -8.204  -0.396   0.016
  543    HE1  PHE  71           1HE      PHE  71  -4.134   1.927  -1.653
  544    HE2  PHE  71           2HE      PHE  71  -6.752   0.816   1.577
  545    HZ   PHE  71           HZ       PHE  71  -4.676   1.934   0.772
  546    H    GLU  72           H        GLU  72  -8.635  -2.735  -4.166
  547    HA   GLU  72           HA       GLU  72 -10.900  -1.993  -5.972
  548   1HB   GLU  72          2HB       GLU  72  -8.563  -1.716  -6.785
  549   2HB   GLU  72          3HB       GLU  72  -8.280  -3.447  -6.548
  550   1HG   GLU  72          2HG       GLU  72  -8.752  -3.019  -8.886
  551   2HG   GLU  72          3HG       GLU  72 -10.114  -3.923  -8.213
  552    H    SER  73           H        SER  73  -9.082  -4.781  -4.699
  553    HA   SER  73           HA       SER  73  -9.708  -6.862  -4.170
  554   1HB   SER  73          2HB       SER  73 -12.211  -5.783  -3.967
  555   2HB   SER  73          3HB       SER  73 -12.445  -6.994  -5.241
  556    HG   SER  73           HG       SER  73 -11.276  -7.277  -2.651
  557    H    GLY  74           H        GLY  74  -8.558  -8.112  -5.289
  558   1HA   GLY  74          1HA       GLY  74  -8.064  -9.662  -7.005
  559   2HA   GLY  74          2HA       GLY  74  -9.198  -8.861  -8.100
  560    H    ALA  75           H        ALA  75  -6.769  -7.203  -6.112
  561    HA   ALA  75           HA       ALA  75  -5.287  -6.237  -8.487
  562   1HB   ALA  75          1HB       ALA  75  -4.200  -4.774  -6.793
  563   2HB   ALA  75          2HB       ALA  75  -5.962  -4.638  -6.761
  564   3HB   ALA  75          3HB       ALA  75  -5.142  -5.609  -5.526
  565    H    ARG  76           H        ARG  76  -2.763  -6.137  -6.788
  566    HA   ARG  76           HA       ARG  76  -1.909  -8.615  -8.095
  567   1HB   ARG  76          2HB       ARG  76  -0.889  -6.134  -8.302
  568   2HB   ARG  76          3HB       ARG  76  -0.038  -6.634  -6.839
  569   1HG   ARG  76          2HG       ARG  76   1.453  -7.626  -8.236
  570   2HG   ARG  76          3HG       ARG  76   0.269  -8.885  -8.407
  571   1HD   ARG  76          2HD       ARG  76   0.461  -8.459 -10.614
  572   2HD   ARG  76          3HD       ARG  76  -0.809  -7.309 -10.282
  573    HE   ARG  76           HE       ARG  76   2.101  -6.524 -10.128
  574   1HH1  ARG  76          2HH2      ARG  76  -1.097  -5.243 -10.658
  575   2HH1  ARG  76          1HH2      ARG  76  -0.451  -3.895 -11.599
  576   1HH2  ARG  76          2HH1      ARG  76   2.739  -5.107 -11.950
  577   2HH2  ARG  76          1HH1      ARG  76   1.677  -3.704 -12.015
  578    H    GLU  77           H        GLU  77  -2.714  -7.794  -5.011
  579    HA   GLU  77           HA       GLU  77  -0.984  -8.240  -3.192
  580   1HB   GLU  77          2HB       GLU  77  -3.472  -9.866  -2.779
  581   2HB   GLU  77          3HB       GLU  77  -2.582  -8.774  -1.705
  582   1HG   GLU  77          2HG       GLU  77  -4.437  -8.000  -3.985
  583   2HG   GLU  77          3HG       GLU  77  -4.580  -7.627  -2.274
  584    H    LEU  78           H        LEU  78  -2.252 -10.899  -4.998
  585    HA   LEU  78           HA       LEU  78  -1.111 -13.111  -3.672
  586   1HB   LEU  78          2HB       LEU  78  -1.480 -13.058  -6.676
  587   2HB   LEU  78          3HB       LEU  78  -1.636 -14.391  -5.545
  588    HG   LEU  78           HG       LEU  78  -3.783 -13.938  -6.232
  589   1HD1  LEU  78          1HD1      LEU  78  -3.629 -14.176  -3.770
  590   2HD1  LEU  78          2HD1      LEU  78  -3.639 -12.412  -3.595
  591   3HD1  LEU  78          3HD1      LEU  78  -5.042 -13.234  -4.286
  592   1HD2  LEU  78          1HD2      LEU  78  -4.742 -12.010  -6.875
  593   2HD2  LEU  78          2HD2      LEU  78  -4.039 -11.045  -5.584
  594   3HD2  LEU  78          3HD2      LEU  78  -3.065 -11.446  -7.009
  595    H    THR  79           H        THR  79   0.273 -11.046  -6.292
  596    HA   THR  79           HA       THR  79   2.588 -12.644  -6.773
  597    HB   THR  79           HB       THR  79   2.213  -9.658  -7.198
  598    HG1  THR  79           1HG      THR  79   2.075 -10.671  -9.381
  599   1HG2  THR  79          1HG2      THR  79   4.624 -10.489  -7.330
  600   2HG2  THR  79          2HG2      THR  79   4.105 -11.650  -8.551
  601   3HG2  THR  79          3HG2      THR  79   4.001  -9.905  -8.870
  602    H    GLU  80           H        GLU  80   3.944 -13.084  -5.266
  603    HA   GLU  80           HA       GLU  80   4.223 -11.534  -2.884
  604   1HB   GLU  80          2HB       GLU  80   6.189 -13.680  -3.684
  605   2HB   GLU  80          3HB       GLU  80   5.708 -13.058  -2.085
  606   1HG   GLU  80          2HG       GLU  80   4.521 -15.028  -2.136
  607   2HG   GLU  80          3HG       GLU  80   3.300 -13.919  -2.759
  608    H    SER  81           H        SER  81   6.327 -11.768  -5.830
  609    HA   SER  81           HA       SER  81   8.494 -10.269  -4.965
  610   1HB   SER  81          2HB       SER  81   7.156  -9.868  -7.685
  611   2HB   SER  81          3HB       SER  81   8.831  -9.571  -7.226
  612    HG   SER  81           HG       SER  81   8.671 -11.469  -8.295
  613    H    GLU  82           H        GLU  82   5.437  -9.038  -6.318
  614    HA   GLU  82           HA       GLU  82   6.132  -6.267  -6.193
  615   1HB   GLU  82          2HB       GLU  82   4.569  -7.176  -7.769
  616   2HB   GLU  82          3HB       GLU  82   3.481  -7.757  -6.490
  617   1HG   GLU  82          2HG       GLU  82   2.779  -5.627  -5.884
  618   2HG   GLU  82          3HG       GLU  82   4.180  -4.818  -6.627
  619    H    THR  83           H        THR  83   4.076  -8.417  -4.189
  620    HA   THR  83           HA       THR  83   3.240  -6.524  -2.368
  621    HB   THR  83           HB       THR  83   3.260  -9.420  -2.574
  622    HG1  THR  83           1HG      THR  83   1.611  -8.150  -0.816
  623   1HG2  THR  83          1HG2      THR  83   2.969 -10.003  -0.199
  624   2HG2  THR  83          2HG2      THR  83   4.646  -9.682  -0.642
  625   3HG2  THR  83          3HG2      THR  83   3.723  -8.465   0.265
  626    H    LYS  84           H        LYS  84   6.145  -8.538  -2.429
  627    HA   LYS  84           HA       LYS  84   7.343  -7.633  -0.020
  628   1HB   LYS  84          2HB       LYS  84   7.755  -9.802  -1.011
  629   2HB   LYS  84          3HB       LYS  84   8.516  -9.065  -2.432
  630   1HG   LYS  84          2HG       LYS  84  10.466  -8.716  -1.382
  631   2HG   LYS  84          3HG       LYS  84   9.696  -8.144   0.112
  632   1HD   LYS  84          2HD       LYS  84   9.171 -10.401   0.816
  633   2HD   LYS  84          3HD       LYS  84   9.851 -11.079  -0.681
  634   1HE   LYS  84          2HE       LYS  84  12.090 -10.314  -0.095
  635   2HE   LYS  84          3HE       LYS  84  11.475  -9.377   1.278
  636   1HZ   LYS  84          1HZ       LYS  84  12.440 -11.452   1.974
  637   2HZ   LYS  84          2HZ       LYS  84  10.838 -11.407   2.345
  638   3HZ   LYS  84          3HZ       LYS  84  11.362 -12.312   1.075
  639    H    SER  85           H        SER  85   7.601  -6.516  -3.425
  640    HA   SER  85           HA       SER  85   9.719  -4.682  -3.059
  641   1HB   SER  85          2HB       SER  85   8.598  -5.345  -5.262
  642   2HB   SER  85          3HB       SER  85   7.293  -4.218  -4.851
  643    HG   SER  85           HG       SER  85  10.035  -3.653  -5.273
  644    H    LEU  86           H        LEU  86   6.167  -4.296  -2.616
  645    HA   LEU  86           HA       LEU  86   6.274  -1.643  -1.591
  646   1HB   LEU  86          2HB       LEU  86   4.243  -3.154  -2.294
  647   2HB   LEU  86          3HB       LEU  86   4.247  -3.670  -0.614
  648    HG   LEU  86           HG       LEU  86   2.632  -1.929  -1.000
  649   1HD1  LEU  86          1HD1      LEU  86   3.154  -0.363   0.741
  650   2HD1  LEU  86          2HD1      LEU  86   3.840  -1.933   1.205
  651   3HD1  LEU  86          3HD1      LEU  86   4.890  -0.644   0.566
  652   1HD2  LEU  86          1HD2      LEU  86   3.079   0.263  -1.807
  653   2HD2  LEU  86          2HD2      LEU  86   4.831   0.031  -1.766
  654   3HD2  LEU  86          3HD2      LEU  86   3.849  -0.858  -2.946
  655    H    MET  87           H        MET  87   6.152  -4.774   0.194
  656    HA   MET  87           HA       MET  87   6.590  -3.868   2.726
  657   1HB   MET  87          2HB       MET  87   6.390  -6.301   1.783
  658   2HB   MET  87          3HB       MET  87   8.155  -6.291   1.757
  659   1HG   MET  87          2HG       MET  87   8.210  -5.860   4.189
  660   2HG   MET  87          3HG       MET  87   6.464  -5.659   4.185
  661   1HE   MET  87          1HE       MET  87   5.419  -7.291   5.742
  662   2HE   MET  87          2HE       MET  87   6.171  -8.849   6.141
  663   3HE   MET  87          3HE       MET  87   7.064  -7.357   6.395
  664    H    ALA  88           H        ALA  88   9.116  -4.400   0.297
  665    HA   ALA  88           HA       ALA  88  11.373  -4.234   1.920
  666   1HB   ALA  88          1HB       ALA  88  12.593  -3.890  -0.216
  667   2HB   ALA  88          2HB       ALA  88  11.375  -5.171  -0.355
  668   3HB   ALA  88          3HB       ALA  88  11.056  -3.577  -1.046
  669    H    ALA  89           H        ALA  89   9.743  -1.633   0.061
  670    HA   ALA  89           HA       ALA  89  11.670   0.376   1.077
  671   1HB   ALA  89          1HB       ALA  89   9.207   0.605  -0.652
  672   2HB   ALA  89          2HB       ALA  89  10.294   1.955  -0.245
  673   3HB   ALA  89          3HB       ALA  89  10.913   0.587  -1.193
  674    H    ALA  90           H        ALA  90   8.309  -0.679   1.739
  675    HA   ALA  90           HA       ALA  90   7.625   1.544   3.468
  676   1HB   ALA  90          1HB       ALA  90   6.683  -1.351   3.429
  677   2HB   ALA  90          2HB       ALA  90   5.891  -0.010   4.284
  678   3HB   ALA  90          3HB       ALA  90   5.966  -0.008   2.500
  679    H    ASP  91           H        ASP  91   9.288  -1.595   4.043
  680    HA   ASP  91           HA       ASP  91   9.341  -1.229   6.867
  681   1HB   ASP  91          2HB       ASP  91   9.729  -3.457   5.958
  682   2HB   ASP  91          3HB       ASP  91  11.139  -2.878   5.048
  683    H    ASN  92           H        ASN  92  10.481   0.281   7.946
  684    HA   ASN  92           HA       ASN  92  12.826   1.610   6.605
  685   1HB   ASN  92          2HB       ASN  92  10.755   2.534   8.604
  686   2HB   ASN  92          3HB       ASN  92  12.347   3.298   8.541
  687   1HD2  ASN  92          1HD2      ASN  92  11.248   5.275   7.959
  688   2HD2  ASN  92          2HD2      ASN  92  10.812   5.522   6.278
  689    H    ASP  93           H        ASP  93  12.474  -1.041   8.442
  690    HA   ASP  93           HA       ASP  93  14.753  -0.316  10.253
  691   1HB   ASP  93          2HB       ASP  93  12.982  -2.782  10.233
  692   2HB   ASP  93          3HB       ASP  93  14.333  -2.487  11.322
  693    H    GLY  94           H        GLY  94  13.659  -2.926   7.989
  694   1HA   GLY  94          1HA       GLY  94  15.123  -4.273   6.647
  695   2HA   GLY  94          2HA       GLY  94  16.485  -3.884   7.710
  696    H    ASP  95           H        ASP  95  13.101  -4.822   8.234
  697    HA   ASP  95           HA       ASP  95  13.858  -7.270   9.732
  698   1HB   ASP  95          2HB       ASP  95  12.196  -6.877  11.436
  699   2HB   ASP  95          3HB       ASP  95  13.422  -5.611  11.453
  700    H    GLY  96           H        GLY  96  11.205  -5.397   8.331
  701   1HA   GLY  96          1HA       GLY  96  10.191  -6.475   6.239
  702   2HA   GLY  96          2HA       GLY  96   9.862  -7.868   7.291
  703    H    LYS  97           H        LYS  97   8.928  -7.122   9.521
  704    HA   LYS  97           HA       LYS  97   6.317  -6.283   9.182
  705   1HB   LYS  97          2HB       LYS  97   6.258  -5.979  11.645
  706   2HB   LYS  97          3HB       LYS  97   7.032  -7.487  11.140
  707   1HG   LYS  97          2HG       LYS  97   9.274  -6.430  11.460
  708   2HG   LYS  97          3HG       LYS  97   8.482  -4.950  12.016
  709   1HD   LYS  97          2HD       LYS  97   7.477  -6.219  13.898
  710   2HD   LYS  97          3HD       LYS  97   8.323  -7.685  13.339
  711   1HE   LYS  97          2HE       LYS  97  10.520  -6.498  13.568
  712   2HE   LYS  97          3HE       LYS  97   9.681  -5.040  14.111
  713   1HZ   LYS  97          1HZ       LYS  97   9.738  -7.619  15.524
  714   2HZ   LYS  97          2HZ       LYS  97  10.562  -6.254  15.926
  715   3HZ   LYS  97          3HZ       LYS  97   8.920  -6.274  16.025
  716    H    ILE  98           H        ILE  98   5.197  -4.380   9.114
  717    HA   ILE  98           HA       ILE  98   6.764  -1.824   9.111
  718    HB   ILE  98           HB       ILE  98   4.581  -2.955   7.398
  719   1HG1  ILE  98          2HG1      ILE  98   6.888  -1.447   6.280
  720   2HG1  ILE  98          3HG1      ILE  98   7.362  -2.876   7.179
  721   1HG2  ILE  98          1HG2      ILE  98   3.823  -0.648   7.880
  722   2HG2  ILE  98          2HG2      ILE  98   5.422  -0.028   7.424
  723   3HG2  ILE  98          3HG2      ILE  98   4.394  -0.818   6.221
  724   1HD1  ILE  98          1HD1      ILE  98   7.052  -3.461   4.891
  725   2HD1  ILE  98          2HD1      ILE  98   5.804  -4.262   5.872
  726   3HD1  ILE  98          3HD1      ILE  98   5.377  -2.842   4.883
  727    H    GLY  99           H        GLY  99   6.410  -0.844  11.018
  728   1HA   GLY  99          1HA       GLY  99   3.846  -0.863  12.402
  729   2HA   GLY  99          2HA       GLY  99   5.194   0.253  12.676
  730    H    ALA 100           H        ALA 100   2.615   1.250  12.807
  731    HA   ALA 100           HA       ALA 100   1.681   2.369  10.331
  732   1HB   ALA 100          1HB       ALA 100   1.304   3.741  13.003
  733   2HB   ALA 100          2HB       ALA 100   0.222   3.667  11.585
  734   3HB   ALA 100          3HB       ALA 100   0.436   2.249  12.626
  735    H    GLU 101           H        GLU 101   4.016   3.428  12.790
  736    HA   GLU 101           HA       GLU 101   4.645   5.956  11.771
  737   1HB   GLU 101          2HB       GLU 101   6.288   3.837  13.216
  738   2HB   GLU 101          3HB       GLU 101   6.943   5.430  12.809
  739   1HG   GLU 101          2HG       GLU 101   5.299   6.575  14.119
  740   2HG   GLU 101          3HG       GLU 101   4.332   5.108  14.358
  741    H    GLU 102           H        GLU 102   6.171   2.782  10.954
  742    HA   GLU 102           HA       GLU 102   7.899   3.706   8.947
  743   1HB   GLU 102          2HB       GLU 102   6.456   1.024   9.078
  744   2HB   GLU 102          3HB       GLU 102   7.927   1.404   8.174
  745   1HG   GLU 102          2HG       GLU 102   9.028   1.962  10.392
  746   2HG   GLU 102          3HG       GLU 102   7.593   1.325  11.217
  747    H    PHE 103           H        PHE 103   4.565   2.417   8.627
  748    HA   PHE 103           HA       PHE 103   4.354   2.692   5.824
  749   1HB   PHE 103          2HB       PHE 103   2.780   1.428   7.243
  750   2HB   PHE 103          3HB       PHE 103   2.160   2.927   7.919
  751    HD1  PHE 103           1HD      PHE 103   2.463   0.914   4.783
  752    HD2  PHE 103           2HD      PHE 103   0.581   4.308   6.668
  753    HE1  PHE 103           1HE      PHE 103   0.865   1.080   2.900
  754    HE2  PHE 103           2HE      PHE 103  -1.083   4.394   4.843
  755    HZ   PHE 103           HZ       PHE 103  -0.933   2.802   2.935
  756    H    GLN 104           H        GLN 104   3.222   4.995   8.344
  757    HA   GLN 104           HA       GLN 104   2.373   7.107   6.613
  758   1HB   GLN 104          2HB       GLN 104   1.826   6.845   9.034
  759   2HB   GLN 104          3HB       GLN 104   3.490   7.316   9.437
  760   1HG   GLN 104          2HG       GLN 104   3.141   9.471   8.228
  761   2HG   GLN 104          3HG       GLN 104   1.487   8.986   7.840
  762   1HE2  GLN 104          1HE2      GLN 104   2.344  11.351   9.334
  763   2HE2  GLN 104          2HE2      GLN 104   1.616  11.217  10.923
  764    H    GLU 105           H        GLU 105   5.633   6.446   8.112
  765    HA   GLU 105           HA       GLU 105   6.945   8.738   7.168
  766   1HB   GLU 105          2HB       GLU 105   7.821   5.908   7.806
  767   2HB   GLU 105          3HB       GLU 105   8.942   6.953   6.956
  768   1HG   GLU 105          2HG       GLU 105   7.595   7.839   9.533
  769   2HG   GLU 105          3HG       GLU 105   9.149   6.991   9.480
  770    H    MET 106           H        MET 106   6.766   5.524   5.526
  771    HA   MET 106           HA       MET 106   8.080   6.428   3.186
  772   1HB   MET 106          2HB       MET 106   7.094   3.991   4.035
  773   2HB   MET 106          3HB       MET 106   5.929   4.387   2.769
  774   1HG   MET 106          2HG       MET 106   8.940   4.093   2.568
  775   2HG   MET 106          3HG       MET 106   7.706   3.114   1.783
  776   1HE   MET 106          1HE       MET 106   9.972   6.156   1.654
  777   2HE   MET 106          2HE       MET 106  10.461   4.761   0.661
  778   3HE   MET 106          3HE       MET 106  10.055   6.315  -0.107
  779    H    VAL 107           H        VAL 107   4.617   6.206   3.990
  780    HA   VAL 107           HA       VAL 107   3.754   7.308   1.537
  781    HB   VAL 107           HB       VAL 107   2.308   6.806   4.144
  782   1HG1  VAL 107          1HG1      VAL 107   1.334   7.701   1.430
  783   2HG1  VAL 107          2HG1      VAL 107   0.261   6.896   2.580
  784   3HG1  VAL 107          3HG1      VAL 107   0.998   8.461   2.987
  785   1HG2  VAL 107          1HG2      VAL 107   3.187   4.781   2.915
  786   2HG2  VAL 107          2HG2      VAL 107   1.425   4.866   2.896
  787   3HG2  VAL 107          3HG2      VAL 107   2.346   5.337   1.458
  788    H    HIS 108           H        HIS 108   5.038   8.935   4.302
  789    HA   HIS 108           HA       HIS 108   3.755  11.480   3.675
  790   1HB   HIS 108          2HB       HIS 108   4.199  10.900   5.966
  791   2HB   HIS 108          3HB       HIS 108   5.909  10.612   5.632
  792    HD1  HIS 108           1HD      HIS 108   7.438  12.816   5.283
  793    HD2  HIS 108           2HD      HIS 108   3.476  13.375   6.577
  794    HE1  HIS 108           1HE      HIS 108   7.317  15.172   6.273
  795    H    SER 109           H        SER 109   6.217   9.674   2.232
  796    HA   SER 109           HA       SER 109   8.195  11.736   1.845
  797   1HB   SER 109          2HB       SER 109   8.664   9.278   1.919
  798   2HB   SER 109          3HB       SER 109   7.808   9.114   0.369
  799    HG   SER 109           HG       SER 109   9.285  10.822  -0.352
  Start of MODEL   17
    1   1H    MET   1           H1       MET   1 -15.011   2.837  -1.228
    2   2H    MET   1           H2       MET   1 -16.584   2.456  -1.422
    3   3H    MET   1           H3       MET   1 -16.192   3.892  -0.808
    4    HA   MET   1           HA       MET   1 -17.099   2.296   0.739
    5   1HB   MET   1          2HB       MET   1 -15.643   0.420  -0.341
    6   2HB   MET   1          3HB       MET   1 -14.328   1.012   0.684
    7   1HG   MET   1          2HG       MET   1 -15.466  -0.838   1.724
    8   2HG   MET   1          3HG       MET   1 -15.778   0.614   2.690
    9   1HE   MET   1          1HE       MET   1 -18.193   1.894   2.640
   10   2HE   MET   1          2HE       MET   1 -19.534   0.753   2.838
   11   3HE   MET   1          3HE       MET   1 -18.070   0.581   3.832
   12    H    SER   2           H        SER   2 -13.628   3.257   0.661
   13    HA   SER   2           HA       SER   2 -14.223   5.384   2.584
   14   1HB   SER   2          2HB       SER   2 -12.128   3.249   3.261
   15   2HB   SER   2          3HB       SER   2 -12.437   4.755   4.144
   16    HG   SER   2           HG       SER   2 -14.775   3.635   3.938
   17    H    ILE   3           H        ILE   3 -11.297   3.714   1.267
   18    HA   ILE   3           HA       ILE   3 -10.221   6.237   0.426
   19    HB   ILE   3           HB       ILE   3  -8.456   5.122  -0.448
   20   1HG1  ILE   3          2HG1      ILE   3  -8.640   2.402  -0.195
   21   2HG1  ILE   3          3HG1      ILE   3 -10.267   2.730  -0.722
   22   1HG2  ILE   3          1HG2      ILE   3  -8.822   5.095   2.051
   23   2HG2  ILE   3          2HG2      ILE   3  -9.295   3.394   1.934
   24   3HG2  ILE   3          3HG2      ILE   3  -7.662   3.884   1.457
   25   1HD1  ILE   3          1HD1      ILE   3  -8.740   2.221  -2.605
   26   2HD1  ILE   3          2HD1      ILE   3  -9.295   3.894  -2.757
   27   3HD1  ILE   3          3HD1      ILE   3  -7.667   3.543  -2.129
   28    H    THR   4           H        THR   4 -12.118   3.722  -1.169
   29    HA   THR   4           HA       THR   4 -11.649   4.719  -3.785
   30    HB   THR   4           HB       THR   4 -13.147   3.099  -4.509
   31    HG1  THR   4           1HG      THR   4 -14.896   3.312  -3.306
   32   1HG2  THR   4          1HG2      THR   4 -11.942   1.821  -2.026
   33   2HG2  THR   4          2HG2      THR   4 -12.365   1.052  -3.556
   34   3HG2  THR   4          3HG2      THR   4 -11.030   2.208  -3.507
   35    H    ASP   5           H        ASP   5 -13.496   6.173  -1.360
   36    HA   ASP   5           HA       ASP   5 -15.406   7.409  -3.308
   37   1HB   ASP   5          2HB       ASP   5 -15.381   7.102  -0.295
   38   2HB   ASP   5          3HB       ASP   5 -16.341   8.350  -1.102
   39    H    VAL   6           H        VAL   6 -12.696   8.163  -1.129
   40    HA   VAL   6           HA       VAL   6 -13.238  10.973  -1.132
   41    HB   VAL   6           HB       VAL   6 -10.965  11.162  -0.076
   42   1HG1  VAL   6          1HG1      VAL   6 -11.668   9.962   1.986
   43   2HG1  VAL   6          2HG1      VAL   6 -13.007  10.861   1.249
   44   3HG1  VAL   6          3HG1      VAL   6 -12.909   9.102   1.057
   45   1HG2  VAL   6          1HG2      VAL   6 -10.884   8.167  -0.251
   46   2HG2  VAL   6          2HG2      VAL   6  -9.786   9.268  -1.114
   47   3HG2  VAL   6          3HG2      VAL   6  -9.774   9.201   0.650
   48    H    LEU   7           H        LEU   7 -10.981   9.031  -3.027
   49    HA   LEU   7           HA       LEU   7 -10.727  10.852  -5.223
   50   1HB   LEU   7          2HB       LEU   7  -9.468  12.289  -3.702
   51   2HB   LEU   7          3HB       LEU   7  -8.554  10.925  -3.081
   52    HG   LEU   7           HG       LEU   7  -8.097  10.988  -5.929
   53   1HD1  LEU   7          1HD1      LEU   7  -7.150  13.203  -6.245
   54   2HD1  LEU   7          2HD1      LEU   7  -8.892  13.312  -5.925
   55   3HD1  LEU   7          3HD1      LEU   7  -7.722  13.715  -4.644
   56   1HD2  LEU   7          1HD2      LEU   7  -6.336  11.869  -3.606
   57   2HD2  LEU   7          2HD2      LEU   7  -6.518  10.195  -4.175
   58   3HD2  LEU   7          3HD2      LEU   7  -5.770  11.411  -5.220
   59    H    SER   8           H        SER   8  -8.736   8.736  -3.164
   60    HA   SER   8           HA       SER   8  -7.094   7.596  -4.799
   61   1HB   SER   8          2HB       SER   8  -8.430   6.074  -2.591
   62   2HB   SER   8          3HB       SER   8  -6.764   5.907  -3.183
   63    HG   SER   8           HG       SER   8  -6.408   8.069  -2.518
   64    H    ALA   9           H        ALA   9 -10.482   6.751  -5.029
   65    HA   ALA   9           HA       ALA   9 -10.392   4.228  -6.342
   66   1HB   ALA   9          1HB       ALA   9 -12.533   4.851  -6.051
   67   2HB   ALA   9          2HB       ALA   9 -12.234   6.586  -6.355
   68   3HB   ALA   9          3HB       ALA   9 -12.354   5.432  -7.697
   69    H    ASP  10           H        ASP  10  -9.954   7.569  -7.661
   70    HA   ASP  10           HA       ASP  10  -9.714   6.636 -10.394
   71   1HB   ASP  10          2HB       ASP  10 -10.370   8.957  -9.704
   72   2HB   ASP  10          3HB       ASP  10  -8.706   9.230  -9.149
   73    H    ASP  11           H        ASP  11  -7.477   7.363  -7.740
   74    HA   ASP  11           HA       ASP  11  -5.075   7.247  -9.191
   75   1HB   ASP  11          2HB       ASP  11  -5.502   6.683  -6.227
   76   2HB   ASP  11          3HB       ASP  11  -4.061   7.284  -7.057
   77    H    ILE  12           H        ILE  12  -6.832   4.744  -7.224
   78    HA   ILE  12           HA       ILE  12  -4.937   2.712  -7.735
   79    HB   ILE  12           HB       ILE  12  -6.589   1.186  -7.076
   80   1HG1  ILE  12          2HG1      ILE  12  -8.539   3.396  -6.812
   81   2HG1  ILE  12          3HG1      ILE  12  -8.616   2.117  -8.029
   82   1HG2  ILE  12          1HG2      ILE  12  -6.321   3.596  -5.248
   83   2HG2  ILE  12          2HG2      ILE  12  -6.810   1.989  -4.714
   84   3HG2  ILE  12          3HG2      ILE  12  -5.206   2.237  -5.409
   85   1HD1  ILE  12          1HD1      ILE  12  -9.065   1.869  -5.055
   86   2HD1  ILE  12          2HD1      ILE  12 -10.188   1.542  -6.377
   87   3HD1  ILE  12          3HD1      ILE  12  -8.805   0.465  -6.128
   88    H    ALA  13           H        ALA  13  -7.846   3.812  -9.549
   89    HA   ALA  13           HA       ALA  13  -7.771   1.770 -11.515
   90   1HB   ALA  13          1HB       ALA  13  -9.596   3.435 -11.309
   91   2HB   ALA  13          2HB       ALA  13  -8.530   4.678 -11.997
   92   3HB   ALA  13          3HB       ALA  13  -8.975   3.267 -12.964
   93    H    ALA  14           H        ALA  14  -5.977   4.912 -11.407
   94    HA   ALA  14           HA       ALA  14  -4.467   4.477 -13.777
   95   1HB   ALA  14          1HB       ALA  14  -3.590   5.972 -11.270
   96   2HB   ALA  14          2HB       ALA  14  -2.859   6.074 -12.879
   97   3HB   ALA  14          3HB       ALA  14  -4.525   6.643 -12.621
   98    H    ALA  15           H        ALA  15  -3.501   3.788 -10.383
   99    HA   ALA  15           HA       ALA  15  -1.064   2.609 -10.716
  100   1HB   ALA  15          1HB       ALA  15  -2.285   3.084  -8.527
  101   2HB   ALA  15          2HB       ALA  15  -3.169   1.575  -8.775
  102   3HB   ALA  15          3HB       ALA  15  -1.410   1.540  -8.602
  103    H    LEU  16           H        LEU  16  -4.219   1.067 -10.834
  104    HA   LEU  16           HA       LEU  16  -3.489  -1.595 -11.195
  105   1HB   LEU  16          2HB       LEU  16  -5.696  -1.213 -10.614
  106   2HB   LEU  16          3HB       LEU  16  -5.953   0.029 -11.827
  107    HG   LEU  16           HG       LEU  16  -5.419  -2.688 -12.942
  108   1HD1  LEU  16          1HD1      LEU  16  -6.839  -3.310 -11.054
  109   2HD1  LEU  16          2HD1      LEU  16  -8.003  -2.034 -11.479
  110   3HD1  LEU  16          3HD1      LEU  16  -7.746  -3.409 -12.573
  111   1HD2  LEU  16          1HD2      LEU  16  -7.612  -0.618 -13.469
  112   2HD2  LEU  16          2HD2      LEU  16  -6.045  -0.587 -14.276
  113   3HD2  LEU  16          3HD2      LEU  16  -7.133  -1.961 -14.526
  114    H    GLN  17           H        GLN  17  -3.822   1.058 -13.593
  115    HA   GLN  17           HA       GLN  17  -3.551  -0.880 -15.799
  116   1HB   GLN  17          2HB       GLN  17  -4.519   1.860 -15.546
  117   2HB   GLN  17          3HB       GLN  17  -3.347   1.712 -16.865
  118   1HG   GLN  17          2HG       GLN  17  -4.585  -0.121 -17.871
  119   2HG   GLN  17          3HG       GLN  17  -5.683  -0.209 -16.488
  120   1HE2  GLN  17          1HE2      GLN  17  -4.547   2.220 -18.931
  121   2HE2  GLN  17          2HE2      GLN  17  -6.150   2.903 -19.153
  122    H    GLU  18           H        GLU  18  -1.649   1.736 -14.285
  123    HA   GLU  18           HA       GLU  18   0.477   1.540 -16.156
  124   1HB   GLU  18          2HB       GLU  18   1.516   3.183 -14.930
  125   2HB   GLU  18          3HB       GLU  18  -0.180   3.421 -14.506
  126   1HG   GLU  18          2HG       GLU  18   0.243   2.123 -12.398
  127   2HG   GLU  18          3HG       GLU  18   1.971   2.111 -12.826
  128    H    CYS  19           H        CYS  19  -0.127  -0.144 -13.063
  129    HA   CYS  19           HA       CYS  19   2.310  -1.829 -13.494
  130   1HB   CYS  19          2HB       CYS  19   0.503  -1.591 -11.057
  131   2HB   CYS  19          3HB       CYS  19   1.970  -2.578 -11.205
  132    HG   CYS  19           HG       CYS  19   1.665   0.677 -11.465
  133    H    ARG  20           H        ARG  20   0.336  -2.298 -15.415
  134    HA   ARG  20           HA       ARG  20  -1.413  -4.503 -14.569
  135   1HB   ARG  20          2HB       ARG  20  -0.729  -3.122 -17.128
  136   2HB   ARG  20          3HB       ARG  20  -1.118  -4.840 -17.278
  137   1HG   ARG  20          2HG       ARG  20  -3.252  -4.600 -16.219
  138   2HG   ARG  20          3HG       ARG  20  -2.846  -2.979 -15.674
  139   1HD   ARG  20          2HD       ARG  20  -4.306  -2.604 -17.477
  140   2HD   ARG  20          3HD       ARG  20  -2.687  -2.206 -18.026
  141    HE   ARG  20           HE       ARG  20  -2.719  -3.941 -19.540
  142   1HH1  ARG  20          2HH2      ARG  20  -5.311  -4.435 -17.217
  143   2HH1  ARG  20          1HH2      ARG  20  -6.220  -5.557 -18.181
  144   1HH2  ARG  20          2HH1      ARG  20  -3.877  -5.449 -20.877
  145   2HH2  ARG  20          1HH1      ARG  20  -5.348  -6.174 -20.313
  146    H    ASP  21           H        ASP  21   1.558  -4.139 -16.475
  147    HA   ASP  21           HA       ASP  21   2.126  -6.790 -16.868
  148   1HB   ASP  21          2HB       ASP  21   3.816  -4.262 -16.801
  149   2HB   ASP  21          3HB       ASP  21   4.463  -5.814 -17.317
  150    HA   PRO  22           HA       PRO  22   3.373  -8.215 -12.897
  151   1HB   PRO  22          2HB       PRO  22   5.081 -10.293 -13.513
  152   2HB   PRO  22          3HB       PRO  22   3.313 -10.368 -13.762
  153   1HG   PRO  22          2HG       PRO  22   5.432  -9.641 -15.803
  154   2HG   PRO  22          3HG       PRO  22   4.107 -10.829 -15.986
  155   1HD   PRO  22          2HD       PRO  22   3.886  -8.309 -16.945
  156   2HD   PRO  22          3HD       PRO  22   2.478  -9.084 -16.157
  157    H    ASP  23           H        ASP  23   5.089  -8.135 -11.404
  158    HA   ASP  23           HA       ASP  23   6.791  -7.193 -10.404
  159   1HB   ASP  23          2HB       ASP  23   7.775  -9.123 -11.738
  160   2HB   ASP  23          3HB       ASP  23   8.406  -7.920 -12.875
  161    H    THR  24           H        THR  24   5.338  -5.376 -12.522
  162    HA   THR  24           HA       THR  24   7.363  -3.304 -13.003
  163    HB   THR  24           HB       THR  24   4.354  -3.260 -13.478
  164    HG1  THR  24           1HG      THR  24   5.155  -4.967 -14.585
  165   1HG2  THR  24          1HG2      THR  24   4.962  -1.703 -15.324
  166   2HG2  THR  24          2HG2      THR  24   5.332  -1.021 -13.736
  167   3HG2  THR  24          3HG2      THR  24   6.640  -1.687 -14.745
  168    H    PHE  25           H        PHE  25   5.425  -4.234 -10.399
  169    HA   PHE  25           HA       PHE  25   4.422  -1.679  -9.548
  170   1HB   PHE  25          2HB       PHE  25   3.464  -3.981  -9.159
  171   2HB   PHE  25          3HB       PHE  25   4.758  -4.252  -8.001
  172    HD1  PHE  25           1HD      PHE  25   1.511  -2.663  -8.612
  173    HD2  PHE  25           2HD      PHE  25   4.865  -2.832  -5.912
  174    HE1  PHE  25           1HE      PHE  25   0.079  -1.847  -6.769
  175    HE2  PHE  25           2HE      PHE  25   3.480  -1.788  -4.148
  176    HZ   PHE  25           HZ       PHE  25   1.051  -1.443  -4.517
  177    H    GLU  26           H        GLU  26   5.655  -0.109  -8.696
  178    HA   GLU  26           HA       GLU  26   8.050  -0.776  -7.046
  179   1HB   GLU  26          2HB       GLU  26   7.447   1.451  -8.998
  180   2HB   GLU  26          3HB       GLU  26   8.575   1.734  -7.664
  181   1HG   GLU  26          2HG       GLU  26   9.924  -0.218  -8.425
  182   2HG   GLU  26          3HG       GLU  26   8.842  -0.381  -9.824
  183    HA   PRO  27           HA       PRO  27   5.986   0.896  -3.555
  184   1HB   PRO  27          2HB       PRO  27   8.087   1.979  -2.080
  185   2HB   PRO  27          3HB       PRO  27   7.716   0.255  -2.224
  186   1HG   PRO  27          2HG       PRO  27   9.781   1.808  -3.794
  187   2HG   PRO  27          3HG       PRO  27   9.922   0.181  -3.072
  188   1HD   PRO  27          2HD       PRO  27   9.432   0.490  -5.689
  189   2HD   PRO  27          3HD       PRO  27   8.668  -0.819  -4.740
  190    H    GLN  28           H        GLN  28   8.562   3.437  -3.852
  191    HA   GLN  28           HA       GLN  28   7.065   5.503  -3.106
  192   1HB   GLN  28          2HB       GLN  28   9.675   5.106  -3.785
  193   2HB   GLN  28          3HB       GLN  28   9.142   5.956  -5.249
  194   1HG   GLN  28          2HG       GLN  28   8.058   7.598  -3.648
  195   2HG   GLN  28          3HG       GLN  28   8.964   6.834  -2.339
  196   1HE2  GLN  28          1HE2      GLN  28  10.951   7.820  -1.883
  197   2HE2  GLN  28          2HE2      GLN  28  11.899   8.698  -3.066
  198    H    LYS  29           H        LYS  29   7.536   4.344  -6.410
  199    HA   LYS  29           HA       LYS  29   6.007   6.142  -7.911
  200   1HB   LYS  29          2HB       LYS  29   7.394   4.220  -8.793
  201   2HB   LYS  29          3HB       LYS  29   6.188   3.107  -8.155
  202   1HG   LYS  29          2HG       LYS  29   5.666   3.239 -10.409
  203   2HG   LYS  29          3HG       LYS  29   4.472   4.307  -9.668
  204   1HD   LYS  29          2HD       LYS  29   6.128   6.241 -10.212
  205   2HD   LYS  29          3HD       LYS  29   7.031   5.032 -11.158
  206   1HE   LYS  29          2HE       LYS  29   4.845   4.522 -12.387
  207   2HE   LYS  29          3HE       LYS  29   4.105   5.873 -11.501
  208   1HZ   LYS  29          1HZ       LYS  29   5.670   7.335 -12.561
  209   2HZ   LYS  29          2HZ       LYS  29   6.342   6.073 -13.394
  210   3HZ   LYS  29          3HZ       LYS  29   4.770   6.496 -13.657
  211    H    PHE  30           H        PHE  30   4.851   2.984  -6.571
  212    HA   PHE  30           HA       PHE  30   2.149   3.340  -7.073
  213   1HB   PHE  30          2HB       PHE  30   3.112   1.199  -6.496
  214   2HB   PHE  30          3HB       PHE  30   3.553   1.771  -4.887
  215    HD1  PHE  30           1HD      PHE  30   1.991   1.663  -3.086
  216    HD2  PHE  30           2HD      PHE  30   0.631   1.170  -7.145
  217    HE1  PHE  30           1HE      PHE  30  -0.298   1.189  -2.265
  218    HE2  PHE  30           2HE      PHE  30  -1.658   0.736  -6.309
  219    HZ   PHE  30           HZ       PHE  30  -2.115   0.698  -3.876
  220    H    PHE  31           H        PHE  31   3.985   4.387  -4.163
  221    HA   PHE  31           HA       PHE  31   1.800   5.130  -2.543
  222   1HB   PHE  31          2HB       PHE  31   4.440   6.629  -2.781
  223   2HB   PHE  31          3HB       PHE  31   3.296   6.705  -1.447
  224    HD1  PHE  31           1HD      PHE  31   6.017   6.370  -0.828
  225    HD2  PHE  31           2HD      PHE  31   3.069   3.363  -1.778
  226    HE1  PHE  31           1HE      PHE  31   7.290   4.700   0.454
  227    HE2  PHE  31           2HE      PHE  31   4.314   1.724  -0.421
  228    HZ   PHE  31           HZ       PHE  31   6.440   2.374   0.696
  229    H    GLN  32           H        GLN  32   3.575   7.145  -4.972
  230    HA   GLN  32           HA       GLN  32   1.674   9.320  -4.523
  231   1HB   GLN  32          2HB       GLN  32   4.069   9.700  -5.149
  232   2HB   GLN  32          3HB       GLN  32   3.705   9.089  -6.775
  233   1HG   GLN  32          2HG       GLN  32   2.153  10.894  -7.196
  234   2HG   GLN  32          3HG       GLN  32   2.063  11.313  -5.483
  235   1HE2  GLN  32          1HE2      GLN  32   5.114  10.721  -7.274
  236   2HE2  GLN  32          2HE2      GLN  32   5.688  12.368  -7.102
  237    H    THR  33           H        THR  33   2.061   6.721  -6.971
  238    HA   THR  33           HA       THR  33   0.154   7.700  -8.748
  239    HB   THR  33           HB       THR  33   1.890   5.395  -8.418
  240    HG1  THR  33           1HG      THR  33   0.412   5.837 -10.610
  241   1HG2  THR  33          1HG2      THR  33  -0.094   4.009  -7.896
  242   2HG2  THR  33          2HG2      THR  33  -0.846   4.612  -9.403
  243   3HG2  THR  33          3HG2      THR  33   0.651   3.658  -9.461
  244    H    SER  34           H        SER  34  -0.225   5.758  -5.820
  245    HA   SER  34           HA       SER  34  -3.070   5.390  -6.280
  246   1HB   SER  34          2HB       SER  34  -1.459   4.968  -3.741
  247   2HB   SER  34          3HB       SER  34  -3.080   4.329  -4.128
  248    HG   SER  34           HG       SER  34  -0.580   3.710  -5.302
  249    H    GLY  35           H        GLY  35  -1.239   8.038  -5.550
  250   1HA   GLY  35          1HA       GLY  35  -1.810  10.149  -4.788
  251   2HA   GLY  35          2HA       GLY  35  -3.437   9.574  -4.402
  252    H    LEU  36           H        LEU  36  -1.283   7.418  -2.967
  253    HA   LEU  36           HA       LEU  36  -2.219   8.236  -0.403
  254   1HB   LEU  36          2HB       LEU  36  -0.702   5.921  -1.563
  255   2HB   LEU  36          3HB       LEU  36  -0.263   6.359   0.066
  256    HG   LEU  36           HG       LEU  36  -2.869   6.433   0.480
  257   1HD1  LEU  36          1HD1      LEU  36  -3.517   6.022  -1.854
  258   2HD1  LEU  36          2HD1      LEU  36  -2.734   4.420  -1.775
  259   3HD1  LEU  36          3HD1      LEU  36  -4.136   4.786  -0.754
  260   1HD2  LEU  36          1HD2      LEU  36  -2.796   4.055   1.186
  261   2HD2  LEU  36          2HD2      LEU  36  -1.302   3.829   0.252
  262   3HD2  LEU  36          3HD2      LEU  36  -1.324   4.923   1.654
  263    H    SER  37           H        SER  37   0.831   8.846  -2.136
  264    HA   SER  37           HA       SER  37   1.991   9.982   0.332
  265   1HB   SER  37          2HB       SER  37   3.861  10.692  -0.966
  266   2HB   SER  37          3HB       SER  37   3.499   9.031  -1.422
  267    HG   SER  37           HG       SER  37   3.887  10.536  -3.169
  268    H    LYS  38           H        LYS  38  -0.371  11.035  -1.853
  269    HA   LYS  38           HA       LYS  38   0.225  13.906  -1.435
  270   1HB   LYS  38          2HB       LYS  38  -1.172  12.373  -3.492
  271   2HB   LYS  38          3HB       LYS  38  -2.310  13.460  -2.695
  272   1HG   LYS  38          2HG       LYS  38  -1.330  14.670  -4.507
  273   2HG   LYS  38          3HG       LYS  38  -0.684  15.330  -3.003
  274   1HD   LYS  38          2HD       LYS  38   1.126  13.239  -3.710
  275   2HD   LYS  38          3HD       LYS  38   0.652  13.928  -5.254
  276   1HE   LYS  38          2HE       LYS  38   1.213  16.227  -3.746
  277   2HE   LYS  38          3HE       LYS  38   2.315  15.042  -3.031
  278   1HZ   LYS  38          1HZ       LYS  38   3.118  14.616  -5.304
  279   2HZ   LYS  38          2HZ       LYS  38   2.143  15.812  -5.869
  280   3HZ   LYS  38          3HZ       LYS  38   3.362  16.174  -4.823
  281    H    MET  39           H        MET  39  -1.935  11.248  -0.496
  282    HA   MET  39           HA       MET  39  -3.678  12.745   1.183
  283   1HB   MET  39          2HB       MET  39  -2.647   9.902   1.322
  284   2HB   MET  39          3HB       MET  39  -3.834  10.547   2.427
  285   1HG   MET  39          2HG       MET  39  -4.166  10.371  -0.592
  286   2HG   MET  39          3HG       MET  39  -4.831   9.277   0.616
  287   1HE   MET  39          1HE       MET  39  -5.387  12.238  -1.577
  288   2HE   MET  39          2HE       MET  39  -6.746  13.122  -0.850
  289   3HE   MET  39          3HE       MET  39  -5.112  13.349  -0.224
  290    H    SER  40           H        SER  40  -3.498  13.681   3.046
  291    HA   SER  40           HA       SER  40  -0.922  14.148   4.224
  292   1HB   SER  40          2HB       SER  40  -3.623  14.689   5.517
  293   2HB   SER  40          3HB       SER  40  -2.118  15.617   5.681
  294    HG   SER  40           HG       SER  40  -2.394  15.998   3.323
  295    H    ALA  41           H        ALA  41  -0.346  13.622   6.467
  296    HA   ALA  41           HA       ALA  41  -0.305  11.040   7.261
  297   1HB   ALA  41          1HB       ALA  41   0.974  12.812   8.356
  298   2HB   ALA  41          2HB       ALA  41  -0.508  13.467   9.092
  299   3HB   ALA  41          3HB       ALA  41   0.086  11.863   9.563
  300    H    ASN  42           H        ASN  42  -2.895  13.331   8.108
  301    HA   ASN  42           HA       ASN  42  -4.500  11.794   9.802
  302   1HB   ASN  42          2HB       ASN  42  -5.525  13.584   7.549
  303   2HB   ASN  42          3HB       ASN  42  -6.381  13.138   9.028
  304   1HD2  ASN  42          1HD2      ASN  42  -5.208  15.785   7.718
  305   2HD2  ASN  42          2HD2      ASN  42  -4.409  16.530   9.088
  306    H    GLN  43           H        GLN  43  -4.697  11.964   6.227
  307    HA   GLN  43           HA       GLN  43  -6.738   9.922   6.009
  308   1HB   GLN  43          2HB       GLN  43  -5.031  11.545   4.137
  309   2HB   GLN  43          3HB       GLN  43  -5.697  10.026   3.529
  310   1HG   GLN  43          2HG       GLN  43  -7.451  12.083   4.906
  311   2HG   GLN  43          3HG       GLN  43  -7.083  12.171   3.178
  312   1HE2  GLN  43          1HE2      GLN  43  -9.694  11.561   4.714
  313   2HE2  GLN  43          2HE2      GLN  43 -10.245  10.095   3.927
  314    H    VAL  44           H        VAL  44  -3.107   9.989   5.703
  315    HA   VAL  44           HA       VAL  44  -2.963   7.324   4.760
  316    HB   VAL  44           HB       VAL  44  -0.931   8.972   6.284
  317   1HG1  VAL  44          1HG1      VAL  44   0.697   7.419   5.135
  318   2HG1  VAL  44          2HG1      VAL  44  -0.263   6.607   6.389
  319   3HG1  VAL  44          3HG1      VAL  44  -0.665   6.391   4.666
  320   1HG2  VAL  44          1HG2      VAL  44  -0.016   9.411   4.035
  321   2HG2  VAL  44          2HG2      VAL  44  -1.272   8.399   3.297
  322   3HG2  VAL  44          3HG2      VAL  44  -1.701   9.927   4.072
  323    H    LYS  45           H        LYS  45  -3.217   8.657   8.064
  324    HA   LYS  45           HA       LYS  45  -2.871   6.179   9.440
  325   1HB   LYS  45          2HB       LYS  45  -2.715   8.554  10.360
  326   2HB   LYS  45          3HB       LYS  45  -4.490   8.537  10.427
  327   1HG   LYS  45          2HG       LYS  45  -4.341   6.452  11.826
  328   2HG   LYS  45          3HG       LYS  45  -2.584   6.580  11.790
  329   1HD   LYS  45          2HD       LYS  45  -3.687   9.161  12.597
  330   2HD   LYS  45          3HD       LYS  45  -4.510   7.912  13.511
  331   1HE   LYS  45          2HE       LYS  45  -2.609   8.590  14.809
  332   2HE   LYS  45          3HE       LYS  45  -2.262   6.969  14.195
  333   1HZ   LYS  45          1HZ       LYS  45  -0.944   8.044  12.434
  334   2HZ   LYS  45          2HZ       LYS  45  -1.245   9.514  13.100
  335   3HZ   LYS  45          3HZ       LYS  45  -0.377   8.397  13.938
  336    H    ASP  46           H        ASP  46  -5.803   7.947   8.261
  337    HA   ASP  46           HA       ASP  46  -7.715   6.075   9.240
  338   1HB   ASP  46          2HB       ASP  46  -7.836   7.907   6.801
  339   2HB   ASP  46          3HB       ASP  46  -9.200   6.992   7.449
  340    H    VAL  47           H        VAL  47  -6.249   6.299   5.957
  341    HA   VAL  47           HA       VAL  47  -7.444   3.915   5.029
  342    HB   VAL  47           HB       VAL  47  -6.040   3.939   3.165
  343   1HG1  VAL  47          1HG1      VAL  47  -6.549   6.002   2.247
  344   2HG1  VAL  47          2HG1      VAL  47  -7.641   5.993   3.655
  345   3HG1  VAL  47          3HG1      VAL  47  -6.131   6.902   3.692
  346   1HG2  VAL  47          1HG2      VAL  47  -3.828   4.048   3.982
  347   2HG2  VAL  47          2HG2      VAL  47  -4.065   5.472   2.947
  348   3HG2  VAL  47          3HG2      VAL  47  -4.156   5.628   4.712
  349    H    PHE  48           H        PHE  48  -4.217   4.399   6.590
  350    HA   PHE  48           HA       PHE  48  -3.254   1.803   6.790
  351   1HB   PHE  48          2HB       PHE  48  -1.935   3.455   7.691
  352   2HB   PHE  48          3HB       PHE  48  -3.221   4.126   8.655
  353    HD1  PHE  48           1HD      PHE  48  -3.940   3.180  10.785
  354    HD2  PHE  48           2HD      PHE  48  -0.597   1.566   8.594
  355    HE1  PHE  48           1HE      PHE  48  -3.491   1.589  12.638
  356    HE2  PHE  48           2HE      PHE  48   0.061   0.286  10.622
  357    HZ   PHE  48           HZ       PHE  48  -1.528   0.071  12.514
  358    H    ARG  49           H        ARG  49  -5.715   3.254   9.049
  359    HA   ARG  49           HA       ARG  49  -6.155   0.775  10.416
  360   1HB   ARG  49          2HB       ARG  49  -7.748   3.347  10.166
  361   2HB   ARG  49          3HB       ARG  49  -8.518   1.891  10.805
  362   1HG   ARG  49          2HG       ARG  49  -6.632   1.631  12.435
  363   2HG   ARG  49          3HG       ARG  49  -6.039   3.228  11.933
  364   1HD   ARG  49          2HD       ARG  49  -8.137   4.272  12.733
  365   2HD   ARG  49          3HD       ARG  49  -8.888   2.693  12.904
  366    HE   ARG  49           HE       ARG  49  -7.955   2.320  14.908
  367   1HH1  ARG  49          2HH2      ARG  49  -6.236   4.962  13.372
  368   2HH1  ARG  49          1HH2      ARG  49  -5.280   5.396  14.764
  369   1HH2  ARG  49          2HH1      ARG  49  -6.716   2.831  16.787
  370   2HH2  ARG  49          1HH1      ARG  49  -5.565   4.126  16.769
  371    H    PHE  50           H        PHE  50  -7.566   2.044   7.405
  372    HA   PHE  50           HA       PHE  50  -9.634   0.031   7.270
  373   1HB   PHE  50          2HB       PHE  50  -9.463   2.277   6.014
  374   2HB   PHE  50          3HB       PHE  50  -8.384   1.447   4.897
  375    HD1  PHE  50           1HD      PHE  50 -11.806   1.380   6.417
  376    HD2  PHE  50           2HD      PHE  50  -9.327   0.084   3.130
  377    HE1  PHE  50           1HE      PHE  50 -13.798   0.471   5.274
  378    HE2  PHE  50           2HE      PHE  50 -11.337  -0.807   1.975
  379    HZ   PHE  50           HZ       PHE  50 -13.559  -0.685   3.084
  380    H    ILE  51           H        ILE  51  -6.192   0.140   6.445
  381    HA   ILE  51           HA       ILE  51  -6.286  -2.343   4.923
  382    HB   ILE  51           HB       ILE  51  -3.818  -1.040   6.097
  383   1HG1  ILE  51          2HG1      ILE  51  -4.388   0.752   4.860
  384   2HG1  ILE  51          3HG1      ILE  51  -3.486  -0.163   3.698
  385   1HG2  ILE  51          1HG2      ILE  51  -4.331  -2.952   3.777
  386   2HG2  ILE  51          2HG2      ILE  51  -2.741  -2.243   4.152
  387   3HG2  ILE  51          3HG2      ILE  51  -3.520  -3.350   5.281
  388   1HD1  ILE  51          1HD1      ILE  51  -5.638  -0.987   2.683
  389   2HD1  ILE  51          2HD1      ILE  51  -6.535   0.049   3.808
  390   3HD1  ILE  51          3HD1      ILE  51  -5.427   0.782   2.662
  391    H    ASP  52           H        ASP  52  -5.099  -1.427   8.220
  392    HA   ASP  52           HA       ASP  52  -4.210  -4.097   8.845
  393   1HB   ASP  52          2HB       ASP  52  -3.381  -1.936   9.917
  394   2HB   ASP  52          3HB       ASP  52  -4.863  -1.907  10.862
  395    H    ASN  53           H        ASN  53  -6.169  -5.093   8.037
  396    HA   ASN  53           HA       ASN  53  -8.748  -4.709   8.946
  397   1HB   ASN  53          2HB       ASN  53  -7.946  -5.941   6.913
  398   2HB   ASN  53          3HB       ASN  53  -7.549  -7.329   7.931
  399   1HD2  ASN  53          1HD2      ASN  53  -9.443  -8.369   9.123
  400   2HD2  ASN  53          2HD2      ASN  53 -11.013  -8.275   8.353
  401    H    ASP  54           H        ASP  54  -6.191  -6.653  10.394
  402    HA   ASP  54           HA       ASP  54  -7.832  -7.986  12.416
  403   1HB   ASP  54          2HB       ASP  54  -5.559  -8.543  13.302
  404   2HB   ASP  54          3HB       ASP  54  -5.683  -8.962  11.586
  405    H    GLN  55           H        GLN  55  -6.178  -4.905  12.047
  406    HA   GLN  55           HA       GLN  55  -5.904  -3.175  13.448
  407   1HB   GLN  55          2HB       GLN  55  -8.100  -2.755  13.350
  408   2HB   GLN  55          3HB       GLN  55  -8.610  -4.215  14.200
  409   1HG   GLN  55          2HG       GLN  55  -8.153  -3.399  16.267
  410   2HG   GLN  55          3HG       GLN  55  -6.986  -2.177  15.694
  411   1HE2  GLN  55          1HE2      GLN  55 -10.479  -3.011  15.394
  412   2HE2  GLN  55          2HE2      GLN  55 -11.038  -1.346  15.453
  413    H    SER  56           H        SER  56  -3.945  -4.048  14.100
  414    HA   SER  56           HA       SER  56  -3.852  -4.919  17.006
  415   1HB   SER  56          2HB       SER  56  -1.575  -5.879  16.289
  416   2HB   SER  56          3HB       SER  56  -3.013  -6.763  15.742
  417    HG   SER  56           HG       SER  56  -2.793  -6.072  13.783
  418    H    GLY  57           H        GLY  57  -1.733  -3.816  14.576
  419   1HA   GLY  57          1HA       GLY  57  -1.269  -1.171  14.722
  420   2HA   GLY  57          2HA       GLY  57  -0.502  -1.669  16.241
  421    H    TYR  58           H        TYR  58  -0.515  -3.497  13.116
  422    HA   TYR  58           HA       TYR  58   2.149  -2.884  12.385
  423   1HB   TYR  58          2HB       TYR  58   1.602  -5.508  13.805
  424   2HB   TYR  58          3HB       TYR  58   2.832  -5.361  12.560
  425    HD1  TYR  58           HD1      TYR  58   4.631  -3.477  12.819
  426    HD2  TYR  58           HD2      TYR  58   2.306  -5.090  16.070
  427    HE1  TYR  58           HE1      TYR  58   6.279  -2.591  14.427
  428    HE2  TYR  58           HE2      TYR  58   3.999  -4.265  17.675
  429    HH   TYR  58           HH       TYR  58   5.962  -3.076  17.953
  430    H    LEU  59           H        LEU  59   2.166  -3.174  10.260
  431    HA   LEU  59           HA       LEU  59   0.049  -4.722   8.843
  432   1HB   LEU  59          2HB       LEU  59   2.021  -2.560   8.058
  433   2HB   LEU  59          3HB       LEU  59   1.418  -3.685   6.841
  434    HG   LEU  59           HG       LEU  59   0.193  -1.470   7.070
  435   1HD1  LEU  59          1HD1      LEU  59  -1.430  -4.051   7.275
  436   2HD1  LEU  59          2HD1      LEU  59  -2.020  -2.473   6.730
  437   3HD1  LEU  59          3HD1      LEU  59  -0.767  -3.316   5.797
  438   1HD2  LEU  59          1HD2      LEU  59   0.072  -1.566   9.588
  439   2HD2  LEU  59          2HD2      LEU  59  -1.462  -1.193   8.765
  440   3HD2  LEU  59          3HD2      LEU  59  -1.182  -2.809   9.433
  441    H    ASP  60           H        ASP  60   0.905  -6.508   9.973
  442    HA   ASP  60           HA       ASP  60   3.481  -7.601   9.710
  443   1HB   ASP  60          2HB       ASP  60   0.954  -9.274   9.687
  444   2HB   ASP  60          3HB       ASP  60   2.501  -9.565  10.507
  445    H    GLU  61           H        GLU  61   4.493  -8.719   7.952
  446    HA   GLU  61           HA       GLU  61   3.997  -7.761   5.482
  447   1HB   GLU  61          2HB       GLU  61   5.239 -10.478   5.966
  448   2HB   GLU  61          3HB       GLU  61   5.402  -9.435   4.539
  449   1HG   GLU  61          2HG       GLU  61   7.231  -8.641   5.609
  450   2HG   GLU  61          3HG       GLU  61   6.092  -7.644   6.492
  451    H    GLU  62           H        GLU  62   2.784 -10.909   6.642
  452    HA   GLU  62           HA       GLU  62   1.791 -11.848   4.187
  453   1HB   GLU  62          2HB       GLU  62   2.175 -13.190   6.236
  454   2HB   GLU  62          3HB       GLU  62   0.714 -12.503   6.969
  455   1HG   GLU  62          2HG       GLU  62  -0.691 -13.585   5.359
  456   2HG   GLU  62          3HG       GLU  62   0.665 -13.900   4.261
  457    H    GLU  63           H        GLU  63   0.359  -9.475   6.425
  458    HA   GLU  63           HA       GLU  63  -2.301  -9.586   5.302
  459   1HB   GLU  63          2HB       GLU  63  -0.834  -7.346   6.737
  460   2HB   GLU  63          3HB       GLU  63  -2.577  -7.431   6.455
  461   1HG   GLU  63          2HG       GLU  63  -2.779  -9.453   7.812
  462   2HG   GLU  63          3HG       GLU  63  -1.022  -9.549   8.042
  463    H    LEU  64           H        LEU  64   0.746  -7.943   4.425
  464    HA   LEU  64           HA       LEU  64  -0.496  -6.110   2.575
  465   1HB   LEU  64          2HB       LEU  64   2.361  -7.116   2.664
  466   2HB   LEU  64          3HB       LEU  64   1.765  -5.816   1.640
  467    HG   LEU  64           HG       LEU  64   1.623  -5.756   4.696
  468   1HD1  LEU  64          1HD1      LEU  64   3.495  -4.168   4.529
  469   2HD1  LEU  64          2HD1      LEU  64   3.933  -5.786   3.946
  470   3HD1  LEU  64          3HD1      LEU  64   3.615  -4.482   2.780
  471   1HD2  LEU  64          1HD2      LEU  64   1.308  -3.276   4.264
  472   2HD2  LEU  64          2HD2      LEU  64   1.095  -3.650   2.543
  473   3HD2  LEU  64          3HD2      LEU  64  -0.053  -4.271   3.747
  474    H    LYS  65           H        LYS  65   0.426  -9.500   2.426
  475    HA   LYS  65           HA       LYS  65   0.203  -9.785  -0.414
  476   1HB   LYS  65          2HB       LYS  65   1.229 -11.410   1.207
  477   2HB   LYS  65          3HB       LYS  65  -0.413 -11.890   1.685
  478   1HG   LYS  65          2HG       LYS  65  -0.931 -12.749  -0.449
  479   2HG   LYS  65          3HG       LYS  65   0.511 -12.029  -1.192
  480   1HD   LYS  65          2HD       LYS  65   1.992 -13.481  -0.031
  481   2HD   LYS  65          3HD       LYS  65   0.717 -14.055   1.071
  482   1HE   LYS  65          2HE       LYS  65  -0.420 -15.242  -0.662
  483   2HE   LYS  65          3HE       LYS  65   0.510 -14.448  -1.948
  484   1HZ   LYS  65          1HZ       LYS  65   1.789 -16.251  -0.005
  485   2HZ   LYS  65          2HZ       LYS  65   1.214 -16.726  -1.480
  486   3HZ   LYS  65          3HZ       LYS  65   2.397 -15.646  -1.425
  487    H    PHE  66           H        PHE  66  -2.206  -8.830   1.838
  488    HA   PHE  66           HA       PHE  66  -4.166  -9.065  -0.346
  489   1HB   PHE  66          2HB       PHE  66  -4.419 -10.901   1.492
  490   2HB   PHE  66          3HB       PHE  66  -4.973  -9.593   2.527
  491    HD1  PHE  66           1HD      PHE  66  -5.602 -11.501  -0.613
  492    HD2  PHE  66           2HD      PHE  66  -7.258  -8.731   2.242
  493    HE1  PHE  66           1HE      PHE  66  -7.839 -11.753  -1.663
  494    HE2  PHE  66           2HE      PHE  66  -9.499  -9.003   1.201
  495    HZ   PHE  66           HZ       PHE  66  -9.786 -10.501  -0.761
  496    H    PHE  67           H        PHE  67  -2.428  -6.863   0.424
  497    HA   PHE  67           HA       PHE  67  -4.051  -5.010   2.005
  498   1HB   PHE  67          2HB       PHE  67  -1.882  -4.484   2.260
  499   2HB   PHE  67          3HB       PHE  67  -1.426  -4.921   0.608
  500    HD1  PHE  67           1HD      PHE  67  -4.030  -2.410   1.701
  501    HD2  PHE  67           2HD      PHE  67  -0.269  -3.123  -0.270
  502    HE1  PHE  67           1HE      PHE  67  -3.872  -0.022   1.141
  503    HE2  PHE  67           2HE      PHE  67  -0.153  -0.728  -0.873
  504    HZ   PHE  67           HZ       PHE  67  -1.929   0.845  -0.128
  505    H    LEU  68           H        LEU  68  -2.847  -4.478  -1.320
  506    HA   LEU  68           HA       LEU  68  -4.769  -2.496  -1.833
  507   1HB   LEU  68          2HB       LEU  68  -2.479  -3.006  -2.773
  508   2HB   LEU  68          3HB       LEU  68  -3.277  -4.129  -3.852
  509    HG   LEU  68           HG       LEU  68  -3.549  -1.121  -3.790
  510   1HD1  LEU  68          1HD1      LEU  68  -1.321  -1.905  -4.440
  511   2HD1  LEU  68          2HD1      LEU  68  -2.006  -3.130  -5.513
  512   3HD1  LEU  68          3HD1      LEU  68  -2.172  -1.430  -5.934
  513   1HD2  LEU  68          1HD2      LEU  68  -4.330  -2.844  -6.167
  514   2HD2  LEU  68          2HD2      LEU  68  -5.545  -2.324  -4.990
  515   3HD2  LEU  68          3HD2      LEU  68  -4.624  -1.131  -5.898
  516    H    GLN  69           H        GLN  69  -5.073  -5.969  -2.112
  517    HA   GLN  69           HA       GLN  69  -7.321  -6.334  -3.782
  518   1HB   GLN  69          2HB       GLN  69  -6.583  -7.560  -1.084
  519   2HB   GLN  69          3HB       GLN  69  -7.922  -8.133  -2.079
  520   1HG   GLN  69          2HG       GLN  69  -5.020  -8.035  -2.998
  521   2HG   GLN  69          3HG       GLN  69  -5.828  -9.468  -2.377
  522   1HE2  GLN  69          1HE2      GLN  69  -4.688  -8.656  -5.170
  523   2HE2  GLN  69          2HE2      GLN  69  -6.028  -9.001  -6.247
  524    H    LYS  70           H        LYS  70  -7.188  -4.870  -0.476
  525    HA   LYS  70           HA       LYS  70 -10.009  -4.692  -0.067
  526   1HB   LYS  70          2HB       LYS  70  -7.597  -3.432   1.147
  527   2HB   LYS  70          3HB       LYS  70  -8.916  -2.298   0.967
  528   1HG   LYS  70          2HG       LYS  70  -9.242  -3.168   3.073
  529   2HG   LYS  70          3HG       LYS  70 -10.442  -3.975   2.042
  530   1HD   LYS  70          2HD       LYS  70  -8.424  -5.792   1.838
  531   2HD   LYS  70          3HD       LYS  70  -7.928  -5.066   3.364
  532   1HE   LYS  70          2HE       LYS  70 -10.584  -6.389   2.667
  533   2HE   LYS  70          3HE       LYS  70  -9.376  -7.005   3.803
  534   1HZ   LYS  70          1HZ       LYS  70  -9.919  -5.273   5.314
  535   2HZ   LYS  70          2HZ       LYS  70 -10.882  -4.485   4.220
  536   3HZ   LYS  70          3HZ       LYS  70 -11.291  -5.949   4.864
  537    H    PHE  71           H        PHE  71  -7.780  -2.782  -2.022
  538    HA   PHE  71           HA       PHE  71  -9.686  -0.608  -2.503
  539   1HB   PHE  71          2HB       PHE  71  -7.047  -1.209  -3.878
  540   2HB   PHE  71          3HB       PHE  71  -7.974   0.261  -3.927
  541    HD1  PHE  71           1HD      PHE  71  -5.227   0.528  -3.509
  542    HD2  PHE  71           2HD      PHE  71  -8.279  -0.280  -0.568
  543    HE1  PHE  71           1HE      PHE  71  -4.001   1.894  -1.853
  544    HE2  PHE  71           2HE      PHE  71  -7.029   1.026   1.083
  545    HZ   PHE  71           HZ       PHE  71  -4.939   2.215   0.430
  546    H    GLU  72           H        GLU  72  -8.107  -3.270  -4.374
  547    HA   GLU  72           HA       GLU  72 -10.417  -3.403  -6.153
  548   1HB   GLU  72          2HB       GLU  72  -8.461  -1.641  -6.926
  549   2HB   GLU  72          3HB       GLU  72  -7.801  -3.129  -7.605
  550   1HG   GLU  72          2HG       GLU  72 -10.590  -1.975  -8.101
  551   2HG   GLU  72          3HG       GLU  72  -9.230  -1.965  -9.237
  552    H    SER  73           H        SER  73 -10.616  -5.390  -7.091
  553    HA   SER  73           HA       SER  73  -9.377  -7.631  -5.749
  554   1HB   SER  73          2HB       SER  73 -11.711  -7.565  -6.693
  555   2HB   SER  73          3HB       SER  73 -11.011  -7.577  -8.321
  556    HG   SER  73           HG       SER  73  -9.883  -9.578  -7.470
  557    H    GLY  74           H        GLY  74  -8.665  -5.801  -8.658
  558   1HA   GLY  74          1HA       GLY  74  -7.020  -7.884  -9.944
  559   2HA   GLY  74          2HA       GLY  74  -7.458  -6.284 -10.561
  560    H    ALA  75           H        ALA  75  -6.410  -6.180  -7.298
  561    HA   ALA  75           HA       ALA  75  -4.020  -4.756  -7.740
  562   1HB   ALA  75          1HB       ALA  75  -5.286  -4.738  -5.633
  563   2HB   ALA  75          2HB       ALA  75  -5.001  -6.461  -5.409
  564   3HB   ALA  75          3HB       ALA  75  -3.623  -5.357  -5.389
  565    H    ARG  76           H        ARG  76  -1.871  -5.578  -6.728
  566    HA   ARG  76           HA       ARG  76  -1.080  -7.932  -8.335
  567   1HB   ARG  76          2HB       ARG  76   0.596  -5.941  -6.753
  568   2HB   ARG  76          3HB       ARG  76   1.163  -7.204  -7.854
  569   1HG   ARG  76          2HG       ARG  76  -0.430  -4.722  -8.575
  570   2HG   ARG  76          3HG       ARG  76   1.246  -5.076  -8.971
  571   1HD   ARG  76          2HD       ARG  76  -1.254  -6.441 -10.061
  572   2HD   ARG  76          3HD       ARG  76  -0.083  -5.448 -10.933
  573    HE   ARG  76           HE       ARG  76   1.317  -7.722  -9.844
  574   1HH1  ARG  76          2HH2      ARG  76  -0.982  -6.881 -12.348
  575   2HH1  ARG  76          1HH2      ARG  76  -0.398  -8.039 -13.476
  576   1HH2  ARG  76          2HH1      ARG  76   1.856  -9.394 -11.025
  577   2HH2  ARG  76          1HH1      ARG  76   1.053  -9.849 -12.534
  578    H    GLU  77           H        GLU  77  -1.367  -6.958  -4.993
  579    HA   GLU  77           HA       GLU  77   0.141  -7.995  -3.446
  580   1HB   GLU  77          2HB       GLU  77  -2.612  -9.040  -2.833
  581   2HB   GLU  77          3HB       GLU  77  -1.393  -8.304  -1.785
  582   1HG   GLU  77          2HG       GLU  77  -3.170  -6.896  -3.787
  583   2HG   GLU  77          3HG       GLU  77  -3.176  -6.771  -2.025
  584    H    LEU  78           H        LEU  78  -1.926 -10.250  -5.077
  585    HA   LEU  78           HA       LEU  78  -1.451 -12.721  -3.965
  586   1HB   LEU  78          2HB       LEU  78  -1.405 -12.366  -6.978
  587   2HB   LEU  78          3HB       LEU  78  -2.042 -13.675  -6.007
  588    HG   LEU  78           HG       LEU  78  -3.910 -12.721  -6.836
  589   1HD1  LEU  78          1HD1      LEU  78  -5.188 -11.691  -5.100
  590   2HD1  LEU  78          2HD1      LEU  78  -4.077 -12.850  -4.349
  591   3HD1  LEU  78          3HD1      LEU  78  -3.748 -11.106  -4.261
  592   1HD2  LEU  78          1HD2      LEU  78  -3.143  -9.833  -6.353
  593   2HD2  LEU  78          2HD2      LEU  78  -2.716 -10.714  -7.829
  594   3HD2  LEU  78          3HD2      LEU  78  -4.403 -10.507  -7.368
  595    H    THR  79           H        THR  79   0.549 -11.082  -6.538
  596    HA   THR  79           HA       THR  79   2.606 -13.114  -6.334
  597    HB   THR  79           HB       THR  79   3.325 -10.462  -7.409
  598    HG1  THR  79           1HG      THR  79   2.140 -10.377  -8.944
  599   1HG2  THR  79          1HG2      THR  79   4.807 -12.421  -7.663
  600   2HG2  THR  79          2HG2      THR  79   3.535 -13.264  -8.580
  601   3HG2  THR  79          3HG2      THR  79   4.281 -11.787  -9.230
  602    H    GLU  80           H        GLU  80   4.240 -13.078  -5.087
  603    HA   GLU  80           HA       GLU  80   4.419 -11.188  -2.946
  604   1HB   GLU  80          2HB       GLU  80   6.404 -13.375  -3.594
  605   2HB   GLU  80          3HB       GLU  80   6.270 -12.376  -2.120
  606   1HG   GLU  80          2HG       GLU  80   5.201 -14.365  -1.528
  607   2HG   GLU  80          3HG       GLU  80   3.883 -13.234  -1.864
  608    H    SER  81           H        SER  81   6.231 -11.532  -6.037
  609    HA   SER  81           HA       SER  81   8.339  -9.782  -5.491
  610   1HB   SER  81          2HB       SER  81   6.825 -10.109  -8.119
  611   2HB   SER  81          3HB       SER  81   8.458  -9.466  -7.919
  612    HG   SER  81           HG       SER  81   9.144 -11.462  -7.275
  613    H    GLU  82           H        GLU  82   5.347  -8.716  -7.306
  614    HA   GLU  82           HA       GLU  82   5.679  -6.037  -6.988
  615   1HB   GLU  82          2HB       GLU  82   3.074  -7.613  -6.806
  616   2HB   GLU  82          3HB       GLU  82   3.186  -5.866  -7.055
  617   1HG   GLU  82          2HG       GLU  82   2.971  -6.512  -9.250
  618   2HG   GLU  82          3HG       GLU  82   4.730  -6.589  -9.129
  619    H    THR  83           H        THR  83   3.919  -8.138  -4.601
  620    HA   THR  83           HA       THR  83   3.251  -5.946  -3.017
  621    HB   THR  83           HB       THR  83   2.429  -8.440  -2.976
  622    HG1  THR  83           1HG      THR  83   1.630  -7.966  -0.844
  623   1HG2  THR  83          1HG2      THR  83   4.115  -8.469  -0.438
  624   2HG2  THR  83          2HG2      THR  83   3.055  -9.744  -1.072
  625   3HG2  THR  83          3HG2      THR  83   4.565  -9.353  -1.901
  626    H    LYS  84           H        LYS  84   6.103  -8.090  -2.887
  627    HA   LYS  84           HA       LYS  84   7.212  -6.994  -0.496
  628   1HB   LYS  84          2HB       LYS  84   8.462  -8.571  -2.759
  629   2HB   LYS  84          3HB       LYS  84   9.371  -8.043  -1.350
  630   1HG   LYS  84          2HG       LYS  84   6.788  -9.544  -0.899
  631   2HG   LYS  84          3HG       LYS  84   8.234 -10.434  -1.385
  632   1HD   LYS  84          2HD       LYS  84   9.480  -9.670   0.524
  633   2HD   LYS  84          3HD       LYS  84   8.215  -8.516   0.986
  634   1HE   LYS  84          2HE       LYS  84   6.649 -10.307   1.512
  635   2HE   LYS  84          3HE       LYS  84   7.761 -11.534   0.883
  636   1HZ   LYS  84          1HZ       LYS  84   9.271 -11.003   2.674
  637   2HZ   LYS  84          2HZ       LYS  84   8.245  -9.860   3.270
  638   3HZ   LYS  84          3HZ       LYS  84   7.805 -11.433   3.271
  639    H    SER  85           H        SER  85   7.299  -5.994  -3.894
  640    HA   SER  85           HA       SER  85   9.356  -4.078  -3.701
  641   1HB   SER  85          2HB       SER  85   7.652  -4.772  -5.683
  642   2HB   SER  85          3HB       SER  85   6.868  -3.277  -5.144
  643    HG   SER  85           HG       SER  85   8.440  -2.991  -6.774
  644    H    LEU  86           H        LEU  86   5.919  -3.873  -2.613
  645    HA   LEU  86           HA       LEU  86   6.156  -1.166  -1.584
  646   1HB   LEU  86          2HB       LEU  86   3.997  -2.227  -2.109
  647   2HB   LEU  86          3HB       LEU  86   4.183  -3.340  -0.771
  648    HG   LEU  86           HG       LEU  86   4.621  -0.549   0.085
  649   1HD1  LEU  86          1HD1      LEU  86   3.064  -0.021  -1.716
  650   2HD1  LEU  86          2HD1      LEU  86   1.967  -1.307  -1.180
  651   3HD1  LEU  86          3HD1      LEU  86   2.228   0.128  -0.156
  652   1HD2  LEU  86          1HD2      LEU  86   4.213  -2.426   1.638
  653   2HD2  LEU  86          2HD2      LEU  86   2.968  -1.180   1.797
  654   3HD2  LEU  86          3HD2      LEU  86   2.607  -2.678   0.916
  655    H    MET  87           H        MET  87   6.031  -4.386  -0.032
  656    HA   MET  87           HA       MET  87   6.439  -3.649   2.564
  657   1HB   MET  87          2HB       MET  87   5.995  -5.963   1.537
  658   2HB   MET  87          3HB       MET  87   7.757  -6.127   1.406
  659   1HG   MET  87          2HG       MET  87   6.225  -5.633   3.964
  660   2HG   MET  87          3HG       MET  87   6.772  -7.210   3.422
  661   1HE   MET  87          1HE       MET  87  10.649  -6.950   3.902
  662   2HE   MET  87          2HE       MET  87   9.293  -8.034   3.540
  663   3HE   MET  87          3HE       MET  87   9.749  -6.747   2.384
  664    H    ALA  88           H        ALA  88   9.018  -4.635   0.364
  665    HA   ALA  88           HA       ALA  88  11.354  -4.430   1.708
  666   1HB   ALA  88          1HB       ALA  88  11.203  -5.129  -0.632
  667   2HB   ALA  88          2HB       ALA  88  10.712  -3.504  -1.135
  668   3HB   ALA  88          3HB       ALA  88  12.352  -3.784  -0.512
  669    H    ALA  89           H        ALA  89   9.627  -1.647   0.217
  670    HA   ALA  89           HA       ALA  89  11.724   0.201   1.162
  671   1HB   ALA  89          1HB       ALA  89   9.103   0.792  -0.244
  672   2HB   ALA  89          2HB       ALA  89  10.505   1.874  -0.054
  673   3HB   ALA  89          3HB       ALA  89  10.657   0.426  -1.042
  674    H    ALA  90           H        ALA  90   8.232  -0.400   1.746
  675    HA   ALA  90           HA       ALA  90   7.675   1.591   3.664
  676   1HB   ALA  90          1HB       ALA  90   5.892   0.045   4.393
  677   2HB   ALA  90          2HB       ALA  90   5.977   0.163   2.614
  678   3HB   ALA  90          3HB       ALA  90   6.646  -1.256   3.449
  679    H    ASP  91           H        ASP  91   9.195  -1.623   4.153
  680    HA   ASP  91           HA       ASP  91   9.185  -1.354   7.013
  681   1HB   ASP  91          2HB       ASP  91   9.209  -3.557   5.886
  682   2HB   ASP  91          3HB       ASP  91  10.830  -3.229   5.265
  683    H    ASN  92           H        ASN  92  10.120   0.765   7.266
  684    HA   ASN  92           HA       ASN  92  12.854   1.330   6.405
  685   1HB   ASN  92          2HB       ASN  92  11.197   2.785   8.500
  686   2HB   ASN  92          3HB       ASN  92  12.685   3.356   7.745
  687   1HD2  ASN  92          1HD2      ASN  92   9.247   2.945   7.322
  688   2HD2  ASN  92          2HD2      ASN  92   9.124   3.868   5.854
  689    H    ASP  93           H        ASP  93  12.788  -1.143   7.821
  690    HA   ASP  93           HA       ASP  93  14.548  -0.525  10.158
  691   1HB   ASP  93          2HB       ASP  93  12.490  -2.761   9.864
  692   2HB   ASP  93          3HB       ASP  93  13.869  -2.866  10.953
  693    H    GLY  94           H        GLY  94  13.485  -3.015   7.798
  694   1HA   GLY  94          1HA       GLY  94  14.875  -4.405   6.467
  695   2HA   GLY  94          2HA       GLY  94  16.279  -4.028   7.482
  696    H    ASP  95           H        ASP  95  12.895  -4.844   8.329
  697    HA   ASP  95           HA       ASP  95  13.799  -7.371   9.629
  698   1HB   ASP  95          2HB       ASP  95  12.759  -7.033  11.578
  699   2HB   ASP  95          3HB       ASP  95  13.135  -5.345  11.240
  700    H    GLY  96           H        GLY  96  10.878  -5.571   8.493
  701   1HA   GLY  96          1HA       GLY  96   9.822  -6.871   6.517
  702   2HA   GLY  96          2HA       GLY  96   9.657  -8.171   7.698
  703    H    LYS  97           H        LYS  97   8.930  -7.001  10.040
  704    HA   LYS  97           HA       LYS  97   6.123  -6.556   9.564
  705   1HB   LYS  97          2HB       LYS  97   7.897  -6.227  12.010
  706   2HB   LYS  97          3HB       LYS  97   6.138  -6.060  12.046
  707   1HG   LYS  97          2HG       LYS  97   5.765  -8.285  11.960
  708   2HG   LYS  97          3HG       LYS  97   6.985  -8.556  10.710
  709   1HD   LYS  97          2HD       LYS  97   8.789  -8.529  12.264
  710   2HD   LYS  97          3HD       LYS  97   7.732  -8.043  13.609
  711   1HE   LYS  97          2HE       LYS  97   6.532 -10.158  13.535
  712   2HE   LYS  97          3HE       LYS  97   7.337 -10.632  12.026
  713   1HZ   LYS  97          1HZ       LYS  97   9.394 -10.758  13.182
  714   2HZ   LYS  97          2HZ       LYS  97   8.720 -10.240  14.594
  715   3HZ   LYS  97          3HZ       LYS  97   8.288 -11.699  13.960
  716    H    ILE  98           H        ILE  98   5.334  -4.699   8.738
  717    HA   ILE  98           HA       ILE  98   6.677  -2.090   9.242
  718    HB   ILE  98           HB       ILE  98   4.491  -3.089   7.403
  719   1HG1  ILE  98          2HG1      ILE  98   6.900  -1.563   6.490
  720   2HG1  ILE  98          3HG1      ILE  98   7.232  -3.165   7.150
  721   1HG2  ILE  98          1HG2      ILE  98   5.399  -0.206   7.781
  722   2HG2  ILE  98          2HG2      ILE  98   4.432  -0.806   6.420
  723   3HG2  ILE  98          3HG2      ILE  98   3.767  -0.861   8.057
  724   1HD1  ILE  98          1HD1      ILE  98   6.914  -3.310   4.770
  725   2HD1  ILE  98          2HD1      ILE  98   5.634  -4.191   5.631
  726   3HD1  ILE  98          3HD1      ILE  98   5.282  -2.604   4.896
  727    H    GLY  99           H        GLY  99   5.525  -0.414  10.296
  728   1HA   GLY  99          1HA       GLY  99   2.940  -1.077  11.622
  729   2HA   GLY  99          2HA       GLY  99   4.254  -0.297  12.526
  730    H    ALA 100           H        ALA 100   2.196   1.262  12.623
  731    HA   ALA 100           HA       ALA 100   1.348   2.547  10.223
  732   1HB   ALA 100          1HB       ALA 100   0.144   4.033  11.588
  733   2HB   ALA 100          2HB       ALA 100   0.100   2.489  12.458
  734   3HB   ALA 100          3HB       ALA 100   1.207   3.765  12.998
  735    H    GLU 101           H        GLU 101   3.765   3.404  12.722
  736    HA   GLU 101           HA       GLU 101   4.443   5.888  11.608
  737   1HB   GLU 101          2HB       GLU 101   5.769   4.005  13.546
  738   2HB   GLU 101          3HB       GLU 101   6.724   5.340  12.878
  739   1HG   GLU 101          2HG       GLU 101   5.233   7.001  13.660
  740   2HG   GLU 101          3HG       GLU 101   3.926   5.846  13.966
  741    H    GLU 102           H        GLU 102   6.391   2.836  11.210
  742    HA   GLU 102           HA       GLU 102   8.001   3.620   9.135
  743   1HB   GLU 102          2HB       GLU 102   6.539   0.995   9.559
  744   2HB   GLU 102          3HB       GLU 102   7.711   1.209   8.266
  745   1HG   GLU 102          2HG       GLU 102   9.467   1.768   9.905
  746   2HG   GLU 102          3HG       GLU 102   8.326   1.498  11.231
  747    H    PHE 103           H        PHE 103   4.611   2.421   8.757
  748    HA   PHE 103           HA       PHE 103   4.684   2.449   5.910
  749   1HB   PHE 103          2HB       PHE 103   3.009   1.210   7.254
  750   2HB   PHE 103          3HB       PHE 103   2.299   2.726   7.785
  751    HD1  PHE 103           1HD      PHE 103   0.384   3.471   6.591
  752    HD2  PHE 103           2HD      PHE 103   3.272   0.979   4.570
  753    HE1  PHE 103           1HE      PHE 103  -1.112   3.323   4.621
  754    HE2  PHE 103           2HE      PHE 103   1.802   0.902   2.578
  755    HZ   PHE 103           HZ       PHE 103  -0.410   2.030   2.613
  756    H    GLN 104           H        GLN 104   3.385   4.834   8.255
  757    HA   GLN 104           HA       GLN 104   2.527   6.751   6.325
  758   1HB   GLN 104          2HB       GLN 104   1.772   6.576   8.687
  759   2HB   GLN 104          3HB       GLN 104   3.344   7.205   9.221
  760   1HG   GLN 104          2HG       GLN 104   2.914   9.297   7.948
  761   2HG   GLN 104          3HG       GLN 104   1.409   8.619   7.320
  762   1HE2  GLN 104          1HE2      GLN 104   3.037   9.741  10.291
  763   2HE2  GLN 104          2HE2      GLN 104   1.551  10.054  11.169
  764    H    GLU 105           H        GLU 105   5.648   6.453   8.150
  765    HA   GLU 105           HA       GLU 105   6.947   8.745   7.199
  766   1HB   GLU 105          2HB       GLU 105   7.968   5.930   7.819
  767   2HB   GLU 105          3HB       GLU 105   9.037   7.237   7.324
  768   1HG   GLU 105          2HG       GLU 105   8.309   8.634   9.220
  769   2HG   GLU 105          3HG       GLU 105   7.240   7.341   9.785
  770    H    MET 106           H        MET 106   7.005   5.449   5.739
  771    HA   MET 106           HA       MET 106   8.461   6.398   3.462
  772   1HB   MET 106          2HB       MET 106   7.384   3.864   4.430
  773   2HB   MET 106          3HB       MET 106   7.138   3.996   2.699
  774   1HG   MET 106          2HG       MET 106   9.859   4.724   3.841
  775   2HG   MET 106          3HG       MET 106   9.368   3.055   3.736
  776   1HE   MET 106          1HE       MET 106   9.013   6.180   1.199
  777   2HE   MET 106          2HE       MET 106  10.693   6.126   1.783
  778   3HE   MET 106          3HE       MET 106  10.315   5.710   0.096
  779    H    VAL 107           H        VAL 107   4.971   5.662   3.855
  780    HA   VAL 107           HA       VAL 107   4.169   6.356   1.241
  781    HB   VAL 107           HB       VAL 107   2.727   6.495   3.905
  782   1HG1  VAL 107          1HG1      VAL 107   1.663   6.987   1.104
  783   2HG1  VAL 107          2HG1      VAL 107   0.627   6.583   2.494
  784   3HG1  VAL 107          3HG1      VAL 107   1.560   8.082   2.499
  785   1HG2  VAL 107          1HG2      VAL 107   1.651   4.465   3.104
  786   2HG2  VAL 107          2HG2      VAL 107   2.448   4.598   1.523
  787   3HG2  VAL 107          3HG2      VAL 107   3.398   4.220   2.965
  788    H    HIS 108           H        HIS 108   4.878   8.479   4.035
  789    HA   HIS 108           HA       HIS 108   3.698  10.827   2.937
  790   1HB   HIS 108          2HB       HIS 108   4.045  10.540   5.315
  791   2HB   HIS 108          3HB       HIS 108   5.793  10.366   5.091
  792    HD1  HIS 108           1HD      HIS 108   3.677  13.228   3.582
  793    HD2  HIS 108           2HD      HIS 108   6.564  12.406   6.532
  794    HE1  HIS 108           1HE      HIS 108   4.359  15.478   4.596
  795    H    SER 109           H        SER 109   6.605   9.076   2.250
  796    HA   SER 109           HA       SER 109   8.250  11.265   1.496
  797   1HB   SER 109          2HB       SER 109   8.926   8.857   2.142
  798   2HB   SER 109          3HB       SER 109   8.491   8.422   0.473
  799    HG   SER 109           HG       SER 109  10.323  10.487   1.104
  Start of MODEL   18
    1   1H    MET   1           H1       MET   1 -18.012   8.872   4.154
    2   2H    MET   1           H2       MET   1 -19.426   8.377   3.425
    3   3H    MET   1           H3       MET   1 -18.506   7.332   4.354
    4    HA   MET   1           HA       MET   1 -18.309   7.021   1.912
    5   1HB   MET   1          2HB       MET   1 -16.528   9.473   2.404
    6   2HB   MET   1          3HB       MET   1 -16.502   8.479   0.944
    7   1HG   MET   1          2HG       MET   1 -18.906  10.091   1.857
    8   2HG   MET   1          3HG       MET   1 -17.776  10.512   0.565
    9   1HE   MET   1          1HE       MET   1 -19.942  10.893  -0.928
   10   2HE   MET   1          2HE       MET   1 -21.083   9.595  -1.347
   11   3HE   MET   1          3HE       MET   1 -21.061  10.252   0.308
   12    H    SER   2           H        SER   2 -15.797   6.539   1.227
   13    HA   SER   2           HA       SER   2 -13.981   6.241   3.328
   14   1HB   SER   2          2HB       SER   2 -15.322   4.203   3.906
   15   2HB   SER   2          3HB       SER   2 -15.128   3.618   2.244
   16    HG   SER   2           HG       SER   2 -13.167   3.915   4.269
   17    H    ILE   3           H        ILE   3 -12.263   4.561   2.136
   18    HA   ILE   3           HA       ILE   3 -10.961   6.100   0.234
   19    HB   ILE   3           HB       ILE   3  -9.685   4.000  -0.290
   20   1HG1  ILE   3          2HG1      ILE   3 -11.150   2.579   1.950
   21   2HG1  ILE   3          3HG1      ILE   3 -11.841   2.447   0.335
   22   1HG2  ILE   3          1HG2      ILE   3  -9.202   5.538   1.577
   23   2HG2  ILE   3          2HG2      ILE   3 -10.256   4.590   2.645
   24   3HG2  ILE   3          3HG2      ILE   3  -8.770   3.867   2.008
   25   1HD1  ILE   3          1HD1      ILE   3  -9.908   1.510  -0.582
   26   2HD1  ILE   3          2HD1      ILE   3  -8.930   1.837   0.860
   27   3HD1  ILE   3          3HD1      ILE   3 -10.232   0.620   0.909
   28    H    THR   4           H        THR   4 -13.309   3.555  -0.387
   29    HA   THR   4           HA       THR   4 -13.187   3.107  -3.009
   30    HB   THR   4           HB       THR   4 -14.404   1.899  -1.183
   31    HG1  THR   4           1HG      THR   4 -15.094   2.554  -3.602
   32   1HG2  THR   4          1HG2      THR   4 -16.581   4.019  -1.548
   33   2HG2  THR   4          2HG2      THR   4 -16.640   2.576  -0.526
   34   3HG2  THR   4          3HG2      THR   4 -15.544   3.909  -0.110
   35    H    ASP   5           H        ASP   5 -14.443   6.031  -1.447
   36    HA   ASP   5           HA       ASP   5 -14.915   7.205  -4.061
   37   1HB   ASP   5          2HB       ASP   5 -17.078   6.009  -3.489
   38   2HB   ASP   5          3HB       ASP   5 -17.222   7.053  -2.062
   39    H    VAL   6           H        VAL   6 -12.942   7.799  -2.419
   40    HA   VAL   6           HA       VAL   6 -13.619  10.505  -1.291
   41    HB   VAL   6           HB       VAL   6 -11.701   8.324  -0.447
   42   1HG1  VAL   6          1HG1      VAL   6 -10.181  10.211  -0.563
   43   2HG1  VAL   6          2HG1      VAL   6 -11.372  11.276   0.221
   44   3HG1  VAL   6          3HG1      VAL   6 -10.623   9.939   1.122
   45   1HG2  VAL   6          1HG2      VAL   6 -14.048   8.717   0.503
   46   2HG2  VAL   6          2HG2      VAL   6 -12.724   8.665   1.692
   47   3HG2  VAL   6          3HG2      VAL   6 -13.428  10.220   1.191
   48    H    LEU   7           H        LEU   7 -11.015   8.640  -2.815
   49    HA   LEU   7           HA       LEU   7 -10.432  10.576  -4.881
   50   1HB   LEU   7          2HB       LEU   7  -9.377  11.798  -2.979
   51   2HB   LEU   7          3HB       LEU   7  -8.556  10.329  -2.477
   52    HG   LEU   7           HG       LEU   7  -7.613  10.519  -5.065
   53   1HD1  LEU   7          1HD1      LEU   7  -8.807  12.659  -5.445
   54   2HD1  LEU   7          2HD1      LEU   7  -7.929  13.380  -4.077
   55   3HD1  LEU   7          3HD1      LEU   7  -7.043  12.840  -5.519
   56   1HD2  LEU   7          1HD2      LEU   7  -5.572  11.455  -4.069
   57   2HD2  LEU   7          2HD2      LEU   7  -6.476  11.848  -2.591
   58   3HD2  LEU   7          3HD2      LEU   7  -6.253  10.155  -3.076
   59    H    SER   8           H        SER   8  -8.897   8.244  -2.671
   60    HA   SER   8           HA       SER   8  -7.117   7.233  -4.256
   61   1HB   SER   8          2HB       SER   8  -8.665   5.831  -2.035
   62   2HB   SER   8          3HB       SER   8  -7.110   5.254  -2.675
   63    HG   SER   8           HG       SER   8  -6.166   7.144  -2.103
   64    H    ALA   9           H        ALA   9 -10.483   6.223  -4.508
   65    HA   ALA   9           HA       ALA   9 -10.202   3.850  -5.983
   66   1HB   ALA   9          1HB       ALA   9 -12.338   4.778  -5.218
   67   2HB   ALA   9          2HB       ALA   9 -12.206   6.115  -6.380
   68   3HB   ALA   9          3HB       ALA   9 -12.389   4.442  -6.960
   69    H    ASP  10           H        ASP  10  -9.823   7.235  -7.113
   70    HA   ASP  10           HA       ASP  10  -9.436   6.492  -9.900
   71   1HB   ASP  10          2HB       ASP  10 -10.243   8.723  -9.169
   72   2HB   ASP  10          3HB       ASP  10  -8.683   9.024  -8.377
   73    H    ASP  11           H        ASP  11  -7.416   6.923  -7.026
   74    HA   ASP  11           HA       ASP  11  -4.901   7.075  -8.357
   75   1HB   ASP  11          2HB       ASP  11  -4.007   7.266  -6.385
   76   2HB   ASP  11          3HB       ASP  11  -5.615   7.576  -5.819
   77    H    ILE  12           H        ILE  12  -6.680   4.328  -6.818
   78    HA   ILE  12           HA       ILE  12  -4.730   2.497  -7.538
   79    HB   ILE  12           HB       ILE  12  -6.326   0.792  -7.147
   80   1HG1  ILE  12          2HG1      ILE  12  -8.408   2.755  -6.311
   81   2HG1  ILE  12          3HG1      ILE  12  -8.405   2.098  -7.959
   82   1HG2  ILE  12          1HG2      ILE  12  -6.496   1.175  -4.754
   83   2HG2  ILE  12          2HG2      ILE  12  -5.003   1.910  -5.343
   84   3HG2  ILE  12          3HG2      ILE  12  -6.404   2.933  -4.991
   85   1HD1  ILE  12          1HD1      ILE  12  -8.587  -0.168  -7.168
   86   2HD1  ILE  12          2HD1      ILE  12  -8.489   0.364  -5.480
   87   3HD1  ILE  12          3HD1      ILE  12  -9.890   0.817  -6.472
   88    H    ALA  13           H        ALA  13  -7.552   3.666  -9.344
   89    HA   ALA  13           HA       ALA  13  -7.429   1.851 -11.520
   90   1HB   ALA  13          1HB       ALA  13  -8.166   4.805 -11.639
   91   2HB   ALA  13          2HB       ALA  13  -8.553   3.563 -12.837
   92   3HB   ALA  13          3HB       ALA  13  -9.260   3.473 -11.212
   93    H    ALA  14           H        ALA  14  -5.653   4.956 -11.030
   94    HA   ALA  14           HA       ALA  14  -4.114   4.773 -13.433
   95   1HB   ALA  14          1HB       ALA  14  -4.305   6.839 -12.120
   96   2HB   ALA  14          2HB       ALA  14  -3.376   6.112 -10.793
   97   3HB   ALA  14          3HB       ALA  14  -2.607   6.384 -12.368
   98    H    ALA  15           H        ALA  15  -3.157   3.890 -10.067
   99    HA   ALA  15           HA       ALA  15  -0.627   2.893 -10.578
  100   1HB   ALA  15          1HB       ALA  15  -0.918   1.581  -8.522
  101   2HB   ALA  15          2HB       ALA  15  -1.495   3.250  -8.309
  102   3HB   ALA  15          3HB       ALA  15  -2.656   1.924  -8.532
  103    H    LEU  16           H        LEU  16  -3.674   1.171 -10.596
  104    HA   LEU  16           HA       LEU  16  -2.822  -1.442 -11.103
  105   1HB   LEU  16          2HB       LEU  16  -5.377   0.050 -11.607
  106   2HB   LEU  16          3HB       LEU  16  -5.126  -1.360 -12.598
  107    HG   LEU  16           HG       LEU  16  -4.906  -2.845 -10.759
  108   1HD1  LEU  16          1HD1      LEU  16  -3.865  -1.297  -9.048
  109   2HD1  LEU  16          2HD1      LEU  16  -5.465  -0.559  -8.835
  110   3HD1  LEU  16          3HD1      LEU  16  -5.221  -2.260  -8.446
  111   1HD2  LEU  16          1HD2      LEU  16  -7.226  -2.679  -9.899
  112   2HD2  LEU  16          2HD2      LEU  16  -7.311  -0.992 -10.446
  113   3HD2  LEU  16          3HD2      LEU  16  -7.158  -2.305 -11.630
  114    H    GLN  17           H        GLN  17  -3.117   1.253 -13.416
  115    HA   GLN  17           HA       GLN  17  -2.572  -0.556 -15.686
  116   1HB   GLN  17          2HB       GLN  17  -4.142   1.324 -15.880
  117   2HB   GLN  17          3HB       GLN  17  -2.831   2.480 -15.624
  118   1HG   GLN  17          2HG       GLN  17  -2.547   0.398 -17.825
  119   2HG   GLN  17          3HG       GLN  17  -3.680   1.727 -18.048
  120   1HE2  GLN  17          1HE2      GLN  17  -0.177   1.041 -17.449
  121   2HE2  GLN  17          2HE2      GLN  17   0.333   2.567 -18.156
  122    H    GLU  18           H        GLU  18  -0.963   2.045 -13.786
  123    HA   GLU  18           HA       GLU  18   1.257   2.101 -15.566
  124   1HB   GLU  18          2HB       GLU  18   2.001   3.887 -14.397
  125   2HB   GLU  18          3HB       GLU  18   0.279   3.914 -14.081
  126   1HG   GLU  18          2HG       GLU  18   0.877   4.237 -11.954
  127   2HG   GLU  18          3HG       GLU  18   1.059   2.477 -11.907
  128    H    CYS  19           H        CYS  19   0.698   0.245 -12.633
  129    HA   CYS  19           HA       CYS  19   3.264  -1.252 -13.072
  130   1HB   CYS  19          2HB       CYS  19   1.799  -0.680 -10.469
  131   2HB   CYS  19          3HB       CYS  19   3.057  -1.915 -10.708
  132    HG   CYS  19           HG       CYS  19   3.306   1.349 -11.033
  133    H    ARG  20           H        ARG  20   1.057  -1.749 -14.713
  134    HA   ARG  20           HA       ARG  20  -0.611  -3.874 -13.641
  135   1HB   ARG  20          2HB       ARG  20  -1.007  -2.433 -15.748
  136   2HB   ARG  20          3HB       ARG  20   0.120  -3.541 -16.550
  137   1HG   ARG  20          2HG       ARG  20  -1.383  -5.443 -15.663
  138   2HG   ARG  20          3HG       ARG  20  -2.508  -4.183 -15.126
  139   1HD   ARG  20          2HD       ARG  20  -2.693  -3.388 -17.496
  140   2HD   ARG  20          3HD       ARG  20  -1.491  -4.588 -17.964
  141    HE   ARG  20           HE       ARG  20  -3.021  -6.261 -17.954
  142   1HH1  ARG  20          2HH2      ARG  20  -4.403  -3.525 -16.231
  143   2HH1  ARG  20          1HH2      ARG  20  -6.001  -4.193 -16.084
  144   1HH2  ARG  20          2HH1      ARG  20  -5.102  -7.239 -17.716
  145   2HH2  ARG  20          1HH1      ARG  20  -6.390  -6.386 -16.931
  146    H    ASP  21           H        ASP  21   2.559  -3.581 -15.044
  147    HA   ASP  21           HA       ASP  21   2.825  -6.283 -15.939
  148   1HB   ASP  21          2HB       ASP  21   4.522  -3.771 -15.837
  149   2HB   ASP  21          3HB       ASP  21   5.222  -5.288 -16.414
  150    HA   PRO  22           HA       PRO  22   4.386  -8.248 -12.408
  151   1HB   PRO  22          2HB       PRO  22   6.150 -10.112 -13.363
  152   2HB   PRO  22          3HB       PRO  22   4.397 -10.198 -13.692
  153   1HG   PRO  22          2HG       PRO  22   6.528  -9.011 -15.483
  154   2HG   PRO  22          3HG       PRO  22   5.280 -10.212 -15.929
  155   1HD   PRO  22          2HD       PRO  22   4.909  -7.579 -16.411
  156   2HD   PRO  22          3HD       PRO  22   3.549  -8.565 -15.804
  157    H    ASP  23           H        ASP  23   6.011  -8.057 -10.842
  158    HA   ASP  23           HA       ASP  23   7.680  -7.265  -9.782
  159   1HB   ASP  23          2HB       ASP  23   9.269  -7.728 -12.354
  160   2HB   ASP  23          3HB       ASP  23   9.954  -7.525 -10.745
  161    H    THR  24           H        THR  24   6.246  -5.264 -11.901
  162    HA   THR  24           HA       THR  24   8.301  -3.221 -12.148
  163    HB   THR  24           HB       THR  24   5.389  -3.194 -13.016
  164    HG1  THR  24           1HG      THR  24   6.279  -3.938 -14.955
  165   1HG2  THR  24          1HG2      THR  24   7.832  -1.618 -13.960
  166   2HG2  THR  24          2HG2      THR  24   6.298  -1.703 -14.853
  167   3HG2  THR  24          3HG2      THR  24   6.338  -0.949 -13.261
  168    H    PHE  25           H        PHE  25   6.120  -3.927  -9.712
  169    HA   PHE  25           HA       PHE  25   5.233  -1.315  -8.990
  170   1HB   PHE  25          2HB       PHE  25   5.423  -3.983  -7.746
  171   2HB   PHE  25          3HB       PHE  25   5.668  -2.680  -6.623
  172    HD1  PHE  25           1HD      PHE  25   3.242  -3.961  -9.173
  173    HD2  PHE  25           2HD      PHE  25   3.855  -1.342  -5.796
  174    HE1  PHE  25           1HE      PHE  25   0.826  -3.439  -9.134
  175    HE2  PHE  25           2HE      PHE  25   1.421  -0.900  -5.704
  176    HZ   PHE  25           HZ       PHE  25  -0.094  -1.908  -7.396
  177    H    GLU  26           H        GLU  26   6.622   0.394  -8.688
  178    HA   GLU  26           HA       GLU  26   9.044  -0.054  -6.992
  179   1HB   GLU  26          2HB       GLU  26   8.468   1.895  -9.157
  180   2HB   GLU  26          3HB       GLU  26   9.122   2.608  -7.673
  181   1HG   GLU  26          2HG       GLU  26  11.029   2.193  -8.847
  182   2HG   GLU  26          3HG       GLU  26  10.965   0.763  -7.819
  183    HA   PRO  27           HA       PRO  27   6.760   1.541  -3.616
  184   1HB   PRO  27          2HB       PRO  27   8.711   2.654  -2.016
  185   2HB   PRO  27          3HB       PRO  27   8.459   0.908  -2.290
  186   1HG   PRO  27          2HG       PRO  27  10.507   2.701  -3.649
  187   2HG   PRO  27          3HG       PRO  27  10.752   1.085  -2.978
  188   1HD   PRO  27          2HD       PRO  27  10.319   1.467  -5.618
  189   2HD   PRO  27          3HD       PRO  27   9.711   0.022  -4.757
  190    H    GLN  28           H        GLN  28   9.292   4.023  -4.268
  191    HA   GLN  28           HA       GLN  28   7.724   6.232  -3.567
  192   1HB   GLN  28          2HB       GLN  28  10.176   5.941  -5.311
  193   2HB   GLN  28          3HB       GLN  28   9.493   7.517  -4.876
  194   1HG   GLN  28          2HG       GLN  28   9.933   7.251  -2.575
  195   2HG   GLN  28          3HG       GLN  28  10.091   5.498  -2.689
  196   1HE2  GLN  28          1HE2      GLN  28  11.826   8.551  -3.073
  197   2HE2  GLN  28          2HE2      GLN  28  13.383   7.789  -3.340
  198    H    LYS  29           H        LYS  29   8.025   4.487  -6.605
  199    HA   LYS  29           HA       LYS  29   6.643   6.305  -8.315
  200   1HB   LYS  29          2HB       LYS  29   8.060   4.295  -8.972
  201   2HB   LYS  29          3HB       LYS  29   6.730   3.261  -8.443
  202   1HG   LYS  29          2HG       LYS  29   6.352   3.368 -10.682
  203   2HG   LYS  29          3HG       LYS  29   5.276   4.654 -10.134
  204   1HD   LYS  29          2HD       LYS  29   7.201   6.309 -10.551
  205   2HD   LYS  29          3HD       LYS  29   8.118   4.977 -11.262
  206   1HE   LYS  29          2HE       LYS  29   5.455   6.119 -12.232
  207   2HE   LYS  29          3HE       LYS  29   7.034   6.323 -13.007
  208   1HZ   LYS  29          1HZ       LYS  29   5.173   4.225 -13.177
  209   2HZ   LYS  29          2HZ       LYS  29   6.464   4.499 -14.154
  210   3HZ   LYS  29          3HZ       LYS  29   6.627   3.603 -12.771
  211    H    PHE  30           H        PHE  30   5.429   3.229  -6.817
  212    HA   PHE  30           HA       PHE  30   2.738   3.640  -7.447
  213   1HB   PHE  30          2HB       PHE  30   3.494   1.478  -6.735
  214   2HB   PHE  30          3HB       PHE  30   4.053   2.105  -5.185
  215    HD1  PHE  30           1HD      PHE  30   2.616   2.054  -3.292
  216    HD2  PHE  30           2HD      PHE  30   0.907   1.882  -7.231
  217    HE1  PHE  30           1HE      PHE  30   0.386   1.664  -2.293
  218    HE2  PHE  30           2HE      PHE  30  -1.365   1.612  -6.210
  219    HZ   PHE  30           HZ       PHE  30  -1.617   1.524  -3.763
  220    H    PHE  31           H        PHE  31   4.512   4.478  -4.513
  221    HA   PHE  31           HA       PHE  31   2.719   5.652  -2.817
  222   1HB   PHE  31          2HB       PHE  31   5.011   5.469  -2.225
  223   2HB   PHE  31          3HB       PHE  31   5.516   6.268  -3.705
  224    HD1  PHE  31           1HD      PHE  31   3.092   7.315  -1.096
  225    HD2  PHE  31           2HD      PHE  31   6.738   8.223  -3.222
  226    HE1  PHE  31           1HE      PHE  31   3.149   9.531  -0.104
  227    HE2  PHE  31           2HE      PHE  31   6.994  10.291  -1.879
  228    HZ   PHE  31           HZ       PHE  31   5.232  10.926  -0.250
  229    H    GLN  32           H        GLN  32   4.355   7.395  -5.561
  230    HA   GLN  32           HA       GLN  32   2.808   9.780  -5.021
  231   1HB   GLN  32          2HB       GLN  32   5.139   9.778  -5.977
  232   2HB   GLN  32          3HB       GLN  32   4.459   9.152  -7.493
  233   1HG   GLN  32          2HG       GLN  32   2.910  11.169  -7.533
  234   2HG   GLN  32          3HG       GLN  32   3.739  11.781  -6.098
  235   1HE2  GLN  32          1HE2      GLN  32   6.010  12.462  -6.329
  236   2HE2  GLN  32          2HE2      GLN  32   6.613  12.862  -7.930
  237    H    THR  33           H        THR  33   2.732   7.145  -7.538
  238    HA   THR  33           HA       THR  33   0.750   8.312  -9.094
  239    HB   THR  33           HB       THR  33   2.383   6.074  -9.250
  240    HG1  THR  33           1HG      THR  33   0.099   6.826 -10.629
  241   1HG2  THR  33          1HG2      THR  33   0.689   4.672  -7.924
  242   2HG2  THR  33          2HG2      THR  33  -0.438   4.977  -9.263
  243   3HG2  THR  33          3HG2      THR  33   1.088   4.112  -9.545
  244    H    SER  34           H        SER  34   0.560   6.424  -6.175
  245    HA   SER  34           HA       SER  34  -2.242   5.919  -6.297
  246   1HB   SER  34          2HB       SER  34  -0.631   4.385  -5.293
  247   2HB   SER  34          3HB       SER  34  -0.199   5.572  -4.050
  248    HG   SER  34           HG       SER  34  -2.839   4.600  -4.411
  249    H    GLY  35           H        GLY  35  -0.358   8.745  -5.449
  250   1HA   GLY  35          1HA       GLY  35  -1.187  10.814  -4.912
  251   2HA   GLY  35          2HA       GLY  35  -2.810  10.132  -4.717
  252    H    LEU  36           H        LEU  36  -0.649   8.272  -2.963
  253    HA   LEU  36           HA       LEU  36  -1.605   9.001  -0.402
  254   1HB   LEU  36          2HB       LEU  36   0.838   7.456  -1.345
  255   2HB   LEU  36          3HB       LEU  36   0.231   7.442   0.305
  256    HG   LEU  36           HG       LEU  36  -1.383   6.463  -2.065
  257   1HD1  LEU  36          1HD1      LEU  36  -0.842   4.213  -1.255
  258   2HD1  LEU  36          2HD1      LEU  36   0.638   5.083  -1.680
  259   3HD1  LEU  36          3HD1      LEU  36   0.184   4.894   0.027
  260   1HD2  LEU  36          1HD2      LEU  36  -2.765   5.382  -0.307
  261   2HD2  LEU  36          2HD2      LEU  36  -1.823   6.219   0.946
  262   3HD2  LEU  36          3HD2      LEU  36  -2.827   7.142  -0.196
  263    H    SER  37           H        SER  37   1.203  10.030  -2.321
  264    HA   SER  37           HA       SER  37   2.530  11.623  -0.322
  265   1HB   SER  37          2HB       SER  37   3.400  10.912  -2.671
  266   2HB   SER  37          3HB       SER  37   2.290  12.101  -3.348
  267    HG   SER  37           HG       SER  37   4.307  12.723  -1.446
  268    H    LYS  38           H        LYS  38  -0.447  12.159  -2.185
  269    HA   LYS  38           HA       LYS  38  -0.205  15.052  -1.794
  270   1HB   LYS  38          2HB       LYS  38  -1.328  13.693  -3.869
  271   2HB   LYS  38          3HB       LYS  38  -2.751  13.877  -2.839
  272   1HG   LYS  38          2HG       LYS  38  -2.022  16.373  -2.623
  273   2HG   LYS  38          3HG       LYS  38  -0.926  16.033  -3.976
  274   1HD   LYS  38          2HD       LYS  38  -2.940  15.282  -5.318
  275   2HD   LYS  38          3HD       LYS  38  -3.964  15.752  -3.941
  276   1HE   LYS  38          2HE       LYS  38  -2.934  18.099  -4.112
  277   2HE   LYS  38          3HE       LYS  38  -2.157  17.577  -5.614
  278   1HZ   LYS  38          1HZ       LYS  38  -4.369  17.169  -6.510
  279   2HZ   LYS  38          2HZ       LYS  38  -5.059  17.694  -5.109
  280   3HZ   LYS  38          3HZ       LYS  38  -4.190  18.733  -6.037
  281    H    MET  39           H        MET  39  -1.893  12.137  -0.671
  282    HA   MET  39           HA       MET  39  -3.755  13.567   0.981
  283   1HB   MET  39          2HB       MET  39  -2.871  10.701   0.716
  284   2HB   MET  39          3HB       MET  39  -3.901  11.184   2.050
  285   1HG   MET  39          2HG       MET  39  -4.614  11.708  -0.872
  286   2HG   MET  39          3HG       MET  39  -5.105  10.303   0.067
  287   1HE   MET  39          1HE       MET  39  -6.367  13.621  -1.191
  288   2HE   MET  39          2HE       MET  39  -7.269  14.311   0.168
  289   3HE   MET  39          3HE       MET  39  -5.507  14.394   0.155
  290    H    SER  40           H        SER  40  -3.695  14.243   3.053
  291    HA   SER  40           HA       SER  40  -1.175  14.616   4.315
  292   1HB   SER  40          2HB       SER  40  -3.931  14.841   5.589
  293   2HB   SER  40          3HB       SER  40  -2.478  15.796   5.947
  294    HG   SER  40           HG       SER  40  -2.698  16.450   3.620
  295    H    ALA  41           H        ALA  41  -0.427  13.743   6.338
  296    HA   ALA  41           HA       ALA  41  -0.480  11.091   6.880
  297   1HB   ALA  41          1HB       ALA  41   0.990  12.562   8.088
  298   2HB   ALA  41          2HB       ALA  41  -0.375  13.360   8.904
  299   3HB   ALA  41          3HB       ALA  41   0.024  11.664   9.258
  300    H    ASN  42           H        ASN  42  -2.907  13.418   8.023
  301    HA   ASN  42           HA       ASN  42  -4.494  11.892   9.716
  302   1HB   ASN  42          2HB       ASN  42  -5.562  13.745   7.543
  303   2HB   ASN  42          3HB       ASN  42  -6.365  13.300   9.052
  304   1HD2  ASN  42          1HD2      ASN  42  -5.281  15.956   7.782
  305   2HD2  ASN  42          2HD2      ASN  42  -4.362  16.649   9.102
  306    H    GLN  43           H        GLN  43  -4.794  12.083   6.129
  307    HA   GLN  43           HA       GLN  43  -6.943  10.110   6.103
  308   1HB   GLN  43          2HB       GLN  43  -5.693  11.959   4.166
  309   2HB   GLN  43          3HB       GLN  43  -5.962  10.364   3.478
  310   1HG   GLN  43          2HG       GLN  43  -8.080  12.027   4.905
  311   2HG   GLN  43          3HG       GLN  43  -7.909  11.897   3.154
  312   1HE2  GLN  43          1HE2      GLN  43  -7.567   9.206   2.628
  313   2HE2  GLN  43          2HE2      GLN  43  -8.922   8.308   3.291
  314    H    VAL  44           H        VAL  44  -3.357  10.141   5.500
  315    HA   VAL  44           HA       VAL  44  -3.314   7.536   4.378
  316    HB   VAL  44           HB       VAL  44  -1.252   9.157   5.920
  317   1HG1  VAL  44          1HG1      VAL  44   0.418   7.798   4.831
  318   2HG1  VAL  44          2HG1      VAL  44  -0.633   6.738   5.765
  319   3HG1  VAL  44          3HG1      VAL  44  -0.836   6.836   4.003
  320   1HG2  VAL  44          1HG2      VAL  44  -2.227  10.245   3.795
  321   2HG2  VAL  44          2HG2      VAL  44  -0.509   9.946   3.750
  322   3HG2  VAL  44          3HG2      VAL  44  -1.633   8.857   2.900
  323    H    LYS  45           H        LYS  45  -3.260   8.766   7.733
  324    HA   LYS  45           HA       LYS  45  -2.803   6.244   8.985
  325   1HB   LYS  45          2HB       LYS  45  -2.475   8.508  10.004
  326   2HB   LYS  45          3HB       LYS  45  -4.233   8.647  10.183
  327   1HG   LYS  45          2HG       LYS  45  -4.247   6.617  11.593
  328   2HG   LYS  45          3HG       LYS  45  -2.511   6.385  11.292
  329   1HD   LYS  45          2HD       LYS  45  -2.188   8.762  12.272
  330   2HD   LYS  45          3HD       LYS  45  -3.826   8.613  12.902
  331   1HE   LYS  45          2HE       LYS  45  -1.411   6.800  13.466
  332   2HE   LYS  45          3HE       LYS  45  -2.122   7.968  14.587
  333   1HZ   LYS  45          1HZ       LYS  45  -2.821   5.747  15.075
  334   2HZ   LYS  45          2HZ       LYS  45  -4.123   6.633  14.598
  335   3HZ   LYS  45          3HZ       LYS  45  -3.436   5.540  13.566
  336    H    ASP  46           H        ASP  46  -5.804   8.105   8.160
  337    HA   ASP  46           HA       ASP  46  -7.640   6.226   9.187
  338   1HB   ASP  46          2HB       ASP  46  -8.293   8.464   8.380
  339   2HB   ASP  46          3HB       ASP  46  -7.995   7.956   6.706
  340    H    VAL  47           H        VAL  47  -6.466   6.437   5.766
  341    HA   VAL  47           HA       VAL  47  -7.666   4.035   4.978
  342    HB   VAL  47           HB       VAL  47  -6.364   3.985   3.037
  343   1HG1  VAL  47          1HG1      VAL  47  -6.488   6.949   3.520
  344   2HG1  VAL  47          2HG1      VAL  47  -6.886   6.024   2.077
  345   3HG1  VAL  47          3HG1      VAL  47  -7.970   5.984   3.490
  346   1HG2  VAL  47          1HG2      VAL  47  -4.110   4.119   3.754
  347   2HG2  VAL  47          2HG2      VAL  47  -4.416   5.427   2.599
  348   3HG2  VAL  47          3HG2      VAL  47  -4.391   5.769   4.338
  349    H    PHE  48           H        PHE  48  -4.353   4.507   6.348
  350    HA   PHE  48           HA       PHE  48  -3.495   1.855   6.421
  351   1HB   PHE  48          2HB       PHE  48  -1.906   3.255   7.266
  352   2HB   PHE  48          3HB       PHE  48  -3.056   4.220   8.159
  353    HD1  PHE  48           1HD      PHE  48  -1.605   0.755   8.219
  354    HD2  PHE  48           2HD      PHE  48  -3.227   4.037  10.478
  355    HE1  PHE  48           1HE      PHE  48  -1.581  -0.640  10.272
  356    HE2  PHE  48           2HE      PHE  48  -3.317   2.589  12.499
  357    HZ   PHE  48           HZ       PHE  48  -2.578   0.212  12.352
  358    H    ARG  49           H        ARG  49  -5.689   3.412   8.866
  359    HA   ARG  49           HA       ARG  49  -6.020   0.991  10.363
  360   1HB   ARG  49          2HB       ARG  49  -7.883   3.370  10.088
  361   2HB   ARG  49          3HB       ARG  49  -8.059   2.077  11.284
  362   1HG   ARG  49          2HG       ARG  49  -5.941   2.630  12.338
  363   2HG   ARG  49          3HG       ARG  49  -5.544   3.768  11.053
  364   1HD   ARG  49          2HD       ARG  49  -6.292   5.159  12.761
  365   2HD   ARG  49          3HD       ARG  49  -7.659   5.050  11.637
  366    HE   ARG  49           HE       ARG  49  -7.859   2.998  13.642
  367   1HH1  ARG  49          2HH2      ARG  49  -8.423   6.425  13.087
  368   2HH1  ARG  49          1HH2      ARG  49  -9.284   6.716  14.563
  369   1HH2  ARG  49          2HH1      ARG  49  -8.994   3.321  15.643
  370   2HH2  ARG  49          1HH1      ARG  49  -9.647   4.877  16.047
  371    H    PHE  50           H        PHE  50  -7.915   2.323   7.589
  372    HA   PHE  50           HA       PHE  50  -9.961   0.287   7.742
  373   1HB   PHE  50          2HB       PHE  50  -9.064   2.217   5.605
  374   2HB   PHE  50          3HB       PHE  50 -10.113   0.880   5.181
  375    HD1  PHE  50           1HD      PHE  50  -9.923   3.683   7.713
  376    HD2  PHE  50           2HD      PHE  50 -12.440   1.138   5.296
  377    HE1  PHE  50           1HE      PHE  50 -11.873   5.038   8.321
  378    HE2  PHE  50           2HE      PHE  50 -14.415   2.449   5.999
  379    HZ   PHE  50           HZ       PHE  50 -14.133   4.433   7.484
  380    H    ILE  51           H        ILE  51  -6.786   0.409   6.087
  381    HA   ILE  51           HA       ILE  51  -7.338  -2.069   4.748
  382    HB   ILE  51           HB       ILE  51  -4.823  -0.423   4.756
  383   1HG1  ILE  51          2HG1      ILE  51  -6.624   0.870   3.732
  384   2HG1  ILE  51          3HG1      ILE  51  -5.576   0.246   2.480
  385   1HG2  ILE  51          1HG2      ILE  51  -4.233  -2.657   4.091
  386   2HG2  ILE  51          2HG2      ILE  51  -5.728  -2.868   3.159
  387   3HG2  ILE  51          3HG2      ILE  51  -4.492  -1.755   2.585
  388   1HD1  ILE  51          1HD1      ILE  51  -8.353  -0.753   3.244
  389   2HD1  ILE  51          2HD1      ILE  51  -7.848   0.068   1.767
  390   3HD1  ILE  51          3HD1      ILE  51  -7.289  -1.575   2.071
  391    H    ASP  52           H        ASP  52  -5.336  -1.142   7.558
  392    HA   ASP  52           HA       ASP  52  -4.302  -3.777   8.131
  393   1HB   ASP  52          2HB       ASP  52  -3.296  -1.749   9.054
  394   2HB   ASP  52          3HB       ASP  52  -4.778  -1.378   9.940
  395    H    ASN  53           H        ASN  53  -6.256  -4.844   7.543
  396    HA   ASN  53           HA       ASN  53  -8.588  -4.970   9.266
  397   1HB   ASN  53          2HB       ASN  53  -7.743  -6.345   6.959
  398   2HB   ASN  53          3HB       ASN  53  -7.558  -7.570   8.205
  399   1HD2  ASN  53          1HD2      ASN  53  -9.377  -8.906   7.951
  400   2HD2  ASN  53          2HD2      ASN  53 -11.014  -8.296   7.800
  401    H    ASP  54           H        ASP  54  -8.852  -6.564  11.074
  402    HA   ASP  54           HA       ASP  54  -8.159  -7.566  12.967
  403   1HB   ASP  54          2HB       ASP  54  -6.565  -9.061  12.798
  404   2HB   ASP  54          3HB       ASP  54  -6.067  -8.429  11.246
  405    H    GLN  55           H        GLN  55  -5.855  -5.020  11.914
  406    HA   GLN  55           HA       GLN  55  -5.036  -3.250  12.984
  407   1HB   GLN  55          2HB       GLN  55  -7.704  -3.377  14.301
  408   2HB   GLN  55          3HB       GLN  55  -6.479  -2.412  15.122
  409   1HG   GLN  55          2HG       GLN  55  -6.047  -1.063  13.179
  410   2HG   GLN  55          3HG       GLN  55  -7.092  -2.072  12.180
  411   1HE2  GLN  55          1HE2      GLN  55  -9.420  -2.285  12.963
  412   2HE2  GLN  55          2HE2      GLN  55 -10.181  -0.788  13.477
  413    H    SER  56           H        SER  56  -3.946  -5.700  13.409
  414    HA   SER  56           HA       SER  56  -3.167  -6.371  15.954
  415   1HB   SER  56          2HB       SER  56  -0.967  -7.022  14.952
  416   2HB   SER  56          3HB       SER  56  -2.344  -7.672  14.093
  417    HG   SER  56           HG       SER  56  -0.536  -6.690  12.855
  418    H    GLY  57           H        GLY  57  -2.243  -3.534  14.111
  419   1HA   GLY  57          1HA       GLY  57  -1.303  -1.594  15.435
  420   2HA   GLY  57          2HA       GLY  57  -0.154  -2.759  16.114
  421    H    TYR  58           H        TYR  58  -0.271  -4.256  13.387
  422    HA   TYR  58           HA       TYR  58   1.572  -2.468  11.874
  423   1HB   TYR  58          2HB       TYR  58   1.957  -5.401  12.548
  424   2HB   TYR  58          3HB       TYR  58   2.965  -4.454  11.462
  425    HD1  TYR  58           HD1      TYR  58   1.909  -4.832  15.035
  426    HD2  TYR  58           HD2      TYR  58   4.786  -3.137  12.313
  427    HE1  TYR  58           HE1      TYR  58   3.158  -3.883  16.945
  428    HE2  TYR  58           HE2      TYR  58   6.003  -2.135  14.223
  429    HH   TYR  58           HH       TYR  58   4.882  -2.484  17.597
  430    H    LEU  59           H        LEU  59   1.704  -2.757   9.738
  431    HA   LEU  59           HA       LEU  59  -0.251  -4.493   8.346
  432   1HB   LEU  59          2HB       LEU  59   1.698  -2.372   7.422
  433   2HB   LEU  59          3HB       LEU  59   1.009  -3.564   6.313
  434    HG   LEU  59           HG       LEU  59  -0.830  -1.972   8.127
  435   1HD1  LEU  59          1HD1      LEU  59   0.482  -0.259   7.039
  436   2HD1  LEU  59          2HD1      LEU  59   0.320  -1.068   5.461
  437   3HD1  LEU  59          3HD1      LEU  59  -1.107  -0.356   6.243
  438   1HD2  LEU  59          1HD2      LEU  59  -1.739  -3.918   6.801
  439   2HD2  LEU  59          2HD2      LEU  59  -2.450  -2.370   6.336
  440   3HD2  LEU  59          3HD2      LEU  59  -1.200  -3.115   5.318
  441    H    ASP  60           H        ASP  60   0.490  -6.192   9.477
  442    HA   ASP  60           HA       ASP  60   3.140  -7.275   9.350
  443   1HB   ASP  60          2HB       ASP  60   0.927  -9.216   9.542
  444   2HB   ASP  60          3HB       ASP  60   2.287  -8.895  10.628
  445    H    GLU  61           H        GLU  61   3.996  -8.911   7.769
  446    HA   GLU  61           HA       GLU  61   3.668  -8.329   5.217
  447   1HB   GLU  61          2HB       GLU  61   5.380  -9.787   6.440
  448   2HB   GLU  61          3HB       GLU  61   4.319 -11.162   6.120
  449   1HG   GLU  61          2HG       GLU  61   4.842  -9.436   3.755
  450   2HG   GLU  61          3HG       GLU  61   6.294 -10.102   4.508
  451    H    GLU  62           H        GLU  62   2.040 -11.161   6.610
  452    HA   GLU  62           HA       GLU  62   0.676 -12.029   4.361
  453   1HB   GLU  62          2HB       GLU  62   0.841 -13.141   6.670
  454   2HB   GLU  62          3HB       GLU  62  -0.435 -12.038   7.216
  455   1HG   GLU  62          2HG       GLU  62  -1.937 -12.996   5.422
  456   2HG   GLU  62          3HG       GLU  62  -0.619 -14.112   4.997
  457    H    GLU  63           H        GLU  63  -0.032  -9.212   6.367
  458    HA   GLU  63           HA       GLU  63  -2.746  -8.886   5.492
  459   1HB   GLU  63          2HB       GLU  63  -1.409  -7.981   7.553
  460   2HB   GLU  63          3HB       GLU  63  -0.973  -6.636   6.495
  461   1HG   GLU  63          2HG       GLU  63  -3.228  -5.901   6.347
  462   2HG   GLU  63          3HG       GLU  63  -3.879  -7.491   6.814
  463    H    LEU  64           H        LEU  64   0.458  -7.622   4.453
  464    HA   LEU  64           HA       LEU  64  -0.753  -5.899   2.537
  465   1HB   LEU  64          2HB       LEU  64   1.722  -5.912   3.464
  466   2HB   LEU  64          3HB       LEU  64   2.029  -6.820   1.974
  467    HG   LEU  64           HG       LEU  64   0.438  -4.775   1.020
  468   1HD1  LEU  64          1HD1      LEU  64   2.084  -3.521   3.258
  469   2HD1  LEU  64          2HD1      LEU  64   1.024  -2.674   2.113
  470   3HD1  LEU  64          3HD1      LEU  64   0.327  -3.769   3.321
  471   1HD2  LEU  64          1HD2      LEU  64   2.422  -3.528   0.328
  472   2HD2  LEU  64          2HD2      LEU  64   3.443  -4.649   1.239
  473   3HD2  LEU  64          3HD2      LEU  64   2.439  -5.237  -0.104
  474    H    LYS  65           H        LYS  65   0.249  -9.232   2.585
  475    HA   LYS  65           HA       LYS  65  -0.039  -9.960  -0.114
  476   1HB   LYS  65          2HB       LYS  65   0.686 -11.243   2.103
  477   2HB   LYS  65          3HB       LYS  65  -1.010 -11.777   2.050
  478   1HG   LYS  65          2HG       LYS  65  -0.686 -12.894  -0.048
  479   2HG   LYS  65          3HG       LYS  65   0.882 -12.113  -0.281
  480   1HD   LYS  65          2HD       LYS  65   1.330 -14.384   0.468
  481   2HD   LYS  65          3HD       LYS  65   1.829 -13.220   1.683
  482   1HE   LYS  65          2HE       LYS  65   0.825 -14.918   2.948
  483   2HE   LYS  65          3HE       LYS  65  -0.399 -13.656   2.891
  484   1HZ   LYS  65          1HZ       LYS  65  -0.350 -16.090   1.251
  485   2HZ   LYS  65          2HZ       LYS  65  -1.354 -15.763   2.513
  486   3HZ   LYS  65          3HZ       LYS  65  -1.478 -14.891   1.122
  487    H    PHE  66           H        PHE  66  -2.569  -8.637   1.869
  488    HA   PHE  66           HA       PHE  66  -4.344  -9.167  -0.434
  489   1HB   PHE  66          2HB       PHE  66  -6.292  -9.452   1.060
  490   2HB   PHE  66          3HB       PHE  66  -5.143 -10.768   1.093
  491    HD1  PHE  66           1HD      PHE  66  -6.365  -7.809   3.043
  492    HD2  PHE  66           2HD      PHE  66  -4.029 -11.430   3.136
  493    HE1  PHE  66           1HE      PHE  66  -6.353  -7.756   5.523
  494    HE2  PHE  66           2HE      PHE  66  -4.135 -11.433   5.604
  495    HZ   PHE  66           HZ       PHE  66  -5.307  -9.607   6.806
  496    H    PHE  67           H        PHE  67  -2.626  -6.898   0.414
  497    HA   PHE  67           HA       PHE  67  -4.003  -4.809   1.638
  498   1HB   PHE  67          2HB       PHE  67  -1.730  -4.617   1.275
  499   2HB   PHE  67          3HB       PHE  67  -1.813  -4.898  -0.455
  500    HD1  PHE  67           1HD      PHE  67  -1.855  -3.010  -1.931
  501    HD2  PHE  67           2HD      PHE  67  -2.308  -2.470   2.314
  502    HE1  PHE  67           1HE      PHE  67  -1.691  -0.562  -2.225
  503    HE2  PHE  67           2HE      PHE  67  -2.237  -0.008   2.007
  504    HZ   PHE  67           HZ       PHE  67  -1.964   0.953  -0.273
  505    H    LEU  68           H        LEU  68  -3.588  -4.917  -1.952
  506    HA   LEU  68           HA       LEU  68  -5.483  -2.813  -2.276
  507   1HB   LEU  68          2HB       LEU  68  -3.366  -3.642  -3.642
  508   2HB   LEU  68          3HB       LEU  68  -4.519  -4.661  -4.448
  509    HG   LEU  68           HG       LEU  68  -4.121  -2.750  -5.787
  510   1HD1  LEU  68          1HD1      LEU  68  -6.570  -3.342  -5.560
  511   2HD1  LEU  68          2HD1      LEU  68  -6.689  -2.000  -4.396
  512   3HD1  LEU  68          3HD1      LEU  68  -6.241  -1.674  -6.074
  513   1HD2  LEU  68          1HD2      LEU  68  -4.674  -0.953  -3.388
  514   2HD2  LEU  68          2HD2      LEU  68  -3.082  -1.315  -4.090
  515   3HD2  LEU  68          3HD2      LEU  68  -4.285  -0.432  -5.038
  516    H    GLN  69           H        GLN  69  -5.645  -6.298  -2.307
  517    HA   GLN  69           HA       GLN  69  -8.062  -6.923  -3.405
  518   1HB   GLN  69          2HB       GLN  69  -6.137  -8.226  -1.845
  519   2HB   GLN  69          3HB       GLN  69  -7.549  -8.308  -0.817
  520   1HG   GLN  69          2HG       GLN  69  -8.786  -9.502  -2.504
  521   2HG   GLN  69          3HG       GLN  69  -7.579  -9.159  -3.750
  522   1HE2  GLN  69          1HE2      GLN  69  -5.543 -10.353  -3.806
  523   2HE2  GLN  69          2HE2      GLN  69  -5.334 -11.749  -2.802
  524    H    LYS  70           H        LYS  70  -7.480  -5.457  -0.177
  525    HA   LYS  70           HA       LYS  70 -10.207  -5.691   0.736
  526   1HB   LYS  70          2HB       LYS  70  -8.107  -3.590   1.397
  527   2HB   LYS  70          3HB       LYS  70  -9.620  -3.858   2.256
  528   1HG   LYS  70          2HG       LYS  70  -8.628  -6.376   2.473
  529   2HG   LYS  70          3HG       LYS  70  -7.108  -5.497   2.164
  530   1HD   LYS  70          2HD       LYS  70  -7.274  -5.558   4.499
  531   2HD   LYS  70          3HD       LYS  70  -7.691  -3.935   3.956
  532   1HE   LYS  70          2HE       LYS  70 -10.210  -4.754   4.146
  533   2HE   LYS  70          3HE       LYS  70  -9.514  -6.107   5.029
  534   1HZ   LYS  70          1HZ       LYS  70  -8.448  -4.300   6.449
  535   2HZ   LYS  70          2HZ       LYS  70  -9.500  -3.243   5.803
  536   3HZ   LYS  70          3HZ       LYS  70 -10.055  -4.568   6.633
  537    H    PHE  71           H        PHE  71  -8.625  -3.557  -1.535
  538    HA   PHE  71           HA       PHE  71 -10.636  -1.434  -1.394
  539   1HB   PHE  71          2HB       PHE  71  -7.999  -1.475  -2.038
  540   2HB   PHE  71          3HB       PHE  71  -8.674  -1.687  -3.650
  541    HD1  PHE  71           1HD      PHE  71 -11.046   0.046  -3.711
  542    HD2  PHE  71           2HD      PHE  71  -7.090   0.661  -2.082
  543    HE1  PHE  71           1HE      PHE  71 -11.282   2.481  -4.016
  544    HE2  PHE  71           2HE      PHE  71  -7.370   3.084  -2.318
  545    HZ   PHE  71           HZ       PHE  71  -9.551   4.013  -3.153
  546    H    GLU  72           H        GLU  72  -9.432  -3.855  -3.742
  547    HA   GLU  72           HA       GLU  72 -11.906  -3.532  -5.390
  548   1HB   GLU  72          2HB       GLU  72  -9.642  -2.939  -6.315
  549   2HB   GLU  72          3HB       GLU  72  -9.167  -4.620  -6.146
  550   1HG   GLU  72          2HG       GLU  72 -11.699  -4.558  -7.573
  551   2HG   GLU  72          3HG       GLU  72 -10.697  -3.265  -8.239
  552    H    SER  73           H        SER  73 -10.532  -6.315  -6.438
  553    HA   SER  73           HA       SER  73 -11.183  -8.042  -4.180
  554   1HB   SER  73          2HB       SER  73 -12.982  -9.312  -5.470
  555   2HB   SER  73          3HB       SER  73 -13.430  -7.710  -4.870
  556    HG   SER  73           HG       SER  73 -14.071  -7.900  -7.019
  557    H    GLY  74           H        GLY  74  -9.341  -7.712  -7.054
  558   1HA   GLY  74          1HA       GLY  74  -7.975 -10.177  -6.369
  559   2HA   GLY  74          2HA       GLY  74  -8.890 -10.255  -7.897
  560    H    ALA  75           H        ALA  75  -6.604  -8.008  -6.104
  561    HA   ALA  75           HA       ALA  75  -5.983  -6.756  -8.701
  562   1HB   ALA  75          1HB       ALA  75  -6.612  -5.429  -6.713
  563   2HB   ALA  75          2HB       ALA  75  -5.149  -5.970  -5.902
  564   3HB   ALA  75          3HB       ALA  75  -5.008  -5.004  -7.375
  565    H    ARG  76           H        ARG  76  -3.415  -6.783  -6.339
  566    HA   ARG  76           HA       ARG  76  -1.983  -8.962  -7.681
  567   1HB   ARG  76          2HB       ARG  76  -1.845  -6.760  -9.118
  568   2HB   ARG  76          3HB       ARG  76  -0.898  -6.109  -7.781
  569   1HG   ARG  76          2HG       ARG  76   0.778  -6.883  -9.052
  570   2HG   ARG  76          3HG       ARG  76   0.537  -8.354  -8.128
  571   1HD   ARG  76          2HD       ARG  76  -0.953  -9.225  -9.981
  572   2HD   ARG  76          3HD       ARG  76  -0.679  -7.714 -10.890
  573    HE   ARG  76           HE       ARG  76   1.859  -8.584 -10.348
  574   1HH1  ARG  76          2HH2      ARG  76  -0.803 -10.101 -12.086
  575   2HH1  ARG  76          1HH2      ARG  76   0.223 -11.256 -12.896
  576   1HH2  ARG  76          2HH1      ARG  76   3.126  -9.964 -11.253
  577   2HH2  ARG  76          1HH1      ARG  76   2.628 -11.181 -12.429
  578    H    GLU  77           H        GLU  77  -2.780  -9.015  -5.223
  579    HA   GLU  77           HA       GLU  77  -0.607  -8.200  -3.399
  580   1HB   GLU  77          2HB       GLU  77  -3.049  -9.729  -2.564
  581   2HB   GLU  77          3HB       GLU  77  -2.158  -8.433  -1.757
  582   1HG   GLU  77          2HG       GLU  77  -4.154  -7.434  -2.303
  583   2HG   GLU  77          3HG       GLU  77  -3.146  -6.873  -3.627
  584    H    LEU  78           H        LEU  78  -1.807 -10.823  -5.274
  585    HA   LEU  78           HA       LEU  78  -0.799 -13.012  -3.755
  586   1HB   LEU  78          2HB       LEU  78  -1.304 -12.982  -6.757
  587   2HB   LEU  78          3HB       LEU  78  -1.224 -14.362  -5.669
  588    HG   LEU  78           HG       LEU  78  -3.449 -14.256  -5.885
  589   1HD1  LEU  78          1HD1      LEU  78  -4.578 -13.334  -4.020
  590   2HD1  LEU  78          2HD1      LEU  78  -2.981 -13.847  -3.460
  591   3HD1  LEU  78          3HD1      LEU  78  -3.324 -12.121  -3.731
  592   1HD2  LEU  78          1HD2      LEU  78  -3.641 -12.548  -7.494
  593   2HD2  LEU  78          2HD2      LEU  78  -4.795 -12.161  -6.208
  594   3HD2  LEU  78          3HD2      LEU  78  -3.278 -11.255  -6.346
  595    H    THR  79           H        THR  79   0.688 -11.071  -6.495
  596    HA   THR  79           HA       THR  79   2.884 -12.876  -6.626
  597    HB   THR  79           HB       THR  79   3.452 -10.003  -7.205
  598    HG1  THR  79           1HG      THR  79   2.632 -10.170  -9.126
  599   1HG2  THR  79          1HG2      THR  79   3.994 -12.584  -8.738
  600   2HG2  THR  79          2HG2      THR  79   4.749 -11.009  -9.017
  601   3HG2  THR  79          3HG2      THR  79   5.106 -11.905  -7.543
  602    H    GLU  80           H        GLU  80   4.502 -13.097  -5.379
  603    HA   GLU  80           HA       GLU  80   4.836 -11.715  -2.863
  604   1HB   GLU  80          2HB       GLU  80   6.912 -12.980  -2.659
  605   2HB   GLU  80          3HB       GLU  80   5.532 -14.000  -3.073
  606   1HG   GLU  80          2HG       GLU  80   6.290 -14.094  -5.454
  607   2HG   GLU  80          3HG       GLU  80   7.658 -13.034  -5.058
  608    H    SER  81           H        SER  81   6.324 -11.424  -6.084
  609    HA   SER  81           HA       SER  81   8.270  -9.559  -5.284
  610   1HB   SER  81          2HB       SER  81   7.971 -10.980  -7.545
  611   2HB   SER  81          3HB       SER  81   7.402  -9.418  -8.133
  612    HG   SER  81           HG       SER  81   9.566  -9.526  -8.370
  613    H    GLU  82           H        GLU  82   5.320  -8.721  -7.277
  614    HA   GLU  82           HA       GLU  82   5.367  -6.068  -6.818
  615   1HB   GLU  82          2HB       GLU  82   2.866  -7.805  -7.008
  616   2HB   GLU  82          3HB       GLU  82   2.885  -6.046  -7.041
  617   1HG   GLU  82          2HG       GLU  82   2.867  -6.638  -9.319
  618   2HG   GLU  82          3HG       GLU  82   4.517  -6.141  -8.993
  619    H    THR  83           H        THR  83   3.956  -8.450  -4.436
  620    HA   THR  83           HA       THR  83   3.227  -6.462  -2.669
  621    HB   THR  83           HB       THR  83   4.134  -9.326  -2.186
  622    HG1  THR  83           1HG      THR  83   1.780  -8.484  -1.254
  623   1HG2  THR  83          1HG2      THR  83   3.213  -7.355  -0.041
  624   2HG2  THR  83          2HG2      THR  83   3.294  -9.114   0.162
  625   3HG2  THR  83          3HG2      THR  83   4.774  -8.193  -0.068
  626    H    LYS  84           H        LYS  84   6.320  -8.330  -2.726
  627    HA   LYS  84           HA       LYS  84   7.419  -7.100  -0.470
  628   1HB   LYS  84          2HB       LYS  84   9.345  -8.302  -0.779
  629   2HB   LYS  84          3HB       LYS  84   8.144  -9.314  -1.568
  630   1HG   LYS  84          2HG       LYS  84   8.877  -8.060  -3.740
  631   2HG   LYS  84          3HG       LYS  84  10.248  -7.467  -2.802
  632   1HD   LYS  84          2HD       LYS  84  10.925  -9.827  -2.359
  633   2HD   LYS  84          3HD       LYS  84   9.538 -10.378  -3.329
  634   1HE   LYS  84          2HE       LYS  84  10.466  -8.949  -5.261
  635   2HE   LYS  84          3HE       LYS  84  11.909  -8.679  -4.292
  636   1HZ   LYS  84          1HZ       LYS  84  12.306 -11.042  -4.346
  637   2HZ   LYS  84          2HZ       LYS  84  10.900 -11.312  -5.167
  638   3HZ   LYS  84          3HZ       LYS  84  12.112 -10.474  -5.884
  639    H    SER  85           H        SER  85   7.479  -6.061  -3.834
  640    HA   SER  85           HA       SER  85   9.447  -4.084  -3.771
  641   1HB   SER  85          2HB       SER  85   6.598  -3.819  -4.859
  642   2HB   SER  85          3HB       SER  85   8.023  -2.874  -5.329
  643    HG   SER  85