*HEADER    STRUCTURAL PROTEIN                      13-NOV-03   1RGW              
*TITLE     SOLUTION STRUCTURE OF ZASP'S PDZ DOMAIN                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZASP PROTEIN;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PDZ DOMAIN;                                                
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 TISSUE: MUSCLE;                                                      
*SOURCE   5 GENE: ZASP;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET9D                                     
*KEYWDS    ZASP, PDZ, CYPHER, ORACLE, MUSCLE, Z-DISK, SARCOMERE                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    Y.AU, R.A.ATKINSON, A.PALLAVICINI, C.JOSEPH, S.R.MARTIN,              
*AUTHOR   2 F.W.MUSKETT, R.GUERRINI, G.FAULKNER, A.PASTORE                       
*REVDAT   1   13-APR-04 1RGW    0                                                
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assign (resid  23 and name HB1 ) (resid  24 and name HN  ) 5.50 3.70 0
assign (resid  47 and name HB1 ) (resid  81 and name HN  ) 4.69 2.89 0
assign (resid  59 and name HG2#) (resid  60 and name HA  ) 4.19 2.39 0
assign (resid  61 and name HN  ) (resid  65 and name HN  ) 4.73 2.93 0
assign (resid   6 and name HA  ) (resid   7 and name HB# ) 4.70 2.90 0
assign (resid  41 and name HB# ) (resid  42 and name HN  ) 3.70 1.90 0
assign (resid  80 and name HD2#) (resid  81 and name HN  ) 4.48 2.68 0
assign (resid   3 and name HD# ) (resid  80 and name HG  ) 4.76 2.96 0
assign (resid   3 and name HE# ) (resid  80 and name HD1#) 3.79 1.99 0
assign (resid  15 and name HA  ) (resid  32 and name HG2#) 4.80 3.00 0
assign (resid  36 and name HB# ) (resid  39 and name HN  ) 4.78 2.98 0
assign ( resid   3 and name o ) ( resid  80 and name n ) 3.0  0.5  0.5
assign ( resid   3 and name o ) ( resid  80 and name hn) 2.1  0.6  0.5
assign ( resid  80 and name o ) ( resid   3 and name n ) 3.0  0.5  0.5
assign ( resid  80 and name o ) ( resid   3 and name hn) 2.1  0.6  0.5
assign ( resid   1 and name o ) ( resid  82 and name n ) 3.0  0.5  0.5
assign ( resid   1 and name o ) ( resid  82 and name hn) 2.1  0.6  0.5
assign ( resid  78 and name o ) ( resid   5 and name n ) 3.0  0.5  0.5
assign ( resid  78 and name o ) ( resid   5 and name hn) 2.1  0.6  0.5
assign ( resid  14 and name o ) ( resid  33 and name n ) 3.0  0.5  0.5
assign ( resid  14 and name o ) ( resid  33 and name hn) 2.1  0.6  0.5
assign ( resid  28 and name o ) ( resid  18 and name n ) 3.0  0.5  0.5
assign ( resid  28 and name o ) ( resid  18 and name hn) 2.1  0.6  0.5
assign ( resid  48 and name o ) ( resid  81 and name n ) 3.0  0.5  0.5
assign ( resid  48 and name o ) ( resid  81 and name hn) 2.1  0.6  0.5

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1  -6.970  -8.740 -11.409
    2   2H    MET   1          2HT       MET   1  -8.492  -9.264 -11.940
    3   3H    MET   1          3HT       MET   1  -8.280  -8.747 -10.366
    4    HA   MET   1           HA       MET   1  -7.673  -6.987 -12.643
    5   1HB   MET   1          2HB       MET   1  -9.994  -7.794 -12.953
    6   2HB   MET   1          1HB       MET   1 -10.412  -7.298 -11.291
    7   1HG   MET   1          2HG       MET   1 -11.252  -5.726 -12.992
    8   2HG   MET   1          1HG       MET   1 -10.120  -4.933 -11.870
    9   1HE   MET   1          1HE       MET   1  -9.670  -2.920 -15.105
   10   2HE   MET   1          2HE       MET   1 -10.021  -2.921 -13.347
   11   3HE   MET   1          3HE       MET   1 -11.164  -3.701 -14.497
   12    H    ALA   2           H        ALA   2  -6.826  -5.043 -12.036
   13    HA   ALA   2           HA       ALA   2  -6.802  -4.499  -9.157
   14   1HB   ALA   2          1HB       ALA   2  -4.691  -5.605  -9.774
   15   2HB   ALA   2          2HB       ALA   2  -4.342  -3.866  -9.529
   16   3HB   ALA   2          3HB       ALA   2  -4.490  -4.509 -11.200
   17    H    TYR   3           H        TYR   3  -5.588  -2.295  -8.830
   18    HA   TYR   3           HA       TYR   3  -6.442  -0.356 -10.761
   19   1HB   TYR   3          2HB       TYR   3  -7.758   1.006  -9.397
   20   2HB   TYR   3          1HB       TYR   3  -8.470  -0.635  -9.318
   21    HD1  TYR   3           1HD      TYR   3  -8.033   2.107  -7.555
   22    HD2  TYR   3           2HD      TYR   3  -7.057  -2.019  -7.162
   23    HE1  TYR   3           1HE      TYR   3  -8.181   2.296  -5.110
   24    HE2  TYR   3           2HE      TYR   3  -7.282  -1.855  -4.765
   25    HH   TYR   3           HH       TYR   3  -8.015  -0.557  -3.043
   26    H    SER   4           H        SER   4  -5.537   1.811 -10.280
   27    HA   SER   4           HA       SER   4  -3.529   1.736  -8.204
   28   1HB   SER   4          2HB       SER   4  -1.769   2.799  -9.455
   29   2HB   SER   4          1HB       SER   4  -2.187   1.212 -10.162
   30    HG   SER   4           HG       SER   4  -1.899   2.893 -11.692
   31    H    VAL   5           H        VAL   5  -3.061   3.655  -7.208
   32    HA   VAL   5           HA       VAL   5  -4.264   6.060  -8.215
   33    HB   VAL   5           HB       VAL   5  -6.092   5.630  -6.969
   34   1HG1  VAL   5          1HG1      VAL   5  -6.096   4.614  -4.707
   35   2HG1  VAL   5          2HG1      VAL   5  -4.347   4.208  -4.894
   36   3HG1  VAL   5          3HG1      VAL   5  -5.580   3.486  -6.017
   37   1HG2  VAL   5          1HG2      VAL   5  -6.016   6.967  -4.893
   38   2HG2  VAL   5          2HG2      VAL   5  -5.090   7.803  -6.199
   39   3HG2  VAL   5          3HG2      VAL   5  -4.228   6.941  -4.876
   40    H    THR   6           H        THR   6  -3.246   7.863  -7.612
   41    HA   THR   6           HA       THR   6  -0.673   7.468  -6.244
   42    HB   THR   6           HB       THR   6  -1.408   9.557  -8.320
   43    HG1  THR   6           1HG      THR   6  -0.046   8.390  -9.647
   44   1HG2  THR   6          1HG2      THR   6   0.533  10.212  -6.810
   45   2HG2  THR   6          2HG2      THR   6   1.143   9.798  -8.440
   46   3HG2  THR   6          3HG2      THR   6   1.310   8.605  -7.116
   47    H    LEU   7           H        LEU   7  -0.125   8.940  -4.565
   48    HA   LEU   7           HA       LEU   7  -1.686  11.369  -4.557
   49   1HB   LEU   7          2HB       LEU   7  -1.624  11.354  -2.000
   50   2HB   LEU   7          1HB       LEU   7  -2.927  10.514  -2.893
   51    HG   LEU   7           HG       LEU   7  -2.174   8.373  -2.333
   52   1HD1  LEU   7          1HD1      LEU   7   0.132   8.265  -2.678
   53   2HD1  LEU   7          2HD1      LEU   7  -0.064   7.974  -0.914
   54   3HD1  LEU   7          3HD1      LEU   7   0.510   9.584  -1.512
   55   1HD2  LEU   7          1HD2      LEU   7  -1.894  10.279   0.054
   56   2HD2  LEU   7          2HD2      LEU   7  -1.936   8.495   0.233
   57   3HD2  LEU   7          3HD2      LEU   7  -3.356   9.365  -0.473
   58    H    THR   8           H        THR   8  -0.723  13.114  -3.376
   59    HA   THR   8           HA       THR   8   2.194  12.884  -3.256
   60    HB   THR   8           HB       THR   8   1.436  14.056  -5.284
   61    HG1  THR   8           1HG      THR   8   2.735  15.852  -3.537
   62   1HG2  THR   8          1HG2      THR   8   0.446  16.247  -3.323
   63   2HG2  THR   8          2HG2      THR   8  -0.599  15.222  -4.375
   64   3HG2  THR   8          3HG2      THR   8   0.571  16.365  -5.116
   65    H    GLY   9           H        GLY   9   3.219  14.242  -1.669
   66   1HA   GLY   9          2HA       GLY   9   2.016  16.192  -0.265
   67   2HA   GLY   9          1HA       GLY   9   1.604  14.685   0.626
   68    HA   PRO  10           HA       PRO  10   5.959  15.663   1.836
   69   1HB   PRO  10          2HB       PRO  10   4.661  17.874   3.550
   70   2HB   PRO  10          1HB       PRO  10   6.389  17.728   3.039
   71   1HG   PRO  10          2HG       PRO  10   4.707  19.410   1.675
   72   2HG   PRO  10          1HG       PRO  10   5.749  18.275   0.707
   73   1HD   PRO  10          2HD       PRO  10   2.806  17.876   1.552
   74   2HD   PRO  10          1HD       PRO  10   3.570  17.659  -0.088
   75    H    GLY  11           H        GLY  11   2.866  15.592   3.381
   76   1HA   GLY  11          2HA       GLY  11   3.908  14.540   5.870
   77   2HA   GLY  11          1HA       GLY  11   2.210  14.933   5.421
   78    HA   PRO  12           HA       PRO  12   2.949  10.423   5.306
   79   1HB   PRO  12          2HB       PRO  12   1.442   9.552   7.449
   80   2HB   PRO  12          1HB       PRO  12   3.058  10.319   7.668
   81   1HG   PRO  12          2HG       PRO  12   0.323  11.720   7.819
   82   2HG   PRO  12          1HG       PRO  12   1.645  11.725   9.069
   83   1HD   PRO  12          2HD       PRO  12   1.383  13.724   7.156
   84   2HD   PRO  12          1HD       PRO  12   3.027  13.153   7.705
   85    H    TRP  13           H        TRP  13   1.323   8.560   5.228
   86    HA   TRP  13           HA       TRP  13  -0.832   9.466   3.500
   87   1HB   TRP  13          2HB       TRP  13   0.254   6.603   3.664
   88   2HB   TRP  13          1HB       TRP  13  -0.699   7.285   2.409
   89    HD1  TRP  13           HD       TRP  13   2.758   6.559   3.349
   90    HE1  TRP  13           1HE      TRP  13   4.478   7.802   1.843
   91    HE3  TRP  13           3HE      TRP  13  -0.291  10.082   1.377
   92    HZ2  TRP  13           2HZ      TRP  13   4.552  10.142   0.336
   93    HZ3  TRP  13           3HZ      TRP  13   0.661  11.827  -0.038
   94    HH2  TRP  13           HH       TRP  13   3.075  11.885  -0.521
   95    H    GLY  14           H        GLY  14  -0.344   6.899   5.965
   96   1HA   GLY  14          2HA       GLY  14  -1.446   7.003   7.937
   97   2HA   GLY  14          1HA       GLY  14  -2.846   7.803   7.171
   98    H    PHE  15           H        PHE  15  -1.163   4.747   6.410
   99    HA   PHE  15           HA       PHE  15  -3.694   3.309   6.800
  100   1HB   PHE  15          2HB       PHE  15  -2.927   1.901   4.854
  101   2HB   PHE  15          1HB       PHE  15  -2.934   3.615   4.437
  102    HD1  PHE  15           1HD      PHE  15  -0.879   4.885   4.347
  103    HD2  PHE  15           2HD      PHE  15  -0.780   0.709   5.126
  104    HE1  PHE  15           1HE      PHE  15   1.577   4.931   4.309
  105    HE2  PHE  15           2HE      PHE  15   1.631   0.713   4.792
  106    HZ   PHE  15           HZ       PHE  15   2.843   2.830   4.569
  107    H    ARG  16           H        ARG  16  -3.627   1.014   7.215
  108    HA   ARG  16           HA       ARG  16  -1.728   0.577   9.339
  109   1HB   ARG  16          2HB       ARG  16  -4.498  -0.662   8.825
  110   2HB   ARG  16          1HB       ARG  16  -3.449  -1.044  10.209
  111   1HG   ARG  16          2HG       ARG  16  -5.006   1.538   9.567
  112   2HG   ARG  16          1HG       ARG  16  -5.250   0.389  10.917
  113   1HD   ARG  16          2HD       ARG  16  -2.927   1.117  11.800
  114   2HD   ARG  16          1HD       ARG  16  -2.979   2.439  10.549
  115    HE   ARG  16           HE       ARG  16  -5.467   2.517  11.951
  116   1HH1  ARG  16          1HH1      ARG  16  -2.014   3.201  12.547
  117   2HH1  ARG  16          2HH1      ARG  16  -2.301   4.066  14.015
  118   1HH2  ARG  16          1HH2      ARG  16  -5.833   3.677  13.917
  119   2HH2  ARG  16          2HH2      ARG  16  -4.497   4.332  14.797
  120    H    LEU  17           H        LEU  17  -0.574  -1.443   9.317
  121    HA   LEU  17           HA       LEU  17  -0.838  -2.827   6.739
  122   1HB   LEU  17          2HB       LEU  17   1.612  -2.421   8.521
  123   2HB   LEU  17          1HB       LEU  17   1.558  -3.403   7.019
  124    HG   LEU  17           HG       LEU  17   0.807  -1.184   5.852
  125   1HD1  LEU  17          1HD1      LEU  17   1.973   0.829   7.094
  126   2HD1  LEU  17          2HD1      LEU  17   1.921  -0.235   8.560
  127   3HD1  LEU  17          3HD1      LEU  17   0.390   0.256   7.727
  128   1HD2  LEU  17          1HD2      LEU  17   2.938  -2.344   5.423
  129   2HD2  LEU  17          2HD2      LEU  17   3.658  -1.668   6.932
  130   3HD2  LEU  17          3HD2      LEU  17   3.224  -0.561   5.563
  131    H    GLN  18           H        GLN  18  -1.538  -5.000   6.930
  132    HA   GLN  18           HA       GLN  18  -0.357  -6.489   9.130
  133   1HB   GLN  18          2HB       GLN  18  -3.360  -6.562   8.579
  134   2HB   GLN  18          1HB       GLN  18  -2.453  -7.685   9.626
  135   1HG   GLN  18          2HG       GLN  18  -1.790  -5.756  11.103
  136   2HG   GLN  18          1HG       GLN  18  -2.844  -4.667  10.146
  137   1HE2  GLN  18          1HE2      GLN  18  -3.481  -4.691  12.714
  138   2HE2  GLN  18          2HE2      GLN  18  -4.887  -5.672  13.011
  139    H    GLY  19           H        GLY  19   0.536  -8.236   8.348
  140   1HA   GLY  19          2HA       GLY  19   0.528 -10.188   7.122
  141   2HA   GLY  19          1HA       GLY  19  -0.293  -9.383   5.750
  142    H    GLY  20           H        GLY  20   1.590 -10.266   4.500
  143   1HA   GLY  20          2HA       GLY  20   3.233  -8.853   3.373
  144   2HA   GLY  20          1HA       GLY  20   4.052  -8.722   4.967
  145    H    LYS  21           H        LYS  21   5.384  -9.658   2.667
  146    HA   LYS  21           HA       LYS  21   5.310 -12.346   2.362
  147   1HB   LYS  21          2HB       LYS  21   6.849 -10.155   1.367
  148   2HB   LYS  21          1HB       LYS  21   8.029 -11.372   1.922
  149   1HG   LYS  21          2HG       LYS  21   7.613 -11.952  -0.323
  150   2HG   LYS  21          1HG       LYS  21   6.663 -13.115   0.642
  151   1HD   LYS  21          2HD       LYS  21   4.704 -11.285   0.324
  152   2HD   LYS  21          1HD       LYS  21   5.706 -10.756  -1.056
  153   1HE   LYS  21          2HE       LYS  21   4.497 -13.574  -0.571
  154   2HE   LYS  21          1HE       LYS  21   3.914 -12.338  -1.750
  155   1HZ   LYS  21          1HZ       LYS  21   6.628 -12.750  -2.283
  156   2HZ   LYS  21          2HZ       LYS  21   5.317 -13.188  -3.200
  157   3HZ   LYS  21          3HZ       LYS  21   5.939 -14.277  -2.065
  158    H    ASP  22           H        ASP  22   7.038 -10.631   4.885
  159    HA   ASP  22           HA       ASP  22   8.668 -12.714   5.705
  160   1HB   ASP  22          2HB       ASP  22   8.804 -10.222   6.205
  161   2HB   ASP  22          1HB       ASP  22   7.423 -10.410   7.346
  162    H    PHE  23           H        PHE  23   5.219 -12.224   6.200
  163    HA   PHE  23           HA       PHE  23   5.087 -14.237   8.272
  164   1HB   PHE  23          2HB       PHE  23   2.988 -12.519   6.804
  165   2HB   PHE  23          1HB       PHE  23   2.631 -13.654   8.151
  166    HD1  PHE  23           1HD      PHE  23   3.581 -13.253  10.377
  167    HD2  PHE  23           2HD      PHE  23   3.943 -10.396   7.261
  168    HE1  PHE  23           1HE      PHE  23   4.161 -11.536  12.024
  169    HE2  PHE  23           2HE      PHE  23   4.537  -8.672   8.901
  170    HZ   PHE  23           HZ       PHE  23   4.659  -9.249  11.288
  171    H    ASN  24           H        ASN  24   5.574 -14.349   5.020
  172    HA   ASN  24           HA       ASN  24   5.153 -15.579   3.372
  173   1HB   ASN  24          2HB       ASN  24   5.908 -17.387   4.896
  174   2HB   ASN  24          1HB       ASN  24   4.195 -17.710   5.330
  175   1HD2  ASN  24          1HD2      ASN  24   5.832 -17.163   2.056
  176   2HD2  ASN  24          2HD2      ASN  24   5.379 -18.723   1.462
  177    H    MET  25           H        MET  25   3.428 -13.629   3.785
  178    HA   MET  25           HA       MET  25   0.860 -14.678   2.882
  179   1HB   MET  25          2HB       MET  25   1.597 -13.196   5.124
  180   2HB   MET  25          1HB       MET  25   1.008 -11.900   4.046
  181   1HG   MET  25          2HG       MET  25  -1.225 -12.871   4.087
  182   2HG   MET  25          1HG       MET  25  -0.592 -14.446   4.688
  183   1HE   MET  25          1HE       MET  25  -3.094 -13.125   7.298
  184   2HE   MET  25          2HE       MET  25  -2.613 -14.451   6.181
  185   3HE   MET  25          3HE       MET  25  -3.085 -12.851   5.526
  186    HA   PRO  26           HA       PRO  26   1.846 -11.825  -0.484
  187   1HB   PRO  26          2HB       PRO  26  -0.686 -10.752  -1.135
  188   2HB   PRO  26          1HB       PRO  26  -0.129 -12.392  -1.554
  189   1HG   PRO  26          2HG       PRO  26  -2.050 -11.587   0.619
  190   2HG   PRO  26          1HG       PRO  26  -2.016 -13.033  -0.434
  191   1HD   PRO  26          2HD       PRO  26  -0.865 -12.276   2.228
  192   2HD   PRO  26          1HD       PRO  26  -0.766 -13.985   1.660
  193    H    LEU  27           H        LEU  27   2.120  -9.357  -0.810
  194    HA   LEU  27           HA       LEU  27   2.267  -8.046   1.632
  195   1HB   LEU  27          2HB       LEU  27   3.409  -7.725  -0.724
  196   2HB   LEU  27          1HB       LEU  27   2.053  -6.625  -1.053
  197    HG   LEU  27           HG       LEU  27   4.177  -6.556   1.124
  198   1HD1  LEU  27          1HD1      LEU  27   3.474  -4.790  -1.298
  199   2HD1  LEU  27          2HD1      LEU  27   5.032  -5.650  -0.915
  200   3HD1  LEU  27          3HD1      LEU  27   4.561  -4.173  -0.011
  201   1HD2  LEU  27          1HD2      LEU  27   3.206  -4.303   1.903
  202   2HD2  LEU  27          2HD2      LEU  27   2.200  -5.716   2.328
  203   3HD2  LEU  27          3HD2      LEU  27   1.725  -4.680   0.932
  204    H    THR  28           H        THR  28   0.407  -7.911   2.806
  205    HA   THR  28           HA       THR  28  -1.876  -6.652   1.490
  206    HB   THR  28           HB       THR  28  -3.402  -7.657   2.773
  207    HG1  THR  28           1HG      THR  28  -2.165  -7.951   4.812
  208   1HG2  THR  28          1HG2      THR  28  -1.327  -9.840   2.143
  209   2HG2  THR  28          2HG2      THR  28  -1.961  -8.730   0.876
  210   3HG2  THR  28          3HG2      THR  28  -3.096  -9.796   1.828
  211    H    ILE  29           H        ILE  29  -2.637  -4.869   1.994
  212    HA   ILE  29           HA       ILE  29  -1.832  -3.459   4.454
  213    HB   ILE  29           HB       ILE  29  -3.314  -2.609   1.967
  214   1HG1  ILE  29          2HG1      ILE  29  -0.723  -2.991   1.853
  215   2HG1  ILE  29          1HG1      ILE  29  -1.509  -1.580   1.125
  216   1HG2  ILE  29          1HG2      ILE  29  -2.578  -1.107   4.581
  217   2HG2  ILE  29          2HG2      ILE  29  -4.225  -1.370   3.868
  218   3HG2  ILE  29          3HG2      ILE  29  -3.064  -0.272   3.075
  219   1HD1  ILE  29          1HD1      ILE  29  -0.827  -0.110   2.971
  220   2HD1  ILE  29          2HD1      ILE  29   0.595  -0.985   2.331
  221   3HD1  ILE  29          3HD1      ILE  29  -0.142  -1.515   3.886
  222    H    SER  30           H        SER  30  -3.564  -2.843   5.981
  223    HA   SER  30           HA       SER  30  -5.870  -4.606   5.669
  224   1HB   SER  30          2HB       SER  30  -6.223  -4.496   8.027
  225   2HB   SER  30          1HB       SER  30  -4.599  -5.096   7.602
  226    HG   SER  30           HG       SER  30  -4.647  -3.572   9.325
  227    H    ARG  31           H        ARG  31  -5.580  -1.541   7.403
  228    HA   ARG  31           HA       ARG  31  -7.797  -0.486   5.817
  229   1HB   ARG  31          2HB       ARG  31  -7.784  -1.102   8.761
  230   2HB   ARG  31          1HB       ARG  31  -8.696   0.335   8.240
  231   1HG   ARG  31          2HG       ARG  31  -9.127  -2.445   7.038
  232   2HG   ARG  31          1HG       ARG  31 -10.051  -1.785   8.418
  233   1HD   ARG  31          2HD       ARG  31 -11.037   0.008   7.038
  234   2HD   ARG  31          1HD       ARG  31  -9.943  -0.386   5.670
  235    HE   ARG  31           HE       ARG  31 -11.274  -2.204   5.097
  236   1HH1  ARG  31          1HH1      ARG  31 -12.497  -1.097   8.303
  237   2HH1  ARG  31          2HH1      ARG  31 -13.508  -2.483   8.482
  238   1HH2  ARG  31          1HH2      ARG  31 -12.825  -3.724   5.219
  239   2HH2  ARG  31          2HH2      ARG  31 -13.960  -3.778   6.540
  240    H    ILE  32           H        ILE  32  -8.397   1.792   6.577
  241    HA   ILE  32           HA       ILE  32  -5.975   3.378   6.393
  242    HB   ILE  32           HB       ILE  32  -8.900   3.653   5.774
  243   1HG1  ILE  32          2HG1      ILE  32  -8.241   4.520   3.652
  244   2HG1  ILE  32          1HG1      ILE  32  -6.542   4.638   4.056
  245   1HG2  ILE  32          1HG2      ILE  32  -6.917   5.989   6.036
  246   2HG2  ILE  32          2HG2      ILE  32  -8.472   5.763   6.974
  247   3HG2  ILE  32          3HG2      ILE  32  -8.526   6.044   5.210
  248   1HD1  ILE  32          1HD1      ILE  32  -6.409   2.080   4.065
  249   2HD1  ILE  32          2HD1      ILE  32  -6.992   2.775   2.515
  250   3HD1  ILE  32          3HD1      ILE  32  -8.183   2.045   3.659
  251    H    THR  33           H        THR  33  -5.662   5.184   7.860
  252    HA   THR  33           HA       THR  33  -6.804   4.857  10.468
  253    HB   THR  33           HB       THR  33  -5.105   7.171   9.464
  254    HG1  THR  33           1HG      THR  33  -4.021   5.261   9.238
  255   1HG2  THR  33          1HG2      THR  33  -4.608   7.393  11.923
  256   2HG2  THR  33          2HG2      THR  33  -5.707   6.002  12.271
  257   3HG2  THR  33          3HG2      THR  33  -6.384   7.532  11.643
  258    HA   PRO  34           HA       PRO  34  -9.888   7.915   9.280
  259   1HB   PRO  34          2HB       PRO  34 -10.983   8.592  11.720
  260   2HB   PRO  34          1HB       PRO  34 -11.129   6.920  10.994
  261   1HG   PRO  34          2HG       PRO  34  -8.956   7.710  12.996
  262   2HG   PRO  34          1HG       PRO  34 -10.241   6.435  13.200
  263   1HD   PRO  34          2HD       PRO  34  -7.847   5.751  12.122
  264   2HD   PRO  34          1HD       PRO  34  -9.349   5.149  11.300
  265    H    GLY  35           H        GLY  35  -9.894  10.044   8.869
  266   1HA   GLY  35          2HA       GLY  35  -9.548  12.224   9.260
  267   2HA   GLY  35          1HA       GLY  35  -8.423  11.845  10.601
  268    H    SER  36           H        SER  36  -7.202   9.963   8.334
  269    HA   SER  36           HA       SER  36  -5.258  12.021   7.614
  270   1HB   SER  36          2HB       SER  36  -5.067   8.973   7.667
  271   2HB   SER  36          1HB       SER  36  -3.732  10.067   7.153
  272    HG   SER  36           HG       SER  36  -3.655   9.422   9.377
  273    H    LYS  37           H        LYS  37  -4.042  11.545   5.490
  274    HA   LYS  37           HA       LYS  37  -5.817  12.143   3.498
  275   1HB   LYS  37          2HB       LYS  37  -3.431  12.825   3.650
  276   2HB   LYS  37          1HB       LYS  37  -2.939  11.163   3.210
  277   1HG   LYS  37          2HG       LYS  37  -4.061  11.372   1.018
  278   2HG   LYS  37          1HG       LYS  37  -4.722  12.974   1.441
  279   1HD   LYS  37          2HD       LYS  37  -1.721  12.347   1.387
  280   2HD   LYS  37          1HD       LYS  37  -2.612  12.876  -0.073
  281   1HE   LYS  37          2HE       LYS  37  -3.147  15.059   0.875
  282   2HE   LYS  37          1HE       LYS  37  -2.566  14.559   2.514
  283   1HZ   LYS  37          1HZ       LYS  37  -0.388  14.231   1.603
  284   2HZ   LYS  37          2HZ       LYS  37  -0.877  15.816   1.438
  285   3HZ   LYS  37          3HZ       LYS  37  -0.848  14.783   0.075
  286    H    ALA  38           H        ALA  38  -4.356   9.018   4.230
  287    HA   ALA  38           HA       ALA  38  -5.205   7.446   2.169
  288   1HB   ALA  38          1HB       ALA  38  -5.114   6.749   5.130
  289   2HB   ALA  38          2HB       ALA  38  -3.690   6.855   4.032
  290   3HB   ALA  38          3HB       ALA  38  -4.928   5.634   3.701
  291    H    ALA  39           H        ALA  39  -7.346   8.900   4.588
  292    HA   ALA  39           HA       ALA  39  -9.495   7.212   3.647
  293   1HB   ALA  39          1HB       ALA  39  -9.327   7.931   6.102
  294   2HB   ALA  39          2HB       ALA  39 -10.844   8.526   5.345
  295   3HB   ALA  39          3HB       ALA  39  -9.441   9.634   5.588
  296    H    GLN  40           H        GLN  40  -8.397  10.534   3.386
  297    HA   GLN  40           HA       GLN  40 -10.679  11.735   2.501
  298   1HB   GLN  40          2HB       GLN  40  -7.707  12.301   2.147
  299   2HB   GLN  40          1HB       GLN  40  -8.910  13.479   1.613
  300   1HG   GLN  40          2HG       GLN  40  -8.798  12.384   4.521
  301   2HG   GLN  40          1HG       GLN  40  -7.868  13.809   3.969
  302   1HE2  GLN  40          1HE2      GLN  40  -8.974  15.731   3.398
  303   2HE2  GLN  40          2HE2      GLN  40 -10.543  16.039   4.101
  304    H    SER  41           H        SER  41  -8.099  10.363   0.416
  305    HA   SER  41           HA       SER  41  -9.252  11.927  -1.713
  306   1HB   SER  41          2HB       SER  41  -7.264  11.738  -2.918
  307   2HB   SER  41          1HB       SER  41  -6.893  12.089  -1.203
  308    HG   SER  41           HG       SER  41  -5.731  10.336  -2.504
  309    H    GLN  42           H        GLN  42  -7.721   9.613  -3.415
  310    HA   GLN  42           HA       GLN  42 -10.221   8.298  -4.170
  311   1HB   GLN  42          2HB       GLN  42  -7.413   8.462  -5.372
  312   2HB   GLN  42          1HB       GLN  42  -8.759   7.541  -6.116
  313   1HG   GLN  42          2HG       GLN  42  -9.972   9.571  -6.663
  314   2HG   GLN  42          1HG       GLN  42  -8.934  10.577  -5.598
  315   1HE2  GLN  42          1HE2      GLN  42  -9.405   9.776  -8.855
  316   2HE2  GLN  42          2HE2      GLN  42  -7.819  10.211  -9.414
  317    H    LEU  43           H        LEU  43  -7.421   8.039  -2.281
  318    HA   LEU  43           HA       LEU  43  -6.529   5.510  -2.774
  319   1HB   LEU  43          2HB       LEU  43  -5.542   7.616  -1.495
  320   2HB   LEU  43          1HB       LEU  43  -6.304   6.895  -0.061
  321    HG   LEU  43           HG       LEU  43  -4.990   4.703  -0.777
  322   1HD1  LEU  43          1HD1      LEU  43  -3.510   6.842  -2.429
  323   2HD1  LEU  43          2HD1      LEU  43  -4.357   5.393  -3.061
  324   3HD1  LEU  43          3HD1      LEU  43  -2.872   5.193  -2.052
  325   1HD2  LEU  43          1HD2      LEU  43  -2.776   5.759   0.226
  326   2HD2  LEU  43          2HD2      LEU  43  -4.229   5.664   1.246
  327   3HD2  LEU  43          3HD2      LEU  43  -3.783   7.233   0.458
  328    H    SER  44           H        SER  44  -6.802   3.474  -1.902
  329    HA   SER  44           HA       SER  44  -8.179   3.232   0.607
  330   1HB   SER  44          2HB       SER  44  -9.279   1.923  -1.939
  331   2HB   SER  44          1HB       SER  44  -9.717   1.396  -0.277
  332    HG   SER  44           HG       SER  44  -9.936   4.079  -1.063
  333    H    GLN  45           H        GLN  45  -5.470   2.838   0.427
  334    HA   GLN  45           HA       GLN  45  -4.552   0.498  -0.350
  335   1HB   GLN  45          2HB       GLN  45  -3.955   1.885   2.311
  336   2HB   GLN  45          1HB       GLN  45  -2.874   0.767   1.396
  337   1HG   GLN  45          2HG       GLN  45  -2.760   2.334  -0.477
  338   2HG   GLN  45          1HG       GLN  45  -3.809   3.506   0.393
  339   1HE2  GLN  45          2HE2      GLN  45  -0.637   2.200   0.214
  340   2HE2  GLN  45          1HE2      GLN  45   0.182   3.396   1.255
  341    H    GLY  46           H        GLY  46  -5.126  -1.526  -0.055
  342   1HA   GLY  46          2HA       GLY  46  -5.304  -2.839   2.343
  343   2HA   GLY  46          1HA       GLY  46  -6.945  -2.183   2.057
  344    H    ASP  47           H        ASP  47  -4.475  -3.839   0.022
  345    HA   ASP  47           HA       ASP  47  -5.992  -6.161  -0.020
  346   1HB   ASP  47          2HB       ASP  47  -7.174  -4.483  -1.796
  347   2HB   ASP  47          1HB       ASP  47  -5.833  -4.949  -2.854
  348    H    LEU  48           H        LEU  48  -4.914  -7.167  -2.553
  349    HA   LEU  48           HA       LEU  48  -2.264  -7.680  -1.625
  350   1HB   LEU  48          2HB       LEU  48  -3.795  -8.693  -4.071
  351   2HB   LEU  48          1HB       LEU  48  -2.170  -9.225  -3.541
  352    HG   LEU  48           HG       LEU  48  -3.480 -10.942  -2.653
  353   1HD1  LEU  48          1HD1      LEU  48  -3.702 -10.773  -0.285
  354   2HD1  LEU  48          2HD1      LEU  48  -3.774  -8.983  -0.313
  355   3HD1  LEU  48          3HD1      LEU  48  -2.236  -9.785  -0.770
  356   1HD2  LEU  48          1HD2      LEU  48  -5.765  -9.513  -3.114
  357   2HD2  LEU  48          2HD2      LEU  48  -5.456  -8.963  -1.403
  358   3HD2  LEU  48          3HD2      LEU  48  -5.700 -10.718  -1.704
  359    H    VAL  49           H        VAL  49  -0.911  -6.009  -1.894
  360    HA   VAL  49           HA       VAL  49  -1.093  -4.258  -4.069
  361    HB   VAL  49           HB       VAL  49   1.182  -4.609  -2.093
  362   1HG1  VAL  49          1HG1      VAL  49   1.408  -2.143  -2.487
  363   2HG1  VAL  49          2HG1      VAL  49   0.089  -2.210  -3.715
  364   3HG1  VAL  49          3HG1      VAL  49   1.660  -3.056  -4.031
  365   1HG2  VAL  49          1HG2      VAL  49  -1.502  -3.108  -1.824
  366   2HG2  VAL  49          2HG2      VAL  49  -0.074  -2.851  -0.769
  367   3HG2  VAL  49          3HG2      VAL  49  -0.893  -4.440  -0.773
  368    H    VAL  50           H        VAL  50   0.020  -4.314  -6.037
  369    HA   VAL  50           HA       VAL  50   1.604  -6.700  -6.555
  370    HB   VAL  50           HB       VAL  50   0.668  -4.812  -8.713
  371   1HG1  VAL  50          1HG1      VAL  50   2.264  -6.695  -9.216
  372   2HG1  VAL  50          2HG1      VAL  50   0.649  -6.955  -9.966
  373   3HG1  VAL  50          3HG1      VAL  50   1.096  -7.864  -8.477
  374   1HG2  VAL  50          1HG2      VAL  50  -1.374  -5.060  -7.564
  375   2HG2  VAL  50          2HG2      VAL  50  -1.090  -6.823  -7.192
  376   3HG2  VAL  50          3HG2      VAL  50  -1.395  -6.271  -8.884
  377    H    ALA  51           H        ALA  51   1.581  -3.205  -7.158
  378    HA   ALA  51           HA       ALA  51   4.498  -3.218  -7.126
  379   1HB   ALA  51          1HB       ALA  51   4.613  -1.637  -9.041
  380   2HB   ALA  51          2HB       ALA  51   2.821  -1.714  -9.228
  381   3HB   ALA  51          3HB       ALA  51   3.829  -3.171  -9.545
  382    H    ILE  52           H        ILE  52   5.438  -1.555  -6.158
  383    HA   ILE  52           HA       ILE  52   3.693   0.452  -4.947
  384    HB   ILE  52           HB       ILE  52   5.017  -1.558  -3.715
  385   1HG1  ILE  52          2HG1      ILE  52   4.307   1.183  -2.533
  386   2HG1  ILE  52          1HG1      ILE  52   3.154  -0.155  -2.876
  387   1HG2  ILE  52          1HG2      ILE  52   7.243  -0.616  -4.199
  388   2HG2  ILE  52          2HG2      ILE  52   6.892  -0.630  -2.446
  389   3HG2  ILE  52          3HG2      ILE  52   6.789   0.930  -3.368
  390   1HD1  ILE  52          1HD1      ILE  52   5.492  -0.252  -0.854
  391   2HD1  ILE  52          2HD1      ILE  52   4.445  -1.651  -1.293
  392   3HD1  ILE  52          3HD1      ILE  52   3.737  -0.207  -0.488
  393    H    ASP  53           H        ASP  53   3.941   2.319  -5.848
  394    HA   ASP  53           HA       ASP  53   4.600   3.850  -7.142
  395   1HB   ASP  53          2HB       ASP  53   5.844   4.175  -4.914
  396   2HB   ASP  53          1HB       ASP  53   7.335   3.725  -5.813
  397    H    GLY  54           H        GLY  54   4.884   1.248  -8.254
  398   1HA   GLY  54          2HA       GLY  54   5.220   0.884 -10.513
  399   2HA   GLY  54          1HA       GLY  54   6.678   1.923 -10.483
  400    H    VAL  55           H        VAL  55   7.137   0.148  -7.776
  401    HA   VAL  55           HA       VAL  55   8.692  -1.810  -9.290
  402    HB   VAL  55           HB       VAL  55   9.076  -0.646  -6.518
  403   1HG1  VAL  55          1HG1      VAL  55   9.827  -3.014  -6.509
  404   2HG1  VAL  55          2HG1      VAL  55  11.263  -1.955  -6.626
  405   3HG1  VAL  55          3HG1      VAL  55  10.650  -2.793  -8.100
  406   1HG2  VAL  55          1HG2      VAL  55   9.663   0.912  -8.386
  407   2HG2  VAL  55          2HG2      VAL  55  10.653  -0.379  -9.168
  408   3HG2  VAL  55          3HG2      VAL  55  11.147   0.306  -7.569
  409    H    ASN  56           H        ASN  56   8.343  -3.973  -8.994
  410    HA   ASN  56           HA       ASN  56   5.898  -4.628  -7.793
  411   1HB   ASN  56          2HB       ASN  56   6.273  -6.859  -8.720
  412   2HB   ASN  56          1HB       ASN  56   6.650  -5.555  -9.897
  413   1HD2  ASN  56          1HD2      ASN  56   7.690  -8.488  -9.204
  414   2HD2  ASN  56          2HD2      ASN  56   9.402  -8.287  -9.491
  415    H    THR  57           H        THR  57   5.312  -5.964  -6.174
  416    HA   THR  57           HA       THR  57   6.937  -5.707  -3.858
  417    HB   THR  57           HB       THR  57   4.767  -6.387  -2.784
  418    HG1  THR  57           1HG      THR  57   3.016  -6.526  -4.238
  419   1HG2  THR  57          1HG2      THR  57   3.588  -4.310  -3.469
  420   2HG2  THR  57          2HG2      THR  57   4.576  -4.192  -4.975
  421   3HG2  THR  57          3HG2      THR  57   5.361  -3.996  -3.375
  422    H    ASP  58           H        ASP  58   7.069  -8.078  -5.994
  423    HA   ASP  58           HA       ASP  58   6.190 -10.376  -5.052
  424   1HB   ASP  58          2HB       ASP  58   7.376  -9.714  -7.239
  425   2HB   ASP  58          1HB       ASP  58   8.932 -10.013  -6.389
  426    H    THR  59           H        THR  59   9.400  -9.091  -4.075
  427    HA   THR  59           HA       THR  59   9.244 -10.939  -1.805
  428    HB   THR  59           HB       THR  59  10.707 -11.817  -3.482
  429    HG1  THR  59           1HG      THR  59  12.156 -12.390  -2.113
  430   1HG2  THR  59          1HG2      THR  59  12.474  -9.338  -2.940
  431   2HG2  THR  59          2HG2      THR  59  11.598  -9.701  -4.479
  432   3HG2  THR  59          3HG2      THR  59  12.916 -10.781  -3.914
  433    H    MET  60           H        MET  60   8.221  -8.168  -1.968
  434    HA   MET  60           HA       MET  60  10.002  -6.689  -0.325
  435   1HB   MET  60          2HB       MET  60   8.712  -5.965  -2.431
  436   2HB   MET  60          1HB       MET  60   7.195  -6.235  -1.521
  437   1HG   MET  60          2HG       MET  60   8.040  -4.560   0.187
  438   2HG   MET  60          1HG       MET  60   9.447  -4.253  -0.919
  439   1HE   MET  60          1HE       MET  60   8.549  -4.279  -3.707
  440   2HE   MET  60          2HE       MET  60   9.311  -2.755  -3.170
  441   3HE   MET  60          3HE       MET  60   7.790  -2.718  -4.120
  442    H    THR  61           H        THR  61   9.768  -6.782   1.912
  443    HA   THR  61           HA       THR  61   7.624  -8.381   2.942
  444    HB   THR  61           HB       THR  61   8.896  -8.280   5.047
  445    HG1  THR  61           1HG      THR  61  11.006  -7.337   4.775
  446   1HG2  THR  61          1HG2      THR  61   9.393  -9.987   3.238
  447   2HG2  THR  61          2HG2      THR  61  10.848  -9.536   4.187
  448   3HG2  THR  61          3HG2      THR  61  10.608  -8.870   2.532
  449    H    HIS  62           H        HIS  62   6.919  -7.577   5.318
  450    HA   HIS  62           HA       HIS  62   5.319  -5.333   5.093
  451   1HB   HIS  62          2HB       HIS  62   4.847  -7.119   6.673
  452   2HB   HIS  62          1HB       HIS  62   6.442  -6.921   7.450
  453    HD1  HIS  62           1HD      HIS  62   3.095  -5.016   7.198
  454    HD2  HIS  62           2HD      HIS  62   6.489  -5.370   9.632
  455    HE1  HIS  62           1HE      HIS  62   2.659  -3.708   9.355
  456    H    LEU  63           H        LEU  63   8.496  -5.692   6.723
  457    HA   LEU  63           HA       LEU  63   8.861  -3.027   7.391
  458   1HB   LEU  63          2HB       LEU  63  10.191  -4.948   8.243
  459   2HB   LEU  63          1HB       LEU  63  10.867  -5.201   6.613
  460    HG   LEU  63           HG       LEU  63  11.885  -2.874   6.728
  461   1HD1  LEU  63          1HD1      LEU  63  10.452  -1.823   8.485
  462   2HD1  LEU  63          2HD1      LEU  63  12.177  -1.844   9.002
  463   3HD1  LEU  63          3HD1      LEU  63  11.019  -3.038   9.696
  464   1HD2  LEU  63          1HD2      LEU  63  13.173  -4.910   7.106
  465   2HD2  LEU  63          2HD2      LEU  63  12.704  -4.929   8.860
  466   3HD2  LEU  63          3HD2      LEU  63  13.743  -3.598   8.212
  467    H    GLU  64           H        GLU  64   9.965  -4.778   4.404
  468    HA   GLU  64           HA       GLU  64  11.193  -2.578   3.349
  469   1HB   GLU  64          2HB       GLU  64  11.012  -5.200   2.643
  470   2HB   GLU  64          1HB       GLU  64   9.944  -4.509   1.375
  471   1HG   GLU  64          2HG       GLU  64  11.835  -2.815   0.912
  472   2HG   GLU  64          1HG       GLU  64  12.818  -3.682   2.144
  473    H    ALA  65           H        ALA  65   7.819  -3.666   2.796
  474    HA   ALA  65           HA       ALA  65   7.183  -1.722   0.920
  475   1HB   ALA  65          1HB       ALA  65   6.055  -3.923   1.400
  476   2HB   ALA  65          2HB       ALA  65   4.880  -2.544   1.363
  477   3HB   ALA  65          3HB       ALA  65   5.428  -3.253   2.942
  478    H    GLN  66           H        GLN  66   7.042  -1.658   4.446
  479    HA   GLN  66           HA       GLN  66   5.687   0.775   4.759
  480   1HB   GLN  66          2HB       GLN  66   6.040  -0.894   6.576
  481   2HB   GLN  66          1HB       GLN  66   7.768  -0.848   6.291
  482   1HG   GLN  66          2HG       GLN  66   7.587   0.219   8.283
  483   2HG   GLN  66          1HG       GLN  66   7.862   1.565   7.153
  484   1HE2  GLN  66          1HE2      GLN  66   4.583   0.147   7.304
  485   2HE2  GLN  66          2HE2      GLN  66   3.906   1.364   8.353
  486    H    ASN  67           H        ASN  67   9.162  -0.039   4.547
  487    HA   ASN  67           HA       ASN  67  10.099   2.581   4.542
  488   1HB   ASN  67          2HB       ASN  67  11.196  -0.127   3.604
  489   2HB   ASN  67          1HB       ASN  67  12.177   1.365   3.448
  490   1HD2  ASN  67          1HD2      ASN  67  13.249  -0.574   4.968
  491   2HD2  ASN  67          2HD2      ASN  67  13.178  -0.106   6.646
  492    H    LYS  68           H        LYS  68   9.229   0.538   1.735
  493    HA   LYS  68           HA       LYS  68  10.062   2.367  -0.151
  494   1HB   LYS  68          2HB       LYS  68   7.653   0.508  -0.422
  495   2HB   LYS  68          1HB       LYS  68   8.515   1.350  -1.745
  496   1HG   LYS  68          2HG       LYS  68   9.354  -1.112  -0.188
  497   2HG   LYS  68          1HG       LYS  68   9.165  -0.828  -1.921
  498   1HD   LYS  68          2HD       LYS  68  11.257   0.707  -1.799
  499   2HD   LYS  68          1HD       LYS  68  11.432   0.113  -0.112
  500   1HE   LYS  68          2HE       LYS  68  11.095  -2.283  -1.350
  501   2HE   LYS  68          1HE       LYS  68  11.745  -1.401  -2.777
  502   1HZ   LYS  68          1HZ       LYS  68  13.824  -1.199  -1.690
  503   2HZ   LYS  68          2HZ       LYS  68  13.215  -2.655  -1.085
  504   3HZ   LYS  68          3HZ       LYS  68  13.140  -1.271  -0.157
  505    H    ILE  69           H        ILE  69   6.642   2.064   1.101
  506    HA   ILE  69           HA       ILE  69   5.632   4.291   0.008
  507    HB   ILE  69           HB       ILE  69   5.209   2.814   2.602
  508   1HG1  ILE  69          2HG1      ILE  69   3.668   3.232  -0.028
  509   2HG1  ILE  69          1HG1      ILE  69   4.367   1.698   0.505
  510   1HG2  ILE  69          1HG2      ILE  69   4.628   5.133   3.192
  511   2HG2  ILE  69          2HG2      ILE  69   3.119   4.249   2.902
  512   3HG2  ILE  69          3HG2      ILE  69   3.756   5.332   1.619
  513   1HD1  ILE  69          1HD1      ILE  69   2.880   1.602   2.492
  514   2HD1  ILE  69          2HD1      ILE  69   2.065   1.429   0.898
  515   3HD1  ILE  69          3HD1      ILE  69   1.932   2.977   1.804
  516    H    LYS  70           H        LYS  70   7.556   4.212   3.036
  517    HA   LYS  70           HA       LYS  70   7.180   6.982   3.467
  518   1HB   LYS  70          2HB       LYS  70   8.626   4.689   4.720
  519   2HB   LYS  70          1HB       LYS  70   9.322   6.285   5.042
  520   1HG   LYS  70          2HG       LYS  70   7.841   5.667   6.815
  521   2HG   LYS  70          1HG       LYS  70   7.260   7.140   5.990
  522   1HD   LYS  70          2HD       LYS  70   5.453   5.915   4.898
  523   2HD   LYS  70          1HD       LYS  70   6.153   4.342   5.374
  524   1HE   LYS  70          2HE       LYS  70   4.179   4.869   6.774
  525   2HE   LYS  70          1HE       LYS  70   5.683   4.777   7.776
  526   1HZ   LYS  70          1HZ       LYS  70   4.544   7.317   6.734
  527   2HZ   LYS  70          2HZ       LYS  70   5.782   7.120   7.881
  528   3HZ   LYS  70          3HZ       LYS  70   4.221   6.679   8.281
  529    H    SER  71           H        SER  71   8.974   5.647   1.035
  530    HA   SER  71           HA       SER  71  11.143   7.611   1.265
  531   1HB   SER  71          2HB       SER  71  10.779   5.205  -0.606
  532   2HB   SER  71          1HB       SER  71  12.173   6.341  -0.622
  533    HG   SER  71           HG       SER  71  11.383   4.628   1.498
  534    H    ALA  72           H        ALA  72   8.073   7.494   0.146
  535    HA   ALA  72           HA       ALA  72   8.599   9.011  -2.315
  536   1HB   ALA  72          1HB       ALA  72   7.328   6.855  -2.528
  537   2HB   ALA  72          2HB       ALA  72   6.228   8.251  -2.856
  538   3HB   ALA  72          3HB       ALA  72   6.203   7.407  -1.249
  539    H    SER  73           H        SER  73   7.627  11.021  -2.579
  540    HA   SER  73           HA       SER  73   5.648  11.849  -0.624
  541   1HB   SER  73          2HB       SER  73   8.139  13.548  -1.160
  542   2HB   SER  73          1HB       SER  73   6.639  14.121  -0.336
  543    HG   SER  73           HG       SER  73   6.997  12.500   1.229
  544    H    TYR  74           H        TYR  74   7.480  12.795  -3.576
  545    HA   TYR  74           HA       TYR  74   5.435  14.632  -4.313
  546   1HB   TYR  74          2HB       TYR  74   8.065  13.617  -5.495
  547   2HB   TYR  74          1HB       TYR  74   6.891  14.390  -6.617
  548    HD1  TYR  74           1HD      TYR  74   5.676  16.494  -5.508
  549    HD2  TYR  74           2HD      TYR  74   9.671  15.203  -4.845
  550    HE1  TYR  74           1HE      TYR  74   6.309  18.771  -5.026
  551    HE2  TYR  74           2HE      TYR  74  10.319  17.509  -4.317
  552    HH   TYR  74           HH       TYR  74   7.925  20.144  -4.273
  553    H    ASN  75           H        ASN  75   6.045  11.246  -4.995
  554    HA   ASN  75           HA       ASN  75   3.268  11.209  -5.456
  555   1HB   ASN  75          2HB       ASN  75   3.254   9.801  -7.535
  556   2HB   ASN  75          1HB       ASN  75   3.799  11.480  -7.824
  557   1HD2  ASN  75          1HD2      ASN  75   5.167   8.088  -7.243
  558   2HD2  ASN  75          2HD2      ASN  75   6.174   8.261  -8.615
  559    H    LEU  76           H        LEU  76   2.426   9.379  -4.538
  560    HA   LEU  76           HA       LEU  76   4.220   7.033  -4.473
  561   1HB   LEU  76          2HB       LEU  76   3.831   7.982  -2.186
  562   2HB   LEU  76          1HB       LEU  76   2.099   7.955  -2.456
  563    HG   LEU  76           HG       LEU  76   2.127   5.428  -2.635
  564   1HD1  LEU  76          1HD1      LEU  76   5.038   5.676  -1.650
  565   2HD1  LEU  76          2HD1      LEU  76   4.583   5.158  -3.325
  566   3HD1  LEU  76          3HD1      LEU  76   4.118   4.157  -1.898
  567   1HD2  LEU  76          1HD2      LEU  76   2.403   5.049  -0.202
  568   2HD2  LEU  76          2HD2      LEU  76   1.612   6.645  -0.490
  569   3HD2  LEU  76          3HD2      LEU  76   3.358   6.572  -0.063
  570    H    SER  77           H        SER  77   3.511   5.907  -6.204
  571    HA   SER  77           HA       SER  77   0.619   5.814  -6.695
  572   1HB   SER  77          2HB       SER  77   2.273   6.627  -8.472
  573   2HB   SER  77          1HB       SER  77   2.830   4.938  -8.604
  574    HG   SER  77           HG       SER  77   0.261   6.051  -9.060
  575    H    LEU  78           H        LEU  78  -0.427   4.089  -5.783
  576    HA   LEU  78           HA       LEU  78   1.146   1.628  -5.501
  577   1HB   LEU  78          2HB       LEU  78  -1.530   2.215  -4.206
  578   2HB   LEU  78          1HB       LEU  78  -0.353   0.933  -3.810
  579    HG   LEU  78           HG       LEU  78  -0.246   2.468  -2.048
  580   1HD1  LEU  78          1HD1      LEU  78   2.042   3.160  -1.957
  581   2HD1  LEU  78          2HD1      LEU  78   2.183   3.242  -3.757
  582   3HD1  LEU  78          3HD1      LEU  78   1.963   1.647  -2.938
  583   1HD2  LEU  78          1HD2      LEU  78  -0.098   4.826  -2.072
  584   2HD2  LEU  78          2HD2      LEU  78  -1.391   4.387  -3.255
  585   3HD2  LEU  78          3HD2      LEU  78   0.227   4.897  -3.835
  586    H    THR  79           H        THR  79   0.629  -0.183  -6.596
  587    HA   THR  79           HA       THR  79  -1.904  -0.300  -8.047
  588    HB   THR  79           HB       THR  79   0.652  -1.827  -8.708
  589    HG1  THR  79           1HG      THR  79   0.923  -0.359 -10.328
  590   1HG2  THR  79          1HG2      THR  79  -1.964  -1.154 -10.218
  591   2HG2  THR  79          2HG2      THR  79  -1.526  -2.769  -9.533
  592   3HG2  THR  79          3HG2      THR  79  -0.571  -2.081 -10.900
  593    H    LEU  80           H        LEU  80  -3.231  -1.645  -6.760
  594    HA   LEU  80           HA       LEU  80  -2.166  -4.221  -5.906
  595   1HB   LEU  80          2HB       LEU  80  -3.385  -4.116  -3.865
  596   2HB   LEU  80          1HB       LEU  80  -2.306  -2.666  -3.962
  597    HG   LEU  80           HG       LEU  80  -5.269  -2.851  -4.514
  598   1HD1  LEU  80          1HD1      LEU  80  -4.552  -3.084  -2.131
  599   2HD1  LEU  80          2HD1      LEU  80  -5.582  -1.590  -2.435
  600   3HD1  LEU  80          3HD1      LEU  80  -3.767  -1.436  -2.236
  601   1HD2  LEU  80          1HD2      LEU  80  -3.163  -0.662  -4.705
  602   2HD2  LEU  80          2HD2      LEU  80  -4.870  -0.140  -4.225
  603   3HD2  LEU  80          3HD2      LEU  80  -4.568  -0.977  -5.829
  604    H    GLN  81           H        GLN  81  -4.152  -5.751  -5.455
  605    HA   GLN  81           HA       GLN  81  -5.896  -5.486  -7.709
  606   1HB   GLN  81          2HB       GLN  81  -5.890  -7.576  -5.520
  607   2HB   GLN  81          1HB       GLN  81  -6.860  -7.592  -7.043
  608   1HG   GLN  81          2HG       GLN  81  -4.748  -7.581  -8.404
  609   2HG   GLN  81          1HG       GLN  81  -3.782  -7.649  -6.890
  610   1HE2  GLN  81          1HE2      GLN  81  -3.049  -9.718  -6.565
  611   2HE2  GLN  81          2HE2      GLN  81  -3.953 -11.166  -6.871
  612    H    LYS  82           H        LYS  82  -8.337  -5.565  -7.552
  613    HA   LYS  82           HA       LYS  82  -9.152  -3.586  -5.838
  614   1HB   LYS  82          2HB       LYS  82 -10.140  -4.471  -8.100
  615   2HB   LYS  82          1HB       LYS  82 -11.047  -5.644  -7.114
  616   1HG   LYS  82          2HG       LYS  82 -12.405  -3.661  -7.634
  617   2HG   LYS  82          1HG       LYS  82 -12.128  -3.715  -5.876
  618   1HD   LYS  82          2HD       LYS  82  -9.906  -2.342  -7.245
  619   2HD   LYS  82          1HD       LYS  82 -11.405  -1.678  -7.881
  620   1HE   LYS  82          2HE       LYS  82 -10.233  -0.500  -5.870
  621   2HE   LYS  82          1HE       LYS  82 -12.044  -0.647  -5.881
  622   1HZ   LYS  82          1HZ       LYS  82 -10.265  -2.529  -4.358
  623   2HZ   LYS  82          2HZ       LYS  82 -11.947  -2.328  -4.296
  624   3HZ   LYS  82          3HZ       LYS  82 -10.958  -1.130  -3.735
  625    H    SER  83           H        SER  83  -9.866  -6.916  -5.703
  626    HA   SER  83           HA       SER  83  -9.604  -7.179  -2.966
  627   1HB   SER  83          2HB       SER  83 -11.876  -7.764  -2.150
  628   2HB   SER  83          1HB       SER  83 -11.633  -6.036  -2.514
  629    HG   SER  83           HG       SER  83 -13.444  -6.383  -3.498
  630    H    LYS  84           H        LYS  84  -8.298  -8.877  -3.658
  631    HA   LYS  84           HA       LYS  84  -9.570 -11.046  -5.065
  632   1HB   LYS  84          2HB       LYS  84  -6.983 -10.256  -4.883
  633   2HB   LYS  84          1HB       LYS  84  -6.982 -11.557  -3.663
  634   1HG   LYS  84          2HG       LYS  84  -7.796 -11.777  -6.630
  635   2HG   LYS  84          1HG       LYS  84  -6.245 -12.276  -5.896
  636   1HD   LYS  84          2HD       LYS  84  -7.635 -13.869  -4.399
  637   2HD   LYS  84          1HD       LYS  84  -8.995 -13.596  -5.522
  638   1HE   LYS  84          2HE       LYS  84  -6.195 -14.668  -6.289
  639   2HE   LYS  84          1HE       LYS  84  -7.653 -15.686  -6.001
  640   1HZ   LYS  84          1HZ       LYS  84  -8.712 -14.705  -7.894
  641   2HZ   LYS  84          2HZ       LYS  84  -7.164 -15.233  -8.328
  642   3HZ   LYS  84          3HZ       LYS  84  -7.453 -13.592  -8.118
  643    H    ARG  85           H        ARG  85 -10.651 -12.743  -4.188
  644    HA   ARG  85           HA       ARG  85 -10.299 -13.289  -1.362
  645   1HB   ARG  85          2HB       ARG  85 -12.440 -11.704  -2.523
  646   2HB   ARG  85          1HB       ARG  85 -13.157 -13.240  -2.000
  647   1HG   ARG  85          2HG       ARG  85 -11.541 -11.308  -0.222
  648   2HG   ARG  85          1HG       ARG  85 -13.330 -11.468  -0.296
  649   1HD   ARG  85          2HD       ARG  85 -13.080 -13.914   0.399
  650   2HD   ARG  85          1HD       ARG  85 -11.320 -13.588   0.682
  651    HE   ARG  85           HE       ARG  85 -12.856 -11.587   2.090
  652   1HH1  ARG  85          1HH1      ARG  85 -12.199 -15.116   2.213
  653   2HH1  ARG  85          2HH1      ARG  85 -12.645 -15.227   3.887
  654   1HH2  ARG  85          1HH2      ARG  85 -13.851 -11.962   4.195
  655   2HH2  ARG  85          2HH2      ARG  85 -13.713 -13.494   4.918
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  -9.352  -7.400  -9.468
    2   2H    MET   1          2HT       MET   1  -7.771  -7.900  -9.662
    3   3H    MET   1          3HT       MET   1  -8.975  -8.479 -10.697
    4    HA   MET   1           HA       MET   1  -7.627  -6.789 -11.790
    5   1HB   MET   1          2HB       MET   1 -10.389  -5.691 -11.025
    6   2HB   MET   1          1HB       MET   1  -9.379  -5.088 -12.368
    7   1HG   MET   1          2HG       MET   1  -9.501  -7.339 -13.475
    8   2HG   MET   1          1HG       MET   1 -10.602  -7.895 -12.178
    9   1HE   MET   1          1HE       MET   1 -11.136  -8.033 -15.269
   10   2HE   MET   1          2HE       MET   1 -12.894  -7.666 -15.261
   11   3HE   MET   1          3HE       MET   1 -12.187  -8.675 -13.956
   12    H    ALA   2           H        ALA   2  -6.077  -5.215 -11.396
   13    HA   ALA   2           HA       ALA   2  -6.391  -3.842  -8.839
   14   1HB   ALA   2          1HB       ALA   2  -4.527  -5.324  -8.931
   15   2HB   ALA   2          2HB       ALA   2  -3.918  -3.639  -8.900
   16   3HB   ALA   2          3HB       ALA   2  -3.903  -4.563 -10.457
   17    H    TYR   3           H        TYR   3  -5.765  -1.837  -8.376
   18    HA   TYR   3           HA       TYR   3  -6.143   0.044 -10.583
   19   1HB   TYR   3          2HB       TYR   3  -7.533   1.412  -9.421
   20   2HB   TYR   3          1HB       TYR   3  -8.196  -0.224  -9.133
   21    HD1  TYR   3           1HD      TYR   3  -7.586   2.781  -7.792
   22    HD2  TYR   3           2HD      TYR   3  -7.006  -1.304  -6.756
   23    HE1  TYR   3           1HE      TYR   3  -7.685   3.363  -5.397
   24    HE2  TYR   3           2HE      TYR   3  -7.176  -0.757  -4.426
   25    HH   TYR   3           HH       TYR   3  -7.403   0.900  -2.868
   26    H    SER   4           H        SER   4  -5.059   2.067 -10.416
   27    HA   SER   4           HA       SER   4  -2.913   2.094  -8.431
   28   1HB   SER   4          2HB       SER   4  -1.442   3.201 -10.099
   29   2HB   SER   4          1HB       SER   4  -1.868   1.517 -10.511
   30    HG   SER   4           HG       SER   4  -2.401   3.795 -11.886
   31    H    VAL   5           H        VAL   5  -2.502   4.036  -7.433
   32    HA   VAL   5           HA       VAL   5  -3.664   6.434  -8.517
   33    HB   VAL   5           HB       VAL   5  -5.506   6.023  -7.262
   34   1HG1  VAL   5          1HG1      VAL   5  -5.520   5.107  -4.969
   35   2HG1  VAL   5          2HG1      VAL   5  -3.762   4.705  -5.137
   36   3HG1  VAL   5          3HG1      VAL   5  -4.994   3.948  -6.230
   37   1HG2  VAL   5          1HG2      VAL   5  -5.503   7.556  -5.383
   38   2HG2  VAL   5          2HG2      VAL   5  -4.465   8.246  -6.683
   39   3HG2  VAL   5          3HG2      VAL   5  -3.717   7.480  -5.230
   40    H    THR   6           H        THR   6  -2.425   8.144  -8.249
   41    HA   THR   6           HA       THR   6   0.067   7.770  -6.803
   42    HB   THR   6           HB       THR   6  -0.823   9.798  -8.852
   43    HG1  THR   6           1HG      THR   6   1.502   8.591  -9.268
   44   1HG2  THR   6          1HG2      THR   6   0.672  11.002  -7.219
   45   2HG2  THR   6          2HG2      THR   6   1.574  10.646  -8.706
   46   3HG2  THR   6          3HG2      THR   6   1.833   9.614  -7.251
   47    H    LEU   7           H        LEU   7   0.269   8.570  -4.829
   48    HA   LEU   7           HA       LEU   7  -1.429  10.766  -3.971
   49   1HB   LEU   7          2HB       LEU   7  -0.987   8.312  -2.941
   50   2HB   LEU   7          1HB       LEU   7   0.437   9.099  -2.230
   51    HG   LEU   7           HG       LEU   7  -1.075  10.723  -1.084
   52   1HD1  LEU   7          1HD1      LEU   7  -3.568  10.242  -0.995
   53   2HD1  LEU   7          2HD1      LEU   7  -3.366   9.085  -2.362
   54   3HD1  LEU   7          3HD1      LEU   7  -3.035  10.848  -2.602
   55   1HD2  LEU   7          1HD2      LEU   7  -2.026   9.030   0.530
   56   2HD2  LEU   7          2HD2      LEU   7  -0.399   8.499  -0.051
   57   3HD2  LEU   7          3HD2      LEU   7  -1.874   7.748  -0.735
   58    H    THR   8           H        THR   8  -0.567  12.763  -3.538
   59    HA   THR   8           HA       THR   8   2.313  13.066  -4.025
   60    HB   THR   8           HB       THR   8   0.993  13.625  -6.006
   61    HG1  THR   8           1HG      THR   8   2.169  15.717  -4.588
   62   1HG2  THR   8          1HG2      THR   8  -0.329  15.776  -4.201
   63   2HG2  THR   8          2HG2      THR   8  -1.141  14.316  -4.898
   64   3HG2  THR   8          3HG2      THR   8  -0.518  15.601  -5.975
   65    H    GLY   9           H        GLY   9   0.318  13.210  -1.584
   66   1HA   GLY   9          2HA       GLY   9   0.645  15.994  -0.852
   67   2HA   GLY   9          1HA       GLY   9  -0.255  14.720  -0.010
   68    HA   PRO  10           HA       PRO  10   4.288  14.307   1.084
   69   1HB   PRO  10          2HB       PRO  10   5.634  16.586   1.940
   70   2HB   PRO  10          1HB       PRO  10   5.484  16.120   0.205
   71   1HG   PRO  10          2HG       PRO  10   3.672  18.066   1.745
   72   2HG   PRO  10          1HG       PRO  10   4.535  18.359   0.173
   73   1HD   PRO  10          2HD       PRO  10   1.905  17.515   0.238
   74   2HD   PRO  10          1HD       PRO  10   3.056  16.836  -1.001
   75    H    GLY  11           H        GLY  11   4.512  13.280   2.927
   76   1HA   GLY  11          2HA       GLY  11   4.779  13.892   5.388
   77   2HA   GLY  11          1HA       GLY  11   3.017  14.268   5.202
   78    HA   PRO  12           HA       PRO  12   3.171   9.803   5.977
   79   1HB   PRO  12          2HB       PRO  12   1.632   9.681   8.245
   80   2HB   PRO  12          1HB       PRO  12   3.362  10.202   8.300
   81   1HG   PRO  12          2HG       PRO  12   0.896  12.043   8.153
   82   2HG   PRO  12          1HG       PRO  12   2.248  12.081   9.365
   83   1HD   PRO  12          2HD       PRO  12   2.250  13.654   7.084
   84   2HD   PRO  12          1HD       PRO  12   3.797  12.937   7.736
   85    H    TRP  13           H        TRP  13   1.316   8.260   6.018
   86    HA   TRP  13           HA       TRP  13  -0.690   9.410   4.214
   87   1HB   TRP  13          2HB       TRP  13   0.444   6.587   4.027
   88   2HB   TRP  13          1HB       TRP  13  -0.590   7.362   2.888
   89    HD1  TRP  13           HD       TRP  13   2.951   6.759   3.611
   90    HE1  TRP  13           1HE      TRP  13   4.452   8.041   1.956
   91    HE3  TRP  13           3HE      TRP  13  -0.417  10.202   2.034
   92    HZ2  TRP  13           2HZ      TRP  13   4.198  10.218   0.207
   93    HZ3  TRP  13           3HZ      TRP  13   0.274  11.849   0.370
   94    HH2  TRP  13           HH       TRP  13   2.545  11.863  -0.536
   95    H    GLY  14           H        GLY  14  -0.385   6.785   6.670
   96   1HA   GLY  14          2HA       GLY  14  -1.804   6.820   8.414
   97   2HA   GLY  14          1HA       GLY  14  -3.110   7.500   7.416
   98    H    PHE  15           H        PHE  15  -1.256   4.588   6.593
   99    HA   PHE  15           HA       PHE  15  -3.725   3.020   6.911
  100   1HB   PHE  15          2HB       PHE  15  -2.952   1.841   4.817
  101   2HB   PHE  15          1HB       PHE  15  -3.027   3.568   4.558
  102    HD1  PHE  15           1HD      PHE  15  -0.985   4.873   4.431
  103    HD2  PHE  15           2HD      PHE  15  -0.760   0.685   5.138
  104    HE1  PHE  15           1HE      PHE  15   1.503   4.946   4.310
  105    HE2  PHE  15           2HE      PHE  15   1.632   0.745   4.748
  106    HZ   PHE  15           HZ       PHE  15   2.787   2.883   4.506
  107    H    ARG  16           H        ARG  16  -3.544   0.722   7.301
  108    HA   ARG  16           HA       ARG  16  -1.451   0.305   9.243
  109   1HB   ARG  16          2HB       ARG  16  -4.349  -0.706   9.014
  110   2HB   ARG  16          1HB       ARG  16  -3.190  -1.358  10.210
  111   1HG   ARG  16          2HG       ARG  16  -4.182   1.578  10.056
  112   2HG   ARG  16          1HG       ARG  16  -4.781   0.294  11.136
  113   1HD   ARG  16          2HD       ARG  16  -3.269   1.403  12.579
  114   2HD   ARG  16          1HD       ARG  16  -2.317  -0.003  11.890
  115    HE   ARG  16           HE       ARG  16  -1.856   2.178  10.144
  116   1HH1  ARG  16          1HH1      ARG  16  -0.975   1.227  13.519
  117   2HH1  ARG  16          2HH1      ARG  16   0.643   1.822  13.270
  118   1HH2  ARG  16          1HH2      ARG  16   0.238   2.960  10.017
  119   2HH2  ARG  16          2HH2      ARG  16   1.256   2.910  11.455
  120    H    LEU  17           H        LEU  17  -0.219  -1.502   9.171
  121    HA   LEU  17           HA       LEU  17  -0.496  -2.952   6.671
  122   1HB   LEU  17          2HB       LEU  17   1.937  -2.445   8.473
  123   2HB   LEU  17          1HB       LEU  17   1.956  -3.413   6.969
  124    HG   LEU  17           HG       LEU  17   1.064  -1.278   5.777
  125   1HD1  LEU  17          1HD1      LEU  17   2.079   0.836   7.002
  126   2HD1  LEU  17          2HD1      LEU  17   2.004  -0.184   8.489
  127   3HD1  LEU  17          3HD1      LEU  17   0.480   0.208   7.580
  128   1HD2  LEU  17          1HD2      LEU  17   3.428  -2.252   5.575
  129   2HD2  LEU  17          2HD2      LEU  17   3.903  -1.219   6.971
  130   3HD2  LEU  17          3HD2      LEU  17   3.338  -0.447   5.436
  131    H    GLN  18           H        GLN  18  -0.857  -5.185   6.741
  132    HA   GLN  18           HA       GLN  18   0.101  -6.663   9.017
  133   1HB   GLN  18          2HB       GLN  18  -2.869  -6.675   8.287
  134   2HB   GLN  18          1HB       GLN  18  -2.063  -7.868   9.350
  135   1HG   GLN  18          2HG       GLN  18  -1.443  -6.044  10.954
  136   2HG   GLN  18          1HG       GLN  18  -2.313  -4.853   9.934
  137   1HE2  GLN  18          1HE2      GLN  18  -2.872  -7.917  11.801
  138   2HE2  GLN  18          2HE2      GLN  18  -4.532  -7.521  12.175
  139    H    GLY  19           H        GLY  19   1.140  -8.348   8.190
  140   1HA   GLY  19          2HA       GLY  19   1.325 -10.257   7.047
  141   2HA   GLY  19          1HA       GLY  19   0.006  -9.805   5.932
  142    H    GLY  20           H        GLY  20   2.853 -10.873   5.556
  143   1HA   GLY  20          2HA       GLY  20   3.223  -9.451   3.172
  144   2HA   GLY  20          1HA       GLY  20   4.470  -9.019   4.406
  145    H    LYS  21           H        LYS  21   5.481 -10.101   2.175
  146    HA   LYS  21           HA       LYS  21   5.564 -12.668   1.755
  147   1HB   LYS  21          2HB       LYS  21   6.719 -10.527   0.698
  148   2HB   LYS  21          1HB       LYS  21   8.122 -11.002   1.682
  149   1HG   LYS  21          2HG       LYS  21   8.528 -12.058  -0.378
  150   2HG   LYS  21          1HG       LYS  21   7.737 -13.385   0.529
  151   1HD   LYS  21          2HD       LYS  21   5.501 -12.394  -0.490
  152   2HD   LYS  21          1HD       LYS  21   6.561 -11.520  -1.617
  153   1HE   LYS  21          2HE       LYS  21   6.352 -14.594  -1.324
  154   2HE   LYS  21          1HE       LYS  21   5.819 -13.578  -2.725
  155   1HZ   LYS  21          1HZ       LYS  21   8.214 -12.887  -2.896
  156   2HZ   LYS  21          2HZ       LYS  21   7.912 -14.487  -3.285
  157   3HZ   LYS  21          3HZ       LYS  21   8.610 -14.091  -1.796
  158    H    ASP  22           H        ASP  22   7.164 -11.192   4.501
  159    HA   ASP  22           HA       ASP  22   8.996 -13.161   5.144
  160   1HB   ASP  22          2HB       ASP  22   8.866 -10.816   5.997
  161   2HB   ASP  22          1HB       ASP  22   7.338 -11.218   6.856
  162    H    PHE  23           H        PHE  23   5.477 -12.991   5.728
  163    HA   PHE  23           HA       PHE  23   5.549 -15.370   7.388
  164   1HB   PHE  23          2HB       PHE  23   3.400 -13.376   6.484
  165   2HB   PHE  23          1HB       PHE  23   3.028 -14.870   7.398
  166    HD1  PHE  23           1HD      PHE  23   1.875 -13.211   8.695
  167    HD2  PHE  23           2HD      PHE  23   6.131 -13.359   8.640
  168    HE1  PHE  23           1HE      PHE  23   1.951 -12.067  10.854
  169    HE2  PHE  23           2HE      PHE  23   6.201 -12.198  10.750
  170    HZ   PHE  23           HZ       PHE  23   4.121 -11.550  11.889
  171    H    ASN  24           H        ASN  24   5.750 -14.860   4.179
  172    HA   ASN  24           HA       ASN  24   5.277 -15.835   2.370
  173   1HB   ASN  24          2HB       ASN  24   5.673 -17.960   3.911
  174   2HB   ASN  24          1HB       ASN  24   3.944 -18.265   3.604
  175   1HD2  ASN  24          1HD2      ASN  24   3.454 -17.976   1.025
  176   2HD2  ASN  24          2HD2      ASN  24   4.580 -18.877   0.024
  177    H    MET  25           H        MET  25   3.433 -14.028   3.650
  178    HA   MET  25           HA       MET  25   0.845 -14.854   2.622
  179   1HB   MET  25          2HB       MET  25   1.958 -13.075   4.705
  180   2HB   MET  25          1HB       MET  25   0.686 -12.255   3.814
  181   1HG   MET  25          2HG       MET  25  -0.324 -13.290   5.709
  182   2HG   MET  25          1HG       MET  25  -0.866 -14.213   4.284
  183   1HE   MET  25          1HE       MET  25  -1.280 -15.076   7.198
  184   2HE   MET  25          2HE       MET  25  -0.921 -16.835   7.089
  185   3HE   MET  25          3HE       MET  25  -1.785 -16.015   5.751
  186    HA   PRO  26           HA       PRO  26   1.424 -11.786  -0.609
  187   1HB   PRO  26          2HB       PRO  26  -1.155 -10.597  -0.782
  188   2HB   PRO  26          1HB       PRO  26  -0.708 -12.190  -1.441
  189   1HG   PRO  26          2HG       PRO  26  -2.343 -11.576   0.988
  190   2HG   PRO  26          1HG       PRO  26  -2.354 -13.000  -0.108
  191   1HD   PRO  26          2HD       PRO  26  -0.921 -12.376   2.444
  192   2HD   PRO  26          1HD       PRO  26  -0.936 -14.026   1.737
  193    H    LEU  27           H        LEU  27   1.887  -9.428  -0.722
  194    HA   LEU  27           HA       LEU  27   2.083  -8.275   1.863
  195   1HB   LEU  27          2HB       LEU  27   3.360  -7.985  -0.570
  196   2HB   LEU  27          1HB       LEU  27   2.430  -6.472  -0.494
  197    HG   LEU  27           HG       LEU  27   4.409  -7.655   1.546
  198   1HD1  LEU  27          1HD1      LEU  27   4.576  -5.072  -0.146
  199   2HD1  LEU  27          2HD1      LEU  27   5.465  -6.625  -0.449
  200   3HD1  LEU  27          3HD1      LEU  27   5.815  -5.673   1.030
  201   1HD2  LEU  27          1HD2      LEU  27   4.208  -5.455   2.821
  202   2HD2  LEU  27          2HD2      LEU  27   2.728  -6.471   2.922
  203   3HD2  LEU  27          3HD2      LEU  27   2.781  -5.042   1.812
  204    H    THR  28           H        THR  28   0.342  -7.646   2.934
  205    HA   THR  28           HA       THR  28  -1.848  -6.474   1.366
  206    HB   THR  28           HB       THR  28  -3.422  -7.512   2.212
  207    HG1  THR  28           1HG      THR  28  -2.092  -7.721   4.696
  208   1HG2  THR  28          1HG2      THR  28  -1.196  -9.431   3.165
  209   2HG2  THR  28          2HG2      THR  28  -1.587  -9.076   1.432
  210   3HG2  THR  28          3HG2      THR  28  -2.838  -9.850   2.510
  211    H    ILE  29           H        ILE  29  -2.950  -4.815   2.057
  212    HA   ILE  29           HA       ILE  29  -1.953  -3.394   4.475
  213    HB   ILE  29           HB       ILE  29  -3.530  -2.315   2.167
  214   1HG1  ILE  29          2HG1      ILE  29  -0.920  -2.879   1.901
  215   2HG1  ILE  29          1HG1      ILE  29  -1.736  -1.487   1.176
  216   1HG2  ILE  29          1HG2      ILE  29  -2.430  -1.083   4.797
  217   2HG2  ILE  29          2HG2      ILE  29  -4.161  -1.200   4.259
  218   3HG2  ILE  29          3HG2      ILE  29  -3.036  -0.100   3.425
  219   1HD1  ILE  29          1HD1      ILE  29  -0.876   0.038   2.891
  220   2HD1  ILE  29          2HD1      ILE  29   0.483  -0.931   2.238
  221   3HD1  ILE  29          3HD1      ILE  29  -0.204  -1.348   3.848
  222    H    SER  30           H        SER  30  -3.460  -2.928   6.092
  223    HA   SER  30           HA       SER  30  -5.685  -4.787   6.091
  224   1HB   SER  30          2HB       SER  30  -4.019  -4.811   7.915
  225   2HB   SER  30          1HB       SER  30  -4.483  -3.155   8.385
  226    HG   SER  30           HG       SER  30  -5.522  -4.858   9.550
  227    H    ARG  31           H        ARG  31  -5.354  -1.435   7.454
  228    HA   ARG  31           HA       ARG  31  -7.943  -0.815   6.279
  229   1HB   ARG  31          2HB       ARG  31  -7.968  -1.919   8.703
  230   2HB   ARG  31          1HB       ARG  31  -7.338  -0.347   9.240
  231   1HG   ARG  31          2HG       ARG  31  -9.536   0.394   7.650
  232   2HG   ARG  31          1HG       ARG  31 -10.063  -1.189   8.275
  233   1HD   ARG  31          2HD       ARG  31  -9.624  -0.333  10.641
  234   2HD   ARG  31          1HD       ARG  31  -9.201   1.282   9.960
  235    HE   ARG  31           HE       ARG  31 -11.906   0.101  10.186
  236   1HH1  ARG  31          1HH1      ARG  31 -10.143   2.662   8.349
  237   2HH1  ARG  31          2HH1      ARG  31 -11.655   3.129   7.577
  238   1HH2  ARG  31          1HH2      ARG  31 -13.691   1.006   9.364
  239   2HH2  ARG  31          2HH2      ARG  31 -13.561   2.290   8.143
  240    H    ILE  32           H        ILE  32  -8.403   1.453   6.237
  241    HA   ILE  32           HA       ILE  32  -6.149   3.226   6.467
  242    HB   ILE  32           HB       ILE  32  -9.012   3.404   5.557
  243   1HG1  ILE  32          2HG1      ILE  32  -7.834   4.541   3.592
  244   2HG1  ILE  32          1HG1      ILE  32  -6.275   3.960   4.217
  245   1HG2  ILE  32          1HG2      ILE  32  -7.135   5.781   6.074
  246   2HG2  ILE  32          2HG2      ILE  32  -8.773   5.510   6.814
  247   3HG2  ILE  32          3HG2      ILE  32  -8.632   5.820   5.061
  248   1HD1  ILE  32          1HD1      ILE  32  -7.276   1.559   4.045
  249   2HD1  ILE  32          2HD1      ILE  32  -7.086   2.454   2.499
  250   3HD1  ILE  32          3HD1      ILE  32  -8.725   2.340   3.273
  251    H    THR  33           H        THR  33  -5.879   4.842   7.989
  252    HA   THR  33           HA       THR  33  -7.492   4.680  10.377
  253    HB   THR  33           HB       THR  33  -5.164   6.546   9.784
  254    HG1  THR  33           1HG      THR  33  -4.500   4.489   9.671
  255   1HG2  THR  33          1HG2      THR  33  -5.077   6.697  12.283
  256   2HG2  THR  33          2HG2      THR  33  -6.499   5.583  12.412
  257   3HG2  THR  33          3HG2      THR  33  -6.698   7.212  11.700
  258    HA   PRO  34           HA       PRO  34  -9.667   8.247   8.759
  259   1HB   PRO  34          2HB       PRO  34 -10.941   9.213  11.025
  260   2HB   PRO  34          1HB       PRO  34 -11.317   7.593  10.276
  261   1HG   PRO  34          2HG       PRO  34  -9.346   7.969  12.581
  262   2HG   PRO  34          1HG       PRO  34 -10.885   6.988  12.573
  263   1HD   PRO  34          2HD       PRO  34  -8.565   5.788  11.862
  264   2HD   PRO  34          1HD       PRO  34 -10.004   5.524  10.790
  265    H    GLY  35           H        GLY  35  -9.836  10.600   8.954
  266   1HA   GLY  35          2HA       GLY  35  -9.068  12.616   9.341
  267   2HA   GLY  35          1HA       GLY  35  -7.949  11.963  10.578
  268    H    SER  36           H        SER  36  -7.021  10.184   8.156
  269    HA   SER  36           HA       SER  36  -4.935  12.123   7.418
  270   1HB   SER  36          2HB       SER  36  -4.373  10.215   8.945
  271   2HB   SER  36          1HB       SER  36  -4.794   9.073   7.644
  272    HG   SER  36           HG       SER  36  -2.981   9.593   6.656
  273    H    LYS  37           H        LYS  37  -3.754  11.527   5.386
  274    HA   LYS  37           HA       LYS  37  -5.201  11.914   3.185
  275   1HB   LYS  37          2HB       LYS  37  -2.438  10.936   3.809
  276   2HB   LYS  37          1HB       LYS  37  -3.004  10.586   2.155
  277   1HG   LYS  37          2HG       LYS  37  -1.864  12.618   1.988
  278   2HG   LYS  37          1HG       LYS  37  -3.613  12.949   1.807
  279   1HD   LYS  37          2HD       LYS  37  -3.647  13.755   4.237
  280   2HD   LYS  37          1HD       LYS  37  -1.888  13.430   4.314
  281   1HE   LYS  37          2HE       LYS  37  -2.155  15.812   3.913
  282   2HE   LYS  37          1HE       LYS  37  -1.582  15.093   2.354
  283   1HZ   LYS  37          1HZ       LYS  37  -3.504  16.619   2.058
  284   2HZ   LYS  37          2HZ       LYS  37  -4.399  15.666   3.103
  285   3HZ   LYS  37          3HZ       LYS  37  -3.902  15.048   1.609
  286    H    ALA  38           H        ALA  38  -4.187   8.738   4.313
  287    HA   ALA  38           HA       ALA  38  -5.121   6.909   2.623
  288   1HB   ALA  38          1HB       ALA  38  -5.357   7.144   5.655
  289   2HB   ALA  38          2HB       ALA  38  -3.933   6.568   4.708
  290   3HB   ALA  38          3HB       ALA  38  -5.429   5.603   4.720
  291    H    ALA  39           H        ALA  39  -7.326   8.919   4.635
  292    HA   ALA  39           HA       ALA  39  -9.533   7.298   3.655
  293   1HB   ALA  39          1HB       ALA  39  -9.254   7.803   6.145
  294   2HB   ALA  39          2HB       ALA  39 -10.786   8.488   5.497
  295   3HB   ALA  39          3HB       ALA  39  -9.357   9.552   5.771
  296    H    GLN  40           H        GLN  40  -7.973  10.196   2.647
  297    HA   GLN  40           HA       GLN  40 -10.206  11.857   2.461
  298   1HB   GLN  40          2HB       GLN  40  -7.799  12.366   3.054
  299   2HB   GLN  40          1HB       GLN  40  -7.309  11.874   1.419
  300   1HG   GLN  40          2HG       GLN  40  -8.609  13.663   0.421
  301   2HG   GLN  40          1HG       GLN  40  -9.195  14.234   2.055
  302   1HE2  GLN  40          1HE2      GLN  40  -7.991  16.277   0.855
  303   2HE2  GLN  40          2HE2      GLN  40  -6.318  16.442   1.272
  304    H    SER  41           H        SER  41  -8.203  10.041   0.105
  305    HA   SER  41           HA       SER  41  -9.560  11.564  -1.994
  306   1HB   SER  41          2HB       SER  41  -7.515  11.439  -3.220
  307   2HB   SER  41          1HB       SER  41  -7.166  11.897  -1.517
  308    HG   SER  41           HG       SER  41  -5.760  10.279  -2.352
  309    H    GLN  42           H        GLN  42  -8.192   9.597  -3.991
  310    HA   GLN  42           HA       GLN  42 -10.443   7.775  -4.114
  311   1HB   GLN  42          2HB       GLN  42  -8.038   8.162  -5.962
  312   2HB   GLN  42          1HB       GLN  42  -9.452   7.128  -6.293
  313   1HG   GLN  42          2HG       GLN  42  -9.523  10.206  -5.988
  314   2HG   GLN  42          1HG       GLN  42  -9.500   9.308  -7.539
  315   1HE2  GLN  42          1HE2      GLN  42 -11.343   7.878  -8.019
  316   2HE2  GLN  42          2HE2      GLN  42 -12.917   8.272  -7.364
  317    H    LEU  43           H        LEU  43  -7.494   7.980  -2.583
  318    HA   LEU  43           HA       LEU  43  -6.424   5.432  -2.966
  319   1HB   LEU  43          2HB       LEU  43  -5.383   7.611  -1.929
  320   2HB   LEU  43          1HB       LEU  43  -6.215   7.150  -0.430
  321    HG   LEU  43           HG       LEU  43  -4.950   4.788  -0.905
  322   1HD1  LEU  43          1HD1      LEU  43  -3.134   6.834  -2.329
  323   2HD1  LEU  43          2HD1      LEU  43  -4.111   5.581  -3.155
  324   3HD1  LEU  43          3HD1      LEU  43  -2.791   5.087  -2.026
  325   1HD2  LEU  43          1HD2      LEU  43  -2.838   5.953   0.286
  326   2HD2  LEU  43          2HD2      LEU  43  -4.334   5.668   1.171
  327   3HD2  LEU  43          3HD2      LEU  43  -3.992   7.315   0.499
  328    H    SER  44           H        SER  44  -7.062   3.435  -2.180
  329    HA   SER  44           HA       SER  44  -7.724   3.534   0.633
  330   1HB   SER  44          2HB       SER  44  -9.883   3.212  -0.875
  331   2HB   SER  44          1HB       SER  44  -9.316   1.527  -1.007
  332    HG   SER  44           HG       SER  44  -9.938   3.070   1.295
  333    H    GLN  45           H        GLN  45  -5.401   3.025   0.802
  334    HA   GLN  45           HA       GLN  45  -4.380   0.626  -0.043
  335   1HB   GLN  45          2HB       GLN  45  -3.858   2.181   2.558
  336   2HB   GLN  45          1HB       GLN  45  -2.736   1.035   1.727
  337   1HG   GLN  45          2HG       GLN  45  -2.771   2.501  -0.270
  338   2HG   GLN  45          1HG       GLN  45  -3.760   3.722   0.605
  339   1HE2  GLN  45          2HE2      GLN  45  -0.622   2.197   0.542
  340   2HE2  GLN  45          1HE2      GLN  45   0.257   3.554   1.317
  341    H    GLY  46           H        GLY  46  -5.491  -1.203   0.256
  342   1HA   GLY  46          2HA       GLY  46  -5.520  -2.397   2.802
  343   2HA   GLY  46          1HA       GLY  46  -7.120  -1.675   2.515
  344    H    ASP  47           H        ASP  47  -4.749  -3.387   0.406
  345    HA   ASP  47           HA       ASP  47  -6.278  -5.721   0.462
  346   1HB   ASP  47          2HB       ASP  47  -7.448  -4.047  -1.315
  347   2HB   ASP  47          1HB       ASP  47  -6.118  -4.541  -2.390
  348    H    LEU  48           H        LEU  48  -5.248  -6.877  -2.004
  349    HA   LEU  48           HA       LEU  48  -2.603  -7.398  -1.053
  350   1HB   LEU  48          2HB       LEU  48  -4.117  -8.532  -3.449
  351   2HB   LEU  48          1HB       LEU  48  -2.501  -9.031  -2.867
  352    HG   LEU  48           HG       LEU  48  -3.772 -10.697  -1.944
  353   1HD1  LEU  48          1HD1      LEU  48  -4.127 -10.417   0.441
  354   2HD1  LEU  48          2HD1      LEU  48  -4.200  -8.624   0.301
  355   3HD1  LEU  48          3HD1      LEU  48  -2.647  -9.486  -0.074
  356   1HD2  LEU  48          1HD2      LEU  48  -5.992  -9.556  -2.748
  357   2HD2  LEU  48          2HD2      LEU  48  -5.936  -8.660  -1.165
  358   3HD2  LEU  48          3HD2      LEU  48  -6.075 -10.473  -1.152
  359    H    VAL  49           H        VAL  49  -1.113  -5.943  -1.486
  360    HA   VAL  49           HA       VAL  49  -1.369  -4.181  -3.686
  361    HB   VAL  49           HB       VAL  49   0.956  -4.536  -1.764
  362   1HG1  VAL  49          1HG1      VAL  49   1.305  -2.112  -2.339
  363   2HG1  VAL  49          2HG1      VAL  49  -0.053  -2.202  -3.528
  364   3HG1  VAL  49          3HG1      VAL  49   1.463  -3.148  -3.804
  365   1HG2  VAL  49          1HG2      VAL  49  -1.667  -2.915  -1.537
  366   2HG2  VAL  49          2HG2      VAL  49  -0.211  -2.640  -0.525
  367   3HG2  VAL  49          3HG2      VAL  49  -1.082  -4.205  -0.420
  368    H    VAL  50           H        VAL  50  -0.395  -4.407  -5.709
  369    HA   VAL  50           HA       VAL  50   1.164  -6.797  -6.179
  370    HB   VAL  50           HB       VAL  50   0.452  -4.750  -8.304
  371   1HG1  VAL  50          1HG1      VAL  50   2.104  -6.585  -8.814
  372   2HG1  VAL  50          2HG1      VAL  50   0.563  -6.792  -9.709
  373   3HG1  VAL  50          3HG1      VAL  50   0.904  -7.809  -8.254
  374   1HG2  VAL  50          1HG2      VAL  50  -1.665  -5.086  -7.269
  375   2HG2  VAL  50          2HG2      VAL  50  -1.404  -6.881  -7.112
  376   3HG2  VAL  50          3HG2      VAL  50  -1.597  -6.105  -8.735
  377    H    ALA  51           H        ALA  51   1.364  -3.368  -7.049
  378    HA   ALA  51           HA       ALA  51   4.284  -3.487  -6.853
  379   1HB   ALA  51          1HB       ALA  51   4.420  -1.826  -8.707
  380   2HB   ALA  51          2HB       ALA  51   2.634  -1.834  -8.856
  381   3HB   ALA  51          3HB       ALA  51   3.575  -3.319  -9.252
  382    H    ILE  52           H        ILE  52   5.361  -1.853  -5.970
  383    HA   ILE  52           HA       ILE  52   3.798   0.259  -4.697
  384    HB   ILE  52           HB       ILE  52   4.405  -1.816  -3.369
  385   1HG1  ILE  52          2HG1      ILE  52   5.168   0.968  -2.282
  386   2HG1  ILE  52          1HG1      ILE  52   3.495   0.341  -2.490
  387   1HG2  ILE  52          1HG2      ILE  52   6.793  -1.944  -4.138
  388   2HG2  ILE  52          2HG2      ILE  52   6.645  -1.891  -2.341
  389   3HG2  ILE  52          3HG2      ILE  52   7.119  -0.408  -3.261
  390   1HD1  ILE  52          1HD1      ILE  52   5.668  -0.858  -0.658
  391   2HD1  ILE  52          2HD1      ILE  52   4.049  -1.590  -0.931
  392   3HD1  ILE  52          3HD1      ILE  52   4.198   0.011  -0.119
  393    H    ASP  53           H        ASP  53   4.477   2.165  -5.082
  394    HA   ASP  53           HA       ASP  53   5.246   3.643  -6.396
  395   1HB   ASP  53          2HB       ASP  53   6.734   3.638  -4.255
  396   2HB   ASP  53          1HB       ASP  53   8.051   3.095  -5.346
  397    H    GLY  54           H        GLY  54   4.984   1.206  -7.720
  398   1HA   GLY  54          2HA       GLY  54   5.120   0.854  -9.937
  399   2HA   GLY  54          1HA       GLY  54   6.685   1.709 -10.025
  400    H    VAL  55           H        VAL  55   6.949  -0.438  -7.415
  401    HA   VAL  55           HA       VAL  55   8.201  -2.365  -9.238
  402    HB   VAL  55           HB       VAL  55   9.057  -1.551  -6.448
  403   1HG1  VAL  55          1HG1      VAL  55   9.660  -3.926  -6.971
  404   2HG1  VAL  55          2HG1      VAL  55  11.114  -2.888  -7.075
  405   3HG1  VAL  55          3HG1      VAL  55  10.293  -3.428  -8.583
  406   1HG2  VAL  55          1HG2      VAL  55   9.483   0.290  -8.073
  407   2HG2  VAL  55          2HG2      VAL  55  10.209  -0.884  -9.240
  408   3HG2  VAL  55          3HG2      VAL  55  11.018  -0.546  -7.666
  409    H    ASN  56           H        ASN  56   7.566  -4.457  -9.069
  410    HA   ASN  56           HA       ASN  56   5.438  -5.095  -7.440
  411   1HB   ASN  56          2HB       ASN  56   5.452  -7.255  -8.326
  412   2HB   ASN  56          1HB       ASN  56   5.970  -6.150  -9.638
  413   1HD2  ASN  56          1HD2      ASN  56   8.448  -6.057 -10.020
  414   2HD2  ASN  56          2HD2      ASN  56   9.388  -7.475  -9.605
  415    H    THR  57           H        THR  57   5.088  -6.332  -5.667
  416    HA   THR  57           HA       THR  57   7.003  -6.284  -3.659
  417    HB   THR  57           HB       THR  57   5.138  -7.436  -2.370
  418    HG1  THR  57           1HG      THR  57   3.617  -6.834  -4.636
  419   1HG2  THR  57          1HG2      THR  57   3.655  -5.445  -2.495
  420   2HG2  THR  57          2HG2      THR  57   4.430  -4.899  -4.020
  421   3HG2  THR  57          3HG2      THR  57   5.381  -4.937  -2.495
  422    H    ASP  58           H        ASP  58   8.204  -7.767  -5.498
  423    HA   ASP  58           HA       ASP  58   7.970 -10.464  -5.493
  424   1HB   ASP  58          2HB       ASP  58   9.443  -8.950  -6.926
  425   2HB   ASP  58          1HB       ASP  58  10.596  -8.834  -5.558
  426    H    THR  59           H        THR  59  10.158  -8.638  -3.303
  427    HA   THR  59           HA       THR  59  10.005 -10.918  -1.469
  428    HB   THR  59           HB       THR  59  11.993 -10.970  -3.011
  429    HG1  THR  59           1HG      THR  59  12.884 -11.970  -1.553
  430   1HG2  THR  59          1HG2      THR  59  12.860  -8.520  -1.339
  431   2HG2  THR  59          2HG2      THR  59  12.508  -8.538  -3.107
  432   3HG2  THR  59          3HG2      THR  59  13.904  -9.462  -2.459
  433    H    MET  60           H        MET  60   8.798  -8.194  -1.669
  434    HA   MET  60           HA       MET  60   9.990  -6.623   0.362
  435   1HB   MET  60          2HB       MET  60   7.629  -6.479  -1.562
  436   2HB   MET  60          1HB       MET  60   7.832  -5.250  -0.272
  437   1HG   MET  60          2HG       MET  60   8.758  -4.279  -2.177
  438   2HG   MET  60          1HG       MET  60  10.153  -4.770  -1.175
  439   1HE   MET  60          1HE       MET  60  11.272  -4.874  -4.959
  440   2HE   MET  60          2HE       MET  60  11.537  -4.141  -3.344
  441   3HE   MET  60          3HE       MET  60  10.011  -3.817  -4.250
  442    H    THR  61           H        THR  61   9.357  -6.377   2.429
  443    HA   THR  61           HA       THR  61   7.250  -8.111   3.424
  444    HB   THR  61           HB       THR  61   8.390  -7.725   5.598
  445    HG1  THR  61           1HG      THR  61  10.522  -6.710   5.279
  446   1HG2  THR  61          1HG2      THR  61   9.076  -9.599   4.026
  447   2HG2  THR  61          2HG2      THR  61  10.478  -8.966   4.980
  448   3HG2  THR  61          3HG2      THR  61  10.265  -8.515   3.251
  449    H    HIS  62           H        HIS  62   6.114  -7.070   5.466
  450    HA   HIS  62           HA       HIS  62   4.831  -4.758   4.842
  451   1HB   HIS  62          2HB       HIS  62   3.923  -4.733   6.970
  452   2HB   HIS  62          1HB       HIS  62   4.312  -6.458   6.673
  453    HD1  HIS  62           1HD      HIS  62   6.389  -7.464   8.108
  454    HD2  HIS  62           2HD      HIS  62   5.050  -3.651   9.242
  455    HE1  HIS  62           1HE      HIS  62   7.301  -6.990  10.400
  456    H    LEU  63           H        LEU  63   7.677  -5.036   6.889
  457    HA   LEU  63           HA       LEU  63   8.187  -2.337   7.313
  458   1HB   LEU  63          2HB       LEU  63   9.299  -4.178   8.539
  459   2HB   LEU  63          1HB       LEU  63  10.120  -4.691   7.038
  460    HG   LEU  63           HG       LEU  63  11.297  -2.445   6.953
  461   1HD1  LEU  63          1HD1      LEU  63   9.762  -1.042   8.332
  462   2HD1  LEU  63          2HD1      LEU  63  11.400  -1.097   9.073
  463   3HD1  LEU  63          3HD1      LEU  63  10.070  -2.100   9.766
  464   1HD2  LEU  63          1HD2      LEU  63  12.379  -4.455   7.776
  465   2HD2  LEU  63          2HD2      LEU  63  11.737  -4.166   9.450
  466   3HD2  LEU  63          3HD2      LEU  63  12.924  -3.009   8.710
  467    H    GLU  64           H        GLU  64   9.485  -4.407   4.589
  468    HA   GLU  64           HA       GLU  64  10.930  -2.309   3.577
  469   1HB   GLU  64          2HB       GLU  64  10.722  -4.937   2.855
  470   2HB   GLU  64          1HB       GLU  64   9.838  -4.182   1.491
  471   1HG   GLU  64          2HG       GLU  64  11.890  -2.499   1.418
  472   2HG   GLU  64          1HG       GLU  64  12.651  -3.594   2.621
  473    H    ALA  65           H        ALA  65   7.607  -3.327   2.839
  474    HA   ALA  65           HA       ALA  65   7.060  -1.506   0.829
  475   1HB   ALA  65          1HB       ALA  65   5.838  -3.590   1.358
  476   2HB   ALA  65          2HB       ALA  65   4.682  -2.190   1.349
  477   3HB   ALA  65          3HB       ALA  65   5.259  -2.895   2.909
  478    H    GLN  66           H        GLN  66   6.560  -1.243   4.344
  479    HA   GLN  66           HA       GLN  66   5.480   1.270   4.501
  480   1HB   GLN  66          2HB       GLN  66   5.847  -0.439   6.340
  481   2HB   GLN  66          1HB       GLN  66   7.583  -0.121   6.249
  482   1HG   GLN  66          2HG       GLN  66   6.891   1.008   8.135
  483   2HG   GLN  66          1HG       GLN  66   7.074   2.338   6.949
  484   1HE2  GLN  66          1HE2      GLN  66   5.043   1.063   9.331
  485   2HE2  GLN  66          2HE2      GLN  66   3.510   1.673   8.791
  486    H    ASN  67           H        ASN  67   8.920   0.313   4.330
  487    HA   ASN  67           HA       ASN  67   9.877   2.953   4.270
  488   1HB   ASN  67          2HB       ASN  67  11.019   0.177   3.812
  489   2HB   ASN  67          1HB       ASN  67  11.976   1.561   3.191
  490   1HD2  ASN  67          1HD2      ASN  67  11.368  -0.282   5.986
  491   2HD2  ASN  67          2HD2      ASN  67  12.174   0.792   7.101
  492    H    LYS  68           H        LYS  68   8.938   0.828   1.563
  493    HA   LYS  68           HA       LYS  68   9.882   2.541  -0.412
  494   1HB   LYS  68          2HB       LYS  68   7.350   0.833  -0.587
  495   2HB   LYS  68          1HB       LYS  68   8.297   1.514  -1.942
  496   1HG   LYS  68          2HG       LYS  68   9.023  -0.830  -0.119
  497   2HG   LYS  68          1HG       LYS  68   8.711  -0.795  -1.860
  498   1HD   LYS  68          2HD       LYS  68  10.816   0.564  -2.215
  499   2HD   LYS  68          1HD       LYS  68  11.143   0.396  -0.448
  500   1HE   LYS  68          2HE       LYS  68  10.919  -2.157  -0.773
  501   2HE   LYS  68          1HE       LYS  68  10.924  -1.872  -2.556
  502   1HZ   LYS  68          1HZ       LYS  68  13.132  -1.405  -2.504
  503   2HZ   LYS  68          2HZ       LYS  68  13.044  -2.339  -1.097
  504   3HZ   LYS  68          3HZ       LYS  68  13.090  -0.650  -0.988
  505    H    ILE  69           H        ILE  69   6.549   2.361   0.981
  506    HA   ILE  69           HA       ILE  69   5.502   4.611  -0.035
  507    HB   ILE  69           HB       ILE  69   5.197   3.055   2.529
  508   1HG1  ILE  69          2HG1      ILE  69   3.522   3.540  -0.001
  509   2HG1  ILE  69          1HG1      ILE  69   4.385   2.031   0.333
  510   1HG2  ILE  69          1HG2      ILE  69   4.556   5.416   3.101
  511   2HG2  ILE  69          2HG2      ILE  69   3.097   4.405   2.931
  512   3HG2  ILE  69          3HG2      ILE  69   3.568   5.503   1.597
  513   1HD1  ILE  69          1HD1      ILE  69   2.980   1.569   2.343
  514   2HD1  ILE  69          2HD1      ILE  69   2.061   1.636   0.795
  515   3HD1  ILE  69          3HD1      ILE  69   1.970   3.012   1.929
  516    H    LYS  70           H        LYS  70   7.396   4.509   3.035
  517    HA   LYS  70           HA       LYS  70   7.065   7.251   3.439
  518   1HB   LYS  70          2HB       LYS  70   8.588   5.004   4.691
  519   2HB   LYS  70          1HB       LYS  70   9.246   6.628   4.986
  520   1HG   LYS  70          2HG       LYS  70   7.816   6.157   6.788
  521   2HG   LYS  70          1HG       LYS  70   7.077   7.450   5.788
  522   1HD   LYS  70          2HD       LYS  70   5.647   5.542   4.703
  523   2HD   LYS  70          1HD       LYS  70   6.221   4.503   6.035
  524   1HE   LYS  70          2HE       LYS  70   4.509   7.071   6.191
  525   2HE   LYS  70          1HE       LYS  70   4.035   5.382   6.643
  526   1HZ   LYS  70          1HZ       LYS  70   6.031   7.138   7.994
  527   2HZ   LYS  70          2HZ       LYS  70   5.796   5.520   8.394
  528   3HZ   LYS  70          3HZ       LYS  70   4.556   6.665   8.608
  529    H    SER  71           H        SER  71   8.942   5.947   1.013
  530    HA   SER  71           HA       SER  71  11.129   7.838   1.395
  531   1HB   SER  71          2HB       SER  71  11.338   5.309   0.743
  532   2HB   SER  71          1HB       SER  71  10.765   5.815  -0.870
  533    HG   SER  71           HG       SER  71  13.138   6.385   0.539
  534    H    ALA  72           H        ALA  72   8.103   7.746   0.021
  535    HA   ALA  72           HA       ALA  72   8.782   9.402  -2.296
  536   1HB   ALA  72          1HB       ALA  72   7.644   7.197  -2.636
  537   2HB   ALA  72          2HB       ALA  72   6.567   8.547  -3.140
  538   3HB   ALA  72          3HB       ALA  72   6.333   7.724  -1.539
  539    H    SER  73           H        SER  73   7.372  11.122  -2.890
  540    HA   SER  73           HA       SER  73   5.385  12.041  -1.143
  541   1HB   SER  73          2HB       SER  73   6.205  14.159  -0.375
  542   2HB   SER  73          1HB       SER  73   7.217  12.836   0.265
  543    HG   SER  73           HG       SER  73   8.401  14.593  -0.435
  544    H    TYR  74           H        TYR  74   7.385  12.601  -3.973
  545    HA   TYR  74           HA       TYR  74   5.593  14.634  -4.979
  546   1HB   TYR  74          2HB       TYR  74   8.178  13.287  -5.884
  547   2HB   TYR  74          1HB       TYR  74   7.108  14.023  -7.119
  548    HD1  TYR  74           1HD      TYR  74   7.978  15.924  -7.830
  549    HD2  TYR  74           2HD      TYR  74   8.117  15.163  -3.649
  550    HE1  TYR  74           1HE      TYR  74   8.911  18.145  -7.461
  551    HE2  TYR  74           2HE      TYR  74   9.033  17.378  -3.273
  552    HH   TYR  74           HH       TYR  74   9.753  19.601  -5.945
  553    H    ASN  75           H        ASN  75   6.481  11.247  -5.682
  554    HA   ASN  75           HA       ASN  75   3.695  10.823  -6.390
  555   1HB   ASN  75          2HB       ASN  75   4.688  11.026  -8.585
  556   2HB   ASN  75          1HB       ASN  75   6.102  10.018  -8.070
  557   1HD2  ASN  75          1HD2      ASN  75   5.548   7.646  -7.512
  558   2HD2  ASN  75          2HD2      ASN  75   4.522   6.902  -8.711
  559    H    LEU  76           H        LEU  76   2.983   9.364  -5.229
  560    HA   LEU  76           HA       LEU  76   4.617   6.986  -4.613
  561   1HB   LEU  76          2HB       LEU  76   4.150   8.259  -2.500
  562   2HB   LEU  76          1HB       LEU  76   2.419   8.271  -2.889
  563    HG   LEU  76           HG       LEU  76   2.310   5.780  -2.626
  564   1HD1  LEU  76          1HD1      LEU  76   5.244   5.956  -1.717
  565   2HD1  LEU  76          2HD1      LEU  76   4.728   5.215  -3.294
  566   3HD1  LEU  76          3HD1      LEU  76   4.199   4.510  -1.718
  567   1HD2  LEU  76          1HD2      LEU  76   2.616   5.702  -0.211
  568   2HD2  LEU  76          2HD2      LEU  76   1.977   7.338  -0.647
  569   3HD2  LEU  76          3HD2      LEU  76   3.724   7.113  -0.231
  570    H    SER  77           H        SER  77   3.915   5.681  -6.266
  571    HA   SER  77           HA       SER  77   1.024   5.616  -6.806
  572   1HB   SER  77          2HB       SER  77   2.462   6.048  -8.767
  573   2HB   SER  77          1HB       SER  77   3.337   4.512  -8.456
  574    HG   SER  77           HG       SER  77   1.834   3.868  -9.796
  575    H    LEU  78           H        LEU  78  -0.110   4.057  -5.779
  576    HA   LEU  78           HA       LEU  78   1.283   1.532  -5.187
  577   1HB   LEU  78          2HB       LEU  78  -1.357   2.433  -4.000
  578   2HB   LEU  78          1HB       LEU  78  -0.267   1.138  -3.450
  579    HG   LEU  78           HG       LEU  78  -0.121   2.851  -1.846
  580   1HD1  LEU  78          1HD1      LEU  78   2.202   3.483  -1.777
  581   2HD1  LEU  78          2HD1      LEU  78   2.406   3.211  -3.547
  582   3HD1  LEU  78          3HD1      LEU  78   2.044   1.813  -2.451
  583   1HD2  LEU  78          1HD2      LEU  78   0.171   5.144  -2.061
  584   2HD2  LEU  78          2HD2      LEU  78  -1.114   4.699  -3.256
  585   3HD2  LEU  78          3HD2      LEU  78   0.554   5.058  -3.821
  586    H    THR  79           H        THR  79   0.610  -0.290  -6.212
  587    HA   THR  79           HA       THR  79  -1.948  -0.194  -7.639
  588    HB   THR  79           HB       THR  79   0.495  -1.841  -8.410
  589    HG1  THR  79           1HG      THR  79   0.898   0.318  -8.835
  590   1HG2  THR  79          1HG2      THR  79  -2.199  -1.164  -9.763
  591   2HG2  THR  79          2HG2      THR  79  -1.716  -2.779  -9.100
  592   3HG2  THR  79          3HG2      THR  79  -0.847  -2.100 -10.521
  593    H    LEU  80           H        LEU  80  -3.323  -1.411  -6.313
  594    HA   LEU  80           HA       LEU  80  -2.505  -4.101  -5.503
  595   1HB   LEU  80          2HB       LEU  80  -3.682  -3.880  -3.447
  596   2HB   LEU  80          1HB       LEU  80  -2.470  -2.539  -3.559
  597    HG   LEU  80           HG       LEU  80  -5.440  -2.424  -4.047
  598   1HD1  LEU  80          1HD1      LEU  80  -4.703  -2.736  -1.679
  599   2HD1  LEU  80          2HD1      LEU  80  -5.554  -1.131  -1.968
  600   3HD1  LEU  80          3HD1      LEU  80  -3.723  -1.191  -1.812
  601   1HD2  LEU  80          1HD2      LEU  80  -3.121  -0.454  -4.259
  602   2HD2  LEU  80          2HD2      LEU  80  -4.759   0.235  -3.768
  603   3HD2  LEU  80          3HD2      LEU  80  -4.554  -0.613  -5.373
  604    H    GLN  81           H        GLN  81  -4.746  -5.400  -4.999
  605    HA   GLN  81           HA       GLN  81  -6.295  -5.034  -7.338
  606   1HB   GLN  81          2HB       GLN  81  -7.119  -6.675  -4.970
  607   2HB   GLN  81          1HB       GLN  81  -7.691  -6.793  -6.654
  608   1HG   GLN  81          2HG       GLN  81  -4.814  -7.450  -5.767
  609   2HG   GLN  81          1HG       GLN  81  -6.146  -8.645  -5.941
  610   1HE2  GLN  81          1HE2      GLN  81  -3.551  -8.408  -7.396
  611   2HE2  GLN  81          2HE2      GLN  81  -3.981  -8.373  -9.085
  612    H    LYS  82           H        LYS  82  -8.621  -4.685  -7.474
  613    HA   LYS  82           HA       LYS  82  -9.790  -3.014  -5.473
  614   1HB   LYS  82          2HB       LYS  82 -10.379  -3.625  -8.136
  615   2HB   LYS  82          1HB       LYS  82 -11.628  -4.542  -7.264
  616   1HG   LYS  82          2HG       LYS  82 -12.617  -2.402  -7.592
  617   2HG   LYS  82          1HG       LYS  82 -12.008  -2.328  -5.908
  618   1HD   LYS  82          2HD       LYS  82  -9.779  -1.406  -7.156
  619   2HD   LYS  82          1HD       LYS  82 -10.935  -0.994  -8.451
  620   1HE   LYS  82          2HE       LYS  82 -10.909  -0.070  -5.509
  621   2HE   LYS  82          1HE       LYS  82 -10.587   0.960  -6.964
  622   1HZ   LYS  82          1HZ       LYS  82 -13.162  -0.138  -5.987
  623   2HZ   LYS  82          2HZ       LYS  82 -12.970   0.231  -7.624
  624   3HZ   LYS  82          3HZ       LYS  82 -12.786   1.432  -6.469
  625    H    SER  83           H        SER  83 -10.598  -3.658  -3.618
  626    HA   SER  83           HA       SER  83 -10.327  -6.319  -2.819
  627   1HB   SER  83          2HB       SER  83 -10.017  -4.169  -1.453
  628   2HB   SER  83          1HB       SER  83 -11.786  -4.177  -1.207
  629    HG   SER  83           HG       SER  83  -9.819  -6.074  -0.502
  630    H    LYS  84           H        LYS  84 -11.695  -7.647  -4.056
  631    HA   LYS  84           HA       LYS  84 -14.518  -7.532  -3.245
  632   1HB   LYS  84          2HB       LYS  84 -13.379  -8.538  -5.892
  633   2HB   LYS  84          1HB       LYS  84 -15.096  -8.603  -5.375
  634   1HG   LYS  84          2HG       LYS  84 -15.061  -6.050  -5.215
  635   2HG   LYS  84          1HG       LYS  84 -13.412  -6.086  -5.896
  636   1HD   LYS  84          2HD       LYS  84 -14.260  -6.093  -7.954
  637   2HD   LYS  84          1HD       LYS  84 -14.927  -7.722  -7.677
  638   1HE   LYS  84          2HE       LYS  84 -16.350  -5.015  -7.148
  639   2HE   LYS  84          1HE       LYS  84 -16.650  -6.128  -8.540
  640   1HZ   LYS  84          1HZ       LYS  84 -17.158  -6.745  -5.654
  641   2HZ   LYS  84          2HZ       LYS  84 -17.329  -7.828  -6.919
  642   3HZ   LYS  84          3HZ       LYS  84 -18.295  -6.440  -6.859
  643    H    ARG  85           H        ARG  85 -15.020  -9.152  -1.860
  644    HA   ARG  85           HA       ARG  85 -14.387 -11.776  -2.932
  645   1HB   ARG  85          2HB       ARG  85 -14.308 -11.096   0.053
  646   2HB   ARG  85          1HB       ARG  85 -14.502 -12.741  -0.623
  647   1HG   ARG  85          2HG       ARG  85 -12.300 -12.380  -1.889
  648   2HG   ARG  85          1HG       ARG  85 -12.046 -10.945  -0.847
  649   1HD   ARG  85          2HD       ARG  85 -12.160 -12.423   1.205
  650   2HD   ARG  85          1HD       ARG  85 -12.529 -13.844   0.137
  651    HE   ARG  85           HE       ARG  85 -10.023 -12.307  -0.493
  652   1HH1  ARG  85          1HH1      ARG  85 -11.319 -15.354   0.907
  653   2HH1  ARG  85          2HH1      ARG  85  -9.767 -16.087   0.823
  654   1HH2  ARG  85          1HH2      ARG  85  -8.114 -13.260  -0.410
  655   2HH2  ARG  85          2HH2      ARG  85  -7.893 -14.827   0.382
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  -5.863  -6.887 -11.595
    2   2H    MET   1          2HT       MET   1  -6.683  -6.755 -13.024
    3   3H    MET   1          3HT       MET   1  -6.933  -8.095 -12.052
    4    HA   MET   1           HA       MET   1  -8.232  -5.593 -12.142
    5   1HB   MET   1          2HB       MET   1  -9.278  -7.880 -11.910
    6   2HB   MET   1          1HB       MET   1  -8.754  -7.899 -10.201
    7   1HG   MET   1          2HG       MET   1 -10.119  -5.758  -9.866
    8   2HG   MET   1          1HG       MET   1 -10.702  -5.925 -11.541
    9   1HE   MET   1          1HE       MET   1 -11.281  -8.925 -12.066
   10   2HE   MET   1          2HE       MET   1 -12.405  -7.559 -12.385
   11   3HE   MET   1          3HE       MET   1 -12.988  -9.019 -11.518
   12    H    ALA   2           H        ALA   2  -6.376  -4.166 -11.422
   13    HA   ALA   2           HA       ALA   2  -6.634  -3.759  -8.531
   14   1HB   ALA   2          1HB       ALA   2  -4.458  -4.865  -8.889
   15   2HB   ALA   2          2HB       ALA   2  -4.150  -3.120  -8.580
   16   3HB   ALA   2          3HB       ALA   2  -4.078  -3.753 -10.260
   17    H    TYR   3           H        TYR   3  -5.707  -1.550  -7.939
   18    HA   TYR   3           HA       TYR   3  -6.409   0.353 -10.056
   19   1HB   TYR   3          2HB       TYR   3  -7.670   1.724  -8.760
   20   2HB   TYR   3          1HB       TYR   3  -8.287   0.089  -8.363
   21    HD1  TYR   3           1HD      TYR   3  -7.166   3.109  -7.194
   22    HD2  TYR   3           2HD      TYR   3  -7.034  -1.020  -6.155
   23    HE1  TYR   3           1HE      TYR   3  -6.737   3.712  -4.845
   24    HE2  TYR   3           2HE      TYR   3  -6.729  -0.430  -3.829
   25    HH   TYR   3           HH       TYR   3  -6.453   1.228  -2.339
   26    H    SER   4           H        SER   4  -5.102   2.114 -10.274
   27    HA   SER   4           HA       SER   4  -2.718   2.078  -8.571
   28   1HB   SER   4          2HB       SER   4  -1.336   2.675 -10.524
   29   2HB   SER   4          1HB       SER   4  -2.065   1.041 -10.631
   30    HG   SER   4           HG       SER   4  -2.215   2.257 -12.562
   31    H    VAL   5           H        VAL   5  -2.390   3.917  -7.522
   32    HA   VAL   5           HA       VAL   5  -3.131   6.381  -8.886
   33    HB   VAL   5           HB       VAL   5  -5.015   6.294  -7.596
   34   1HG1  VAL   5          1HG1      VAL   5  -5.088   5.788  -5.210
   35   2HG1  VAL   5          2HG1      VAL   5  -3.375   5.216  -5.262
   36   3HG1  VAL   5          3HG1      VAL   5  -4.656   4.369  -6.236
   37   1HG2  VAL   5          1HG2      VAL   5  -4.758   8.108  -5.985
   38   2HG2  VAL   5          2HG2      VAL   5  -3.666   8.456  -7.382
   39   3HG2  VAL   5          3HG2      VAL   5  -3.001   7.826  -5.837
   40    H    THR   6           H        THR   6  -1.598   7.796  -8.972
   41    HA   THR   6           HA       THR   6   0.625   7.752  -7.200
   42    HB   THR   6           HB       THR   6   0.752  10.207  -8.252
   43    HG1  THR   6           1HG      THR   6  -0.570  10.420  -9.806
   44   1HG2  THR   6          1HG2      THR   6   2.427   8.337  -8.438
   45   2HG2  THR   6          2HG2      THR   6   2.154   9.103 -10.044
   46   3HG2  THR   6          3HG2      THR   6   1.390   7.514  -9.663
   47    H    LEU   7           H        LEU   7   0.304   8.197  -5.124
   48    HA   LEU   7           HA       LEU   7  -1.763  10.056  -4.317
   49   1HB   LEU   7          2HB       LEU   7  -1.426   7.845  -3.198
   50   2HB   LEU   7          1HB       LEU   7   0.220   8.334  -2.747
   51    HG   LEU   7           HG       LEU   7  -0.787  10.227  -1.359
   52   1HD1  LEU   7          1HD1      LEU   7  -3.198   9.999  -0.685
   53   2HD1  LEU   7          2HD1      LEU   7  -3.425   8.734  -1.958
   54   3HD1  LEU   7          3HD1      LEU   7  -3.027  10.434  -2.426
   55   1HD2  LEU   7          1HD2      LEU   7  -1.589   8.623   0.464
   56   2HD2  LEU   7          2HD2      LEU   7   0.004   8.210  -0.269
   57   3HD2  LEU   7          3HD2      LEU   7  -1.471   7.291  -0.748
   58    H    THR   8           H        THR   8  -1.411  12.079  -3.547
   59    HA   THR   8           HA       THR   8   1.363  12.995  -3.302
   60    HB   THR   8           HB       THR   8   0.548  13.803  -5.387
   61    HG1  THR   8           1HG      THR   8   0.188  15.985  -3.692
   62   1HG2  THR   8          1HG2      THR   8  -1.849  14.989  -3.822
   63   2HG2  THR   8          2HG2      THR   8  -1.914  13.669  -5.046
   64   3HG2  THR   8          3HG2      THR   8  -1.423  15.322  -5.537
   65    H    GLY   9           H        GLY   9   1.699  14.632  -1.671
   66   1HA   GLY   9          2HA       GLY   9   0.015  15.995  -0.237
   67   2HA   GLY   9          1HA       GLY   9  -0.178  14.348   0.486
   68    HA   PRO  10           HA       PRO  10   3.342  16.537   2.331
   69   1HB   PRO  10          2HB       PRO  10   2.762  16.168   5.036
   70   2HB   PRO  10          1HB       PRO  10   2.067  17.467   4.006
   71   1HG   PRO  10          2HG       PRO  10   0.773  14.772   4.695
   72   2HG   PRO  10          1HG       PRO  10   0.045  16.427   4.781
   73   1HD   PRO  10          2HD       PRO  10  -0.342  14.790   2.597
   74   2HD   PRO  10          1HD       PRO  10  -0.111  16.587   2.383
   75    H    GLY  11           H        GLY  11   2.157  13.419   3.621
   76   1HA   GLY  11          2HA       GLY  11   4.275  11.852   3.186
   77   2HA   GLY  11          1HA       GLY  11   4.778  12.807   4.625
   78    HA   PRO  12           HA       PRO  12   2.103  10.117   6.922
   79   1HB   PRO  12          2HB       PRO  12   0.257  12.467   7.577
   80   2HB   PRO  12          1HB       PRO  12   0.847  11.155   8.679
   81   1HG   PRO  12          2HG       PRO  12   2.074  13.597   8.719
   82   2HG   PRO  12          1HG       PRO  12   3.119  12.108   8.636
   83   1HD   PRO  12          2HD       PRO  12   2.208  13.913   6.311
   84   2HD   PRO  12          1HD       PRO  12   3.879  13.295   6.690
   85    H    TRP  13           H        TRP  13   1.233   8.734   5.424
   86    HA   TRP  13           HA       TRP  13  -1.046   9.567   3.896
   87   1HB   TRP  13          2HB       TRP  13   0.250   6.810   3.894
   88   2HB   TRP  13          1HB       TRP  13  -0.786   7.465   2.678
   89    HD1  TRP  13           HD       TRP  13   2.732   6.883   3.405
   90    HE1  TRP  13           1HE      TRP  13   4.295   8.222   1.849
   91    HE3  TRP  13           3HE      TRP  13  -0.548  10.433   1.862
   92    HZ2  TRP  13           2HZ      TRP  13   4.149  10.494   0.261
   93    HZ3  TRP  13           3HZ      TRP  13   0.250  12.216   0.420
   94    HH2  TRP  13           HH       TRP  13   2.603  12.298  -0.325
   95    H    GLY  14           H        GLY  14  -0.501   6.895   6.255
   96   1HA   GLY  14          2HA       GLY  14  -1.753   6.872   8.141
   97   2HA   GLY  14          1HA       GLY  14  -3.174   7.498   7.261
   98    H    PHE  15           H        PHE  15  -1.101   4.705   6.527
   99    HA   PHE  15           HA       PHE  15  -3.467   2.977   6.684
  100   1HB   PHE  15          2HB       PHE  15  -2.540   1.889   4.607
  101   2HB   PHE  15          1HB       PHE  15  -2.689   3.641   4.430
  102    HD1  PHE  15           1HD      PHE  15  -0.867   5.030   4.324
  103    HD2  PHE  15           2HD      PHE  15  -0.129   0.888   5.022
  104    HE1  PHE  15           1HE      PHE  15   1.585   5.425   4.340
  105    HE2  PHE  15           2HE      PHE  15   2.250   1.293   4.735
  106    HZ   PHE  15           HZ       PHE  15   3.120   3.537   4.545
  107    H    ARG  16           H        ARG  16  -3.265   0.723   7.027
  108    HA   ARG  16           HA       ARG  16  -1.273   0.340   9.097
  109   1HB   ARG  16          2HB       ARG  16  -4.120  -0.711   8.717
  110   2HB   ARG  16          1HB       ARG  16  -2.994  -1.526   9.830
  111   1HG   ARG  16          2HG       ARG  16  -3.928   1.402  10.014
  112   2HG   ARG  16          1HG       ARG  16  -4.492   0.024  11.012
  113   1HD   ARG  16          2HD       ARG  16  -2.133  -0.265  11.911
  114   2HD   ARG  16          1HD       ARG  16  -1.633   1.213  10.978
  115    HE   ARG  16           HE       ARG  16  -4.005   1.658  12.675
  116   1HH1  ARG  16          1HH1      ARG  16  -0.445   1.190  12.929
  117   2HH1  ARG  16          2HH1      ARG  16  -0.423   1.955  14.491
  118   1HH2  ARG  16          1HH2      ARG  16  -3.671   3.201  14.388
  119   2HH2  ARG  16          2HH2      ARG  16  -2.178   3.159  15.261
  120    H    LEU  17           H        LEU  17   0.274  -1.132   8.807
  121    HA   LEU  17           HA       LEU  17   0.078  -2.666   6.405
  122   1HB   LEU  17          2HB       LEU  17   2.312  -2.121   8.454
  123   2HB   LEU  17          1HB       LEU  17   2.548  -3.180   7.027
  124    HG   LEU  17           HG       LEU  17   3.497  -1.041   6.579
  125   1HD1  LEU  17          1HD1      LEU  17   2.182  -2.355   4.846
  126   2HD1  LEU  17          2HD1      LEU  17   2.593  -0.659   4.446
  127   3HD1  LEU  17          3HD1      LEU  17   0.902  -1.084   4.974
  128   1HD2  LEU  17          1HD2      LEU  17   2.521   1.096   6.832
  129   2HD2  LEU  17          2HD2      LEU  17   2.136   0.210   8.339
  130   3HD2  LEU  17          3HD2      LEU  17   0.866   0.435   7.075
  131    H    GLN  18           H        GLN  18  -0.195  -4.879   6.229
  132    HA   GLN  18           HA       GLN  18   0.613  -6.464   8.516
  133   1HB   GLN  18          2HB       GLN  18  -2.208  -6.504   7.359
  134   2HB   GLN  18          1HB       GLN  18  -1.484  -7.883   8.251
  135   1HG   GLN  18          2HG       GLN  18  -1.053  -6.218  10.197
  136   2HG   GLN  18          1HG       GLN  18  -2.162  -5.092   9.353
  137   1HE2  GLN  18          1HE2      GLN  18  -1.923  -8.016  11.334
  138   2HE2  GLN  18          2HE2      GLN  18  -3.637  -8.310  11.400
  139    H    GLY  19           H        GLY  19   1.514  -8.364   8.005
  140   1HA   GLY  19          2HA       GLY  19   1.613 -10.308   6.893
  141   2HA   GLY  19          1HA       GLY  19   0.783  -9.586   5.479
  142    H    GLY  20           H        GLY  20   2.016  -9.980   3.756
  143   1HA   GLY  20          2HA       GLY  20   3.732  -9.597   2.408
  144   2HA   GLY  20          1HA       GLY  20   4.759  -9.053   3.781
  145    H    LYS  21           H        LYS  21   6.166 -10.468   2.182
  146    HA   LYS  21           HA       LYS  21   6.133 -13.174   2.234
  147   1HB   LYS  21          2HB       LYS  21   8.115 -10.996   1.814
  148   2HB   LYS  21          1HB       LYS  21   8.855 -12.519   2.355
  149   1HG   LYS  21          2HG       LYS  21   8.966 -12.414   0.041
  150   2HG   LYS  21          1HG       LYS  21   7.911 -13.763   0.472
  151   1HD   LYS  21          2HD       LYS  21   6.829 -10.980  -0.353
  152   2HD   LYS  21          1HD       LYS  21   7.375 -12.167  -1.556
  153   1HE   LYS  21          2HE       LYS  21   4.998 -12.587   0.359
  154   2HE   LYS  21          1HE       LYS  21   4.965 -12.269  -1.416
  155   1HZ   LYS  21          1HZ       LYS  21   6.448 -14.370  -1.527
  156   2HZ   LYS  21          2HZ       LYS  21   4.802 -14.548  -1.284
  157   3HZ   LYS  21          3HZ       LYS  21   5.893 -14.701   0.007
  158    H    ASP  22           H        ASP  22   7.194 -11.065   4.797
  159    HA   ASP  22           HA       ASP  22   8.448 -12.641   6.552
  160   1HB   ASP  22          2HB       ASP  22   7.824 -10.153   6.472
  161   2HB   ASP  22          1HB       ASP  22   6.224 -10.577   7.145
  162    H    PHE  23           H        PHE  23   4.875 -12.357   6.281
  163    HA   PHE  23           HA       PHE  23   4.518 -14.468   8.245
  164   1HB   PHE  23          2HB       PHE  23   2.804 -12.368   6.821
  165   2HB   PHE  23          1HB       PHE  23   1.996 -13.767   7.595
  166    HD1  PHE  23           1HD      PHE  23   1.808 -13.991   9.877
  167    HD2  PHE  23           2HD      PHE  23   4.183 -10.845   8.287
  168    HE1  PHE  23           1HE      PHE  23   1.907 -12.953  12.089
  169    HE2  PHE  23           2HE      PHE  23   4.320  -9.831  10.502
  170    HZ   PHE  23           HZ       PHE  23   3.180 -10.869  12.411
  171    H    ASN  24           H        ASN  24   5.271 -14.572   5.104
  172    HA   ASN  24           HA       ASN  24   4.824 -15.650   3.350
  173   1HB   ASN  24          2HB       ASN  24   5.412 -17.555   4.966
  174   2HB   ASN  24          1HB       ASN  24   3.657 -17.953   4.985
  175   1HD2  ASN  24          1HD2      ASN  24   4.768 -20.041   4.082
  176   2HD2  ASN  24          2HD2      ASN  24   5.066 -20.099   2.357
  177    H    MET  25           H        MET  25   3.216 -13.765   3.462
  178    HA   MET  25           HA       MET  25   0.492 -14.632   2.906
  179   1HB   MET  25          2HB       MET  25   1.162 -13.770   5.178
  180   2HB   MET  25          1HB       MET  25   1.749 -12.248   4.397
  181   1HG   MET  25          2HG       MET  25  -0.274 -11.976   5.706
  182   2HG   MET  25          1HG       MET  25  -0.561 -11.586   4.002
  183   1HE   MET  25          1HE       MET  25  -2.877 -11.745   5.865
  184   2HE   MET  25          2HE       MET  25  -4.052 -12.802   5.024
  185   3HE   MET  25          3HE       MET  25  -3.066 -11.634   4.078
  186    HA   PRO  26           HA       PRO  26   1.447 -11.747  -0.485
  187   1HB   PRO  26          2HB       PRO  26  -1.088 -10.324  -0.654
  188   2HB   PRO  26          1HB       PRO  26  -0.590 -11.770  -1.557
  189   1HG   PRO  26          2HG       PRO  26  -2.552 -11.568   0.621
  190   2HG   PRO  26          1HG       PRO  26  -2.187 -12.940  -0.460
  191   1HD   PRO  26          2HD       PRO  26  -1.242 -12.116   2.268
  192   2HD   PRO  26          1HD       PRO  26  -1.136 -13.831   1.725
  193    H    LEU  27           H        LEU  27   2.001  -9.370  -0.702
  194    HA   LEU  27           HA       LEU  27   2.199  -8.127   1.830
  195   1HB   LEU  27          2HB       LEU  27   3.483  -7.948  -0.619
  196   2HB   LEU  27          1HB       LEU  27   2.555  -6.432  -0.604
  197    HG   LEU  27           HG       LEU  27   4.485  -7.532   1.537
  198   1HD1  LEU  27          1HD1      LEU  27   4.752  -5.168  -0.438
  199   2HD1  LEU  27          2HD1      LEU  27   5.581  -6.776  -0.535
  200   3HD1  LEU  27          3HD1      LEU  27   5.970  -5.641   0.816
  201   1HD2  LEU  27          1HD2      LEU  27   4.310  -5.266   2.653
  202   2HD2  LEU  27          2HD2      LEU  27   2.730  -6.126   2.691
  203   3HD2  LEU  27          3HD2      LEU  27   3.026  -4.825   1.458
  204    H    THR  28           H        THR  28   0.565  -7.270   2.893
  205    HA   THR  28           HA       THR  28  -1.713  -6.293   1.311
  206    HB   THR  28           HB       THR  28  -3.244  -7.136   2.605
  207    HG1  THR  28           1HG      THR  28  -1.293  -7.367   4.637
  208   1HG2  THR  28          1HG2      THR  28  -1.107  -9.263   3.153
  209   2HG2  THR  28          2HG2      THR  28  -1.530  -8.808   1.464
  210   3HG2  THR  28          3HG2      THR  28  -2.807  -9.460   2.568
  211    H    ILE  29           H        ILE  29  -3.018  -4.706   2.252
  212    HA   ILE  29           HA       ILE  29  -1.919  -3.279   4.598
  213    HB   ILE  29           HB       ILE  29  -3.372  -2.047   2.274
  214   1HG1  ILE  29          2HG1      ILE  29  -0.564  -1.996   3.474
  215   2HG1  ILE  29          1HG1      ILE  29  -1.032  -2.433   1.809
  216   1HG2  ILE  29          1HG2      ILE  29  -2.505  -0.907   5.034
  217   2HG2  ILE  29          2HG2      ILE  29  -4.225  -1.169   4.478
  218   3HG2  ILE  29          3HG2      ILE  29  -3.209   0.041   3.688
  219   1HD1  ILE  29          1HD1      ILE  29  -1.623  -0.092   1.292
  220   2HD1  ILE  29          2HD1      ILE  29   0.067  -0.190   1.923
  221   3HD1  ILE  29          3HD1      ILE  29  -1.236   0.408   2.996
  222    H    SER  30           H        SER  30  -3.460  -2.896   6.182
  223    HA   SER  30           HA       SER  30  -5.765  -4.679   6.124
  224   1HB   SER  30          2HB       SER  30  -4.411  -4.944   8.015
  225   2HB   SER  30          1HB       SER  30  -4.188  -3.205   8.257
  226    HG   SER  30           HG       SER  30  -5.608  -4.030   9.746
  227    H    ARG  31           H        ARG  31  -5.406  -1.386   7.528
  228    HA   ARG  31           HA       ARG  31  -7.777  -0.525   6.077
  229   1HB   ARG  31          2HB       ARG  31  -7.414  -0.926   9.070
  230   2HB   ARG  31          1HB       ARG  31  -8.520   0.355   8.504
  231   1HG   ARG  31          2HG       ARG  31 -10.044  -1.092   7.532
  232   2HG   ARG  31          1HG       ARG  31  -8.912  -2.454   7.390
  233   1HD   ARG  31          2HD       ARG  31  -9.859  -1.403  10.132
  234   2HD   ARG  31          1HD       ARG  31 -10.715  -2.702   9.190
  235    HE   ARG  31           HE       ARG  31  -7.912  -3.356   9.279
  236   1HH1  ARG  31          1HH1      ARG  31 -10.707  -3.299  11.596
  237   2HH1  ARG  31          2HH1      ARG  31 -10.084  -4.741  12.367
  238   1HH2  ARG  31          1HH2      ARG  31  -7.220  -5.137  10.507
  239   2HH2  ARG  31          2HH2      ARG  31  -8.249  -5.712  11.806
  240    H    ILE  32           H        ILE  32  -8.267   1.779   6.693
  241    HA   ILE  32           HA       ILE  32  -5.852   3.393   6.677
  242    HB   ILE  32           HB       ILE  32  -8.780   3.827   6.042
  243   1HG1  ILE  32          2HG1      ILE  32  -8.132   4.639   3.912
  244   2HG1  ILE  32          1HG1      ILE  32  -6.402   4.561   4.228
  245   1HG2  ILE  32          1HG2      ILE  32  -6.539   5.919   6.336
  246   2HG2  ILE  32          2HG2      ILE  32  -8.182   5.893   7.148
  247   3HG2  ILE  32          3HG2      ILE  32  -8.060   6.185   5.393
  248   1HD1  ILE  32          1HD1      ILE  32  -6.649   1.993   4.315
  249   2HD1  ILE  32          2HD1      ILE  32  -7.032   2.746   2.735
  250   3HD1  ILE  32          3HD1      ILE  32  -8.382   2.208   3.819
  251    H    THR  33           H        THR  33  -5.625   5.057   8.300
  252    HA   THR  33           HA       THR  33  -7.253   4.749  10.678
  253    HB   THR  33           HB       THR  33  -5.022   6.703  10.064
  254    HG1  THR  33           1HG      THR  33  -4.332   4.653  10.483
  255   1HG2  THR  33          1HG2      THR  33  -5.269   7.241  12.539
  256   2HG2  THR  33          2HG2      THR  33  -6.782   6.238  12.572
  257   3HG2  THR  33          3HG2      THR  33  -6.733   7.736  11.606
  258    HA   PRO  34           HA       PRO  34  -9.906   7.655   8.678
  259   1HB   PRO  34          2HB       PRO  34 -11.823   8.137  10.587
  260   2HB   PRO  34          1HB       PRO  34 -11.461   6.463   9.924
  261   1HG   PRO  34          2HG       PRO  34 -10.232   7.515  12.514
  262   2HG   PRO  34          1HG       PRO  34 -11.343   6.088  12.306
  263   1HD   PRO  34          2HD       PRO  34  -8.651   5.743  12.092
  264   2HD   PRO  34          1HD       PRO  34  -9.725   4.941  10.866
  265    H    GLY  35           H        GLY  35 -10.406   9.871   8.446
  266   1HA   GLY  35          2HA       GLY  35 -10.100  12.037   8.742
  267   2HA   GLY  35          1HA       GLY  35  -9.311  11.737  10.321
  268    H    SER  36           H        SER  36  -7.907   9.890   7.888
  269    HA   SER  36           HA       SER  36  -5.675  11.792   7.661
  270   1HB   SER  36          2HB       SER  36  -5.605   8.736   7.484
  271   2HB   SER  36          1HB       SER  36  -4.193   9.858   7.490
  272    HG   SER  36           HG       SER  36  -6.045   9.243   9.515
  273    H    LYS  37           H        LYS  37  -4.330  11.396   5.611
  274    HA   LYS  37           HA       LYS  37  -5.885  12.028   3.475
  275   1HB   LYS  37          2HB       LYS  37  -3.020  11.403   3.950
  276   2HB   LYS  37          1HB       LYS  37  -3.522  11.201   2.253
  277   1HG   LYS  37          2HG       LYS  37  -4.063  13.752   3.856
  278   2HG   LYS  37          1HG       LYS  37  -2.620  13.474   2.837
  279   1HD   LYS  37          2HD       LYS  37  -4.045  13.133   0.827
  280   2HD   LYS  37          1HD       LYS  37  -5.527  13.412   1.803
  281   1HE   LYS  37          2HE       LYS  37  -4.793  15.733   2.325
  282   2HE   LYS  37          1HE       LYS  37  -3.257  15.461   1.404
  283   1HZ   LYS  37          1HZ       LYS  37  -4.509  15.238  -0.599
  284   2HZ   LYS  37          2HZ       LYS  37  -4.946  16.658   0.171
  285   3HZ   LYS  37          3HZ       LYS  37  -5.998  15.342   0.203
  286    H    ALA  38           H        ALA  38  -4.584   8.839   4.226
  287    HA   ALA  38           HA       ALA  38  -5.437   7.393   2.026
  288   1HB   ALA  38          1HB       ALA  38  -5.127   6.484   4.889
  289   2HB   ALA  38          2HB       ALA  38  -3.786   6.771   3.723
  290   3HB   ALA  38          3HB       ALA  38  -4.979   5.522   3.341
  291    H    ALA  39           H        ALA  39  -7.498   8.823   4.460
  292    HA   ALA  39           HA       ALA  39  -9.717   7.170   3.546
  293   1HB   ALA  39          1HB       ALA  39  -9.527   7.586   6.022
  294   2HB   ALA  39          2HB       ALA  39 -11.000   8.346   5.348
  295   3HB   ALA  39          3HB       ALA  39  -9.562   9.360   5.720
  296    H    GLN  40           H        GLN  40  -8.643  10.530   3.743
  297    HA   GLN  40           HA       GLN  40 -10.797  11.852   2.784
  298   1HB   GLN  40          2HB       GLN  40  -7.792  12.275   2.599
  299   2HB   GLN  40          1HB       GLN  40  -8.878  13.528   1.971
  300   1HG   GLN  40          2HG       GLN  40  -9.124  12.507   4.873
  301   2HG   GLN  40          1HG       GLN  40  -7.948  13.772   4.398
  302   1HE2  GLN  40          1HE2      GLN  40  -8.651  15.862   4.381
  303   2HE2  GLN  40          2HE2      GLN  40 -10.334  16.330   4.495
  304    H    SER  41           H        SER  41  -8.154  10.547   0.827
  305    HA   SER  41           HA       SER  41  -9.095  12.061  -1.437
  306   1HB   SER  41          2HB       SER  41  -6.727  11.933  -0.561
  307   2HB   SER  41          1HB       SER  41  -6.613  10.287  -1.261
  308    HG   SER  41           HG       SER  41  -6.252  11.303  -3.104
  309    H    GLN  42           H        GLN  42  -7.831  10.038  -3.436
  310    HA   GLN  42           HA       GLN  42 -10.288   8.608  -3.806
  311   1HB   GLN  42          2HB       GLN  42  -9.437   8.121  -5.988
  312   2HB   GLN  42          1HB       GLN  42  -9.339   9.866  -5.678
  313   1HG   GLN  42          2HG       GLN  42  -6.920   7.945  -5.412
  314   2HG   GLN  42          1HG       GLN  42  -7.372   8.771  -6.927
  315   1HE2  GLN  42          1HE2      GLN  42  -7.448  11.185  -6.914
  316   2HE2  GLN  42          2HE2      GLN  42  -6.297  12.023  -5.905
  317    H    LEU  43           H        LEU  43  -7.390   8.168  -2.297
  318    HA   LEU  43           HA       LEU  43  -6.668   5.545  -2.907
  319   1HB   LEU  43          2HB       LEU  43  -5.402   7.579  -1.789
  320   2HB   LEU  43          1HB       LEU  43  -6.175   7.054  -0.277
  321    HG   LEU  43           HG       LEU  43  -5.078   4.690  -0.865
  322   1HD1  LEU  43          1HD1      LEU  43  -3.378   6.577  -2.621
  323   2HD1  LEU  43          2HD1      LEU  43  -4.456   5.279  -3.215
  324   3HD1  LEU  43          3HD1      LEU  43  -3.006   4.859  -2.231
  325   1HD2  LEU  43          1HD2      LEU  43  -2.781   5.670   0.056
  326   2HD2  LEU  43          2HD2      LEU  43  -4.206   5.661   1.098
  327   3HD2  LEU  43          3HD2      LEU  43  -3.715   7.185   0.256
  328    H    SER  44           H        SER  44  -7.014   3.577  -1.864
  329    HA   SER  44           HA       SER  44  -7.933   3.677   0.847
  330   1HB   SER  44          2HB       SER  44  -9.529   2.117  -1.261
  331   2HB   SER  44          1HB       SER  44  -9.618   1.787   0.503
  332    HG   SER  44           HG       SER  44 -10.058   4.346  -0.605
  333    H    GLN  45           H        GLN  45  -5.426   3.131   0.734
  334    HA   GLN  45           HA       GLN  45  -4.516   0.725   0.074
  335   1HB   GLN  45          2HB       GLN  45  -4.185   2.657   2.434
  336   2HB   GLN  45          1HB       GLN  45  -3.084   1.266   2.185
  337   1HG   GLN  45          2HG       GLN  45  -2.507   1.996  -0.041
  338   2HG   GLN  45          1HG       GLN  45  -3.545   3.452   0.052
  339   1HE2  GLN  45          2HE2      GLN  45  -0.524   2.501   0.258
  340   2HE2  GLN  45          1HE2      GLN  45   0.239   3.766   1.247
  341    H    GLY  46           H        GLY  46  -5.633  -1.194   0.382
  342   1HA   GLY  46          2HA       GLY  46  -5.468  -2.335   2.912
  343   2HA   GLY  46          1HA       GLY  46  -7.122  -1.698   2.715
  344    H    ASP  47           H        ASP  47  -4.737  -3.284   0.551
  345    HA   ASP  47           HA       ASP  47  -6.364  -5.598   0.251
  346   1HB   ASP  47          2HB       ASP  47  -7.183  -3.519  -1.320
  347   2HB   ASP  47          1HB       ASP  47  -5.851  -4.060  -2.370
  348    H    LEU  48           H        LEU  48  -5.139  -6.598  -2.078
  349    HA   LEU  48           HA       LEU  48  -2.529  -7.124  -1.000
  350   1HB   LEU  48          2HB       LEU  48  -3.963  -8.253  -3.445
  351   2HB   LEU  48          1HB       LEU  48  -2.354  -8.753  -2.847
  352    HG   LEU  48           HG       LEU  48  -3.642 -10.422  -1.929
  353   1HD1  LEU  48          1HD1      LEU  48  -4.075 -10.119   0.456
  354   2HD1  LEU  48          2HD1      LEU  48  -4.106  -8.329   0.301
  355   3HD1  LEU  48          3HD1      LEU  48  -2.563  -9.220  -0.025
  356   1HD2  LEU  48          1HD2      LEU  48  -5.864  -9.312  -2.747
  357   2HD2  LEU  48          2HD2      LEU  48  -5.824  -8.404  -1.168
  358   3HD2  LEU  48          3HD2      LEU  48  -5.942 -10.213  -1.144
  359    H    VAL  49           H        VAL  49  -0.903  -5.817  -1.396
  360    HA   VAL  49           HA       VAL  49  -1.074  -3.904  -3.469
  361    HB   VAL  49           HB       VAL  49   1.161  -4.522  -1.501
  362   1HG1  VAL  49          1HG1      VAL  49   1.701  -2.093  -1.903
  363   2HG1  VAL  49          2HG1      VAL  49   0.432  -2.031  -3.188
  364   3HG1  VAL  49          3HG1      VAL  49   1.897  -3.072  -3.406
  365   1HG2  VAL  49          1HG2      VAL  49  -1.286  -2.642  -1.290
  366   2HG2  VAL  49          2HG2      VAL  49   0.120  -2.664  -0.169
  367   3HG2  VAL  49          3HG2      VAL  49  -0.959  -4.090  -0.263
  368    H    VAL  50           H        VAL  50  -0.241  -4.174  -5.535
  369    HA   VAL  50           HA       VAL  50   1.151  -6.650  -6.074
  370    HB   VAL  50           HB       VAL  50   0.301  -4.556  -8.114
  371   1HG1  VAL  50          1HG1      VAL  50   1.917  -6.306  -8.884
  372   2HG1  VAL  50          2HG1      VAL  50   0.279  -6.601  -9.562
  373   3HG1  VAL  50          3HG1      VAL  50   0.871  -7.594  -8.180
  374   1HG2  VAL  50          1HG2      VAL  50  -1.700  -4.976  -6.911
  375   2HG2  VAL  50          2HG2      VAL  50  -1.369  -6.763  -6.797
  376   3HG2  VAL  50          3HG2      VAL  50  -1.743  -5.986  -8.389
  377    H    ALA  51           H        ALA  51   1.454  -3.274  -7.057
  378    HA   ALA  51           HA       ALA  51   4.373  -3.522  -7.101
  379   1HB   ALA  51          1HB       ALA  51   4.375  -2.000  -9.071
  380   2HB   ALA  51          2HB       ALA  51   2.578  -1.915  -9.020
  381   3HB   ALA  51          3HB       ALA  51   3.395  -3.472  -9.417
  382    H    ILE  52           H        ILE  52   5.586  -1.883  -6.364
  383    HA   ILE  52           HA       ILE  52   4.239   0.438  -5.210
  384    HB   ILE  52           HB       ILE  52   4.832  -1.657  -3.778
  385   1HG1  ILE  52          2HG1      ILE  52   5.493   1.145  -2.710
  386   2HG1  ILE  52          1HG1      ILE  52   3.834   0.586  -3.106
  387   1HG2  ILE  52          1HG2      ILE  52   7.231  -1.768  -4.417
  388   2HG2  ILE  52          2HG2      ILE  52   7.019  -1.545  -2.643
  389   3HG2  ILE  52          3HG2      ILE  52   7.498  -0.145  -3.677
  390   1HD1  ILE  52          1HD1      ILE  52   5.705  -0.719  -1.028
  391   2HD1  ILE  52          2HD1      ILE  52   4.094  -1.360  -1.522
  392   3HD1  ILE  52          3HD1      ILE  52   4.209   0.231  -0.702
  393    H    ASP  53           H        ASP  53   5.161   2.273  -5.824
  394    HA   ASP  53           HA       ASP  53   6.298   3.612  -7.049
  395   1HB   ASP  53          2HB       ASP  53   8.093   2.938  -5.299
  396   2HB   ASP  53          1HB       ASP  53   8.857   1.998  -6.619
  397    H    GLY  54           H        GLY  54   5.152   1.087  -8.135
  398   1HA   GLY  54          2HA       GLY  54   4.751   0.473 -10.275
  399   2HA   GLY  54          1HA       GLY  54   6.282   1.241 -10.812
  400    H    VAL  55           H        VAL  55   7.068  -0.570  -8.070
  401    HA   VAL  55           HA       VAL  55   8.084  -2.613  -9.881
  402    HB   VAL  55           HB       VAL  55   9.161  -1.793  -7.176
  403   1HG1  VAL  55          1HG1      VAL  55   9.792  -4.119  -7.846
  404   2HG1  VAL  55          2HG1      VAL  55  11.205  -3.049  -8.136
  405   3HG1  VAL  55          3HG1      VAL  55  10.183  -3.563  -9.513
  406   1HG2  VAL  55          1HG2      VAL  55   9.375   0.132  -8.696
  407   2HG2  VAL  55          2HG2      VAL  55   9.971  -0.935 -10.032
  408   3HG2  VAL  55          3HG2      VAL  55  10.974  -0.676  -8.555
  409    H    ASN  56           H        ASN  56   7.646  -4.735  -9.516
  410    HA   ASN  56           HA       ASN  56   5.427  -5.365  -7.973
  411   1HB   ASN  56          2HB       ASN  56   5.903  -7.683  -8.804
  412   2HB   ASN  56          1HB       ASN  56   5.876  -6.444 -10.097
  413   1HD2  ASN  56          1HD2      ASN  56   7.367  -9.204  -9.566
  414   2HD2  ASN  56          2HD2      ASN  56   8.979  -8.811 -10.091
  415    H    THR  57           H        THR  57   5.145  -6.223  -5.987
  416    HA   THR  57           HA       THR  57   7.184  -6.136  -4.144
  417    HB   THR  57           HB       THR  57   5.363  -6.965  -2.601
  418    HG1  THR  57           1HG      THR  57   3.641  -6.594  -4.733
  419   1HG2  THR  57          1HG2      THR  57   3.945  -4.957  -2.890
  420   2HG2  THR  57          2HG2      THR  57   4.689  -4.618  -4.494
  421   3HG2  THR  57          3HG2      THR  57   5.698  -4.554  -3.005
  422    H    ASP  58           H        ASP  58   7.883  -8.154  -6.025
  423    HA   ASP  58           HA       ASP  58   6.993 -10.630  -5.501
  424   1HB   ASP  58          2HB       ASP  58   8.610  -9.465  -7.351
  425   2HB   ASP  58          1HB       ASP  58   9.885 -10.337  -6.439
  426    H    THR  59           H        THR  59   9.657  -9.085  -3.799
  427    HA   THR  59           HA       THR  59   9.576 -11.324  -1.927
  428    HB   THR  59           HB       THR  59  11.481 -11.651  -3.448
  429    HG1  THR  59           1HG      THR  59  12.032 -10.942  -0.795
  430   1HG2  THR  59          1HG2      THR  59  12.514  -8.964  -2.313
  431   2HG2  THR  59          2HG2      THR  59  11.967  -9.253  -4.007
  432   3HG2  THR  59          3HG2      THR  59  13.417 -10.101  -3.374
  433    H    MET  60           H        MET  60   8.315  -8.636  -1.899
  434    HA   MET  60           HA       MET  60   9.865  -7.193   0.042
  435   1HB   MET  60          2HB       MET  60   7.502  -6.733  -1.809
  436   2HB   MET  60          1HB       MET  60   7.809  -5.606  -0.446
  437   1HG   MET  60          2HG       MET  60   8.725  -4.626  -2.348
  438   2HG   MET  60          1HG       MET  60  10.090  -5.144  -1.334
  439   1HE   MET  60          1HE       MET  60  10.462  -5.138  -5.467
  440   2HE   MET  60          2HE       MET  60  10.599  -4.085  -4.017
  441   3HE   MET  60          3HE       MET  60   8.982  -4.523  -4.664
  442    H    THR  61           H        THR  61   8.979  -6.461   2.018
  443    HA   THR  61           HA       THR  61   7.001  -8.307   3.142
  444    HB   THR  61           HB       THR  61   8.249  -8.113   5.238
  445    HG1  THR  61           1HG      THR  61  10.219  -7.088   5.182
  446   1HG2  THR  61          1HG2      THR  61   8.890  -9.888   3.531
  447   2HG2  THR  61          2HG2      THR  61  10.278  -9.344   4.542
  448   3HG2  THR  61          3HG2      THR  61  10.118  -8.757   2.855
  449    H    HIS  62           H        HIS  62   6.147  -7.399   5.327
  450    HA   HIS  62           HA       HIS  62   4.859  -5.041   5.285
  451   1HB   HIS  62          2HB       HIS  62   4.600  -6.816   6.965
  452   2HB   HIS  62          1HB       HIS  62   6.209  -6.464   7.643
  453    HD1  HIS  62           1HD      HIS  62   3.314  -6.406   9.086
  454    HD2  HIS  62           2HD      HIS  62   5.773  -3.133   8.165
  455    HE1  HIS  62           1HE      HIS  62   2.770  -4.551  10.702
  456    H    LEU  63           H        LEU  63   8.138  -5.482   6.696
  457    HA   LEU  63           HA       LEU  63   8.732  -2.845   7.212
  458   1HB   LEU  63          2HB       LEU  63  10.083  -4.711   8.006
  459   2HB   LEU  63          1HB       LEU  63  10.433  -5.233   6.334
  460    HG   LEU  63           HG       LEU  63  11.736  -3.100   5.954
  461   1HD1  LEU  63          1HD1      LEU  63  10.651  -1.622   7.644
  462   2HD1  LEU  63          2HD1      LEU  63  12.417  -1.754   7.952
  463   3HD1  LEU  63          3HD1      LEU  63  11.251  -2.683   8.976
  464   1HD2  LEU  63          1HD2      LEU  63  12.845  -5.202   6.529
  465   2HD2  LEU  63          2HD2      LEU  63  12.599  -4.887   8.292
  466   3HD2  LEU  63          3HD2      LEU  63  13.688  -3.812   7.322
  467    H    GLU  64           H        GLU  64   9.443  -4.705   4.189
  468    HA   GLU  64           HA       GLU  64  10.714  -2.549   3.034
  469   1HB   GLU  64          2HB       GLU  64  10.379  -5.206   2.409
  470   2HB   GLU  64          1HB       GLU  64   9.451  -4.441   1.075
  471   1HG   GLU  64          2HG       GLU  64  11.482  -3.001   0.582
  472   2HG   GLU  64          1HG       GLU  64  12.280  -3.636   2.065
  473    H    ALA  65           H        ALA  65   7.283  -3.514   2.676
  474    HA   ALA  65           HA       ALA  65   6.698  -1.529   0.801
  475   1HB   ALA  65          1HB       ALA  65   5.447  -3.614   1.288
  476   2HB   ALA  65          2HB       ALA  65   4.346  -2.168   1.326
  477   3HB   ALA  65          3HB       ALA  65   4.915  -2.934   2.875
  478    H    GLN  66           H        GLN  66   6.614  -1.441   4.338
  479    HA   GLN  66           HA       GLN  66   5.527   1.081   4.707
  480   1HB   GLN  66          2HB       GLN  66   5.861  -0.541   6.514
  481   2HB   GLN  66          1HB       GLN  66   7.568  -0.687   6.129
  482   1HG   GLN  66          2HG       GLN  66   7.464   0.455   8.165
  483   2HG   GLN  66          1HG       GLN  66   8.035   1.643   6.963
  484   1HE2  GLN  66          1HE2      GLN  66   4.761   0.435   7.906
  485   2HE2  GLN  66          2HE2      GLN  66   4.143   1.957   8.476
  486    H    ASN  67           H        ASN  67   8.924   0.075   4.305
  487    HA   ASN  67           HA       ASN  67  10.027   2.635   4.320
  488   1HB   ASN  67          2HB       ASN  67  10.919  -0.114   3.284
  489   2HB   ASN  67          1HB       ASN  67  11.994   1.314   3.160
  490   1HD2  ASN  67          1HD2      ASN  67  12.981  -0.708   4.551
  491   2HD2  ASN  67          2HD2      ASN  67  12.983  -0.353   6.260
  492    H    LYS  68           H        LYS  68   8.950   0.658   1.548
  493    HA   LYS  68           HA       LYS  68   9.831   2.436  -0.393
  494   1HB   LYS  68          2HB       LYS  68   7.512   0.469  -0.445
  495   2HB   LYS  68          1HB       LYS  68   8.199   1.247  -1.906
  496   1HG   LYS  68          2HG       LYS  68  10.017  -0.373  -0.069
  497   2HG   LYS  68          1HG       LYS  68   8.877  -1.219  -1.134
  498   1HD   LYS  68          2HD       LYS  68   9.962  -0.166  -3.119
  499   2HD   LYS  68          1HD       LYS  68  11.049   0.773  -2.035
  500   1HE   LYS  68          2HE       LYS  68  11.961  -1.334  -1.060
  501   2HE   LYS  68          1HE       LYS  68  10.842  -2.315  -2.062
  502   1HZ   LYS  68          1HZ       LYS  68  12.001  -1.404  -4.064
  503   2HZ   LYS  68          2HZ       LYS  68  12.918  -2.332  -3.056
  504   3HZ   LYS  68          3HZ       LYS  68  13.151  -0.670  -3.038
  505    H    ILE  69           H        ILE  69   6.478   2.223   1.083
  506    HA   ILE  69           HA       ILE  69   5.511   4.448  -0.115
  507    HB   ILE  69           HB       ILE  69   4.998   3.138   2.557
  508   1HG1  ILE  69          2HG1      ILE  69   3.506   3.403  -0.115
  509   2HG1  ILE  69          1HG1      ILE  69   4.309   1.927   0.426
  510   1HG2  ILE  69          1HG2      ILE  69   4.381   5.463   2.956
  511   2HG2  ILE  69          2HG2      ILE  69   2.849   4.694   2.437
  512   3HG2  ILE  69          3HG2      ILE  69   3.786   5.673   1.271
  513   1HD1  ILE  69          1HD1      ILE  69   2.840   1.603   2.337
  514   2HD1  ILE  69          2HD1      ILE  69   1.941   1.632   0.773
  515   3HD1  ILE  69          3HD1      ILE  69   1.862   3.044   1.876
  516    H    LYS  70           H        LYS  70   7.366   4.411   2.987
  517    HA   LYS  70           HA       LYS  70   7.097   7.209   3.228
  518   1HB   LYS  70          2HB       LYS  70   8.474   4.995   4.685
  519   2HB   LYS  70          1HB       LYS  70   9.157   6.617   4.913
  520   1HG   LYS  70          2HG       LYS  70   7.649   6.205   6.673
  521   2HG   LYS  70          1HG       LYS  70   7.026   7.537   5.655
  522   1HD   LYS  70          2HD       LYS  70   5.401   5.964   4.590
  523   2HD   LYS  70          1HD       LYS  70   6.001   4.621   5.611
  524   1HE   LYS  70          2HE       LYS  70   4.624   7.211   6.611
  525   2HE   LYS  70          1HE       LYS  70   3.866   5.575   6.477
  526   1HZ   LYS  70          1HZ       LYS  70   4.576   5.989   8.718
  527   2HZ   LYS  70          2HZ       LYS  70   6.129   6.354   8.259
  528   3HZ   LYS  70          3HZ       LYS  70   5.567   4.776   8.051
  529    H    SER  71           H        SER  71   8.807   5.747   0.872
  530    HA   SER  71           HA       SER  71  11.240   7.278   1.144
  531   1HB   SER  71          2HB       SER  71  11.001   4.832   0.260
  532   2HB   SER  71          1HB       SER  71  10.359   5.554  -1.240
  533    HG   SER  71           HG       SER  71  12.550   5.228  -1.380
  534    H    ALA  72           H        ALA  72   8.142   7.636  -0.099
  535    HA   ALA  72           HA       ALA  72   8.902   9.469  -2.256
  536   1HB   ALA  72          1HB       ALA  72   7.551   7.403  -2.762
  537   2HB   ALA  72          2HB       ALA  72   6.566   8.885  -3.068
  538   3HB   ALA  72          3HB       ALA  72   6.341   7.922  -1.548
  539    H    SER  73           H        SER  73   8.122  11.575  -2.330
  540    HA   SER  73           HA       SER  73   5.766  12.128  -0.783
  541   1HB   SER  73          2HB       SER  73   6.481  14.127   0.330
  542   2HB   SER  73          1HB       SER  73   7.442  12.722   0.870
  543    HG   SER  73           HG       SER  73   8.888  14.278   0.509
  544    H    TYR  74           H        TYR  74   7.673  12.728  -3.604
  545    HA   TYR  74           HA       TYR  74   6.034  14.969  -4.332
  546   1HB   TYR  74          2HB       TYR  74   8.424  14.576  -5.154
  547   2HB   TYR  74          1HB       TYR  74   7.797  13.247  -6.171
  548    HD1  TYR  74           1HD      TYR  74   6.600  13.788  -8.172
  549    HD2  TYR  74           2HD      TYR  74   7.593  16.869  -5.423
  550    HE1  TYR  74           1HE      TYR  74   5.938  15.461  -9.822
  551    HE2  TYR  74           2HE      TYR  74   6.943  18.552  -7.065
  552    HH   TYR  74           HH       TYR  74   6.533  18.880  -9.302
  553    H    ASN  75           H        ASN  75   6.325  11.577  -5.475
  554    HA   ASN  75           HA       ASN  75   3.463  11.446  -5.492
  555   1HB   ASN  75          2HB       ASN  75   3.323  10.437  -7.818
  556   2HB   ASN  75          1HB       ASN  75   3.539  12.202  -7.691
  557   1HD2  ASN  75          1HD2      ASN  75   6.273   9.789  -7.442
  558   2HD2  ASN  75          2HD2      ASN  75   6.994  10.360  -8.936
  559    H    LEU  76           H        LEU  76   2.772   9.593  -4.661
  560    HA   LEU  76           HA       LEU  76   4.721   7.405  -4.499
  561   1HB   LEU  76          2HB       LEU  76   3.951   8.356  -2.370
  562   2HB   LEU  76          1HB       LEU  76   2.262   8.240  -2.881
  563    HG   LEU  76           HG       LEU  76   2.423   5.718  -2.866
  564   1HD1  LEU  76          1HD1      LEU  76   5.171   6.144  -1.539
  565   2HD1  LEU  76          2HD1      LEU  76   4.964   5.544  -3.239
  566   3HD1  LEU  76          3HD1      LEU  76   4.334   4.585  -1.850
  567   1HD2  LEU  76          1HD2      LEU  76   2.421   5.506  -0.404
  568   2HD2  LEU  76          2HD2      LEU  76   1.588   7.030  -0.902
  569   3HD2  LEU  76          3HD2      LEU  76   3.267   7.084  -0.245
  570    H    SER  77           H        SER  77   4.431   5.838  -5.994
  571    HA   SER  77           HA       SER  77   1.786   5.564  -7.205
  572   1HB   SER  77          2HB       SER  77   3.711   5.947  -8.682
  573   2HB   SER  77          1HB       SER  77   4.491   4.459  -8.069
  574    HG   SER  77           HG       SER  77   3.255   4.307 -10.082
  575    H    LEU  78           H        LEU  78   0.486   4.259  -5.939
  576    HA   LEU  78           HA       LEU  78   1.574   1.621  -5.267
  577   1HB   LEU  78          2HB       LEU  78  -1.126   2.712  -4.398
  578   2HB   LEU  78          1HB       LEU  78  -0.224   1.316  -3.765
  579    HG   LEU  78           HG       LEU  78  -0.088   2.901  -2.084
  580   1HD1  LEU  78          1HD1      LEU  78   2.223   3.522  -1.801
  581   2HD1  LEU  78          2HD1      LEU  78   2.560   3.388  -3.562
  582   3HD1  LEU  78          3HD1      LEU  78   2.154   1.910  -2.615
  583   1HD2  LEU  78          1HD2      LEU  78   0.266   5.233  -2.193
  584   2HD2  LEU  78          2HD2      LEU  78  -1.050   4.796  -3.341
  585   3HD2  LEU  78          3HD2      LEU  78   0.590   5.193  -3.970
  586    H    THR  79           H        THR  79   0.797  -0.202  -6.288
  587    HA   THR  79           HA       THR  79  -1.828   0.008  -7.561
  588    HB   THR  79           HB       THR  79   0.428  -1.856  -8.441
  589    HG1  THR  79           1HG      THR  79   0.789   0.296  -9.115
  590   1HG2  THR  79          1HG2      THR  79  -2.412  -1.194  -9.472
  591   2HG2  THR  79          2HG2      THR  79  -1.898  -2.742  -8.687
  592   3HG2  THR  79          3HG2      THR  79  -1.243  -2.307 -10.291
  593    H    LEU  80           H        LEU  80  -3.181  -1.128  -6.098
  594    HA   LEU  80           HA       LEU  80  -2.286  -3.784  -5.285
  595   1HB   LEU  80          2HB       LEU  80  -3.350  -3.548  -3.173
  596   2HB   LEU  80          1HB       LEU  80  -2.107  -2.244  -3.361
  597    HG   LEU  80           HG       LEU  80  -5.073  -1.964  -3.799
  598   1HD1  LEU  80          1HD1      LEU  80  -4.405  -2.506  -1.458
  599   2HD1  LEU  80          2HD1      LEU  80  -5.166  -0.836  -1.618
  600   3HD1  LEU  80          3HD1      LEU  80  -3.344  -1.017  -1.437
  601   1HD2  LEU  80          1HD2      LEU  80  -2.621  -0.157  -3.911
  602   2HD2  LEU  80          2HD2      LEU  80  -4.160   0.635  -3.317
  603   3HD2  LEU  80          3HD2      LEU  80  -4.090  -0.115  -4.979
  604    H    GLN  81           H        GLN  81  -4.260  -5.186  -4.781
  605    HA   GLN  81           HA       GLN  81  -5.895  -4.933  -7.070
  606   1HB   GLN  81          2HB       GLN  81  -5.991  -7.006  -4.875
  607   2HB   GLN  81          1HB       GLN  81  -6.825  -7.077  -6.466
  608   1HG   GLN  81          2HG       GLN  81  -4.671  -7.058  -7.674
  609   2HG   GLN  81          1HG       GLN  81  -3.772  -6.965  -6.120
  610   1HE2  GLN  81          1HE2      GLN  81  -2.848  -8.938  -5.776
  611   2HE2  GLN  81          2HE2      GLN  81  -3.653 -10.475  -5.989
  612    H    LYS  82           H        LYS  82  -8.228  -5.200  -7.133
  613    HA   LYS  82           HA       LYS  82  -9.634  -4.177  -4.773
  614   1HB   LYS  82          2HB       LYS  82 -10.546  -4.697  -7.667
  615   2HB   LYS  82          1HB       LYS  82 -11.596  -4.070  -6.372
  616   1HG   LYS  82          2HG       LYS  82  -9.248  -2.676  -7.735
  617   2HG   LYS  82          1HG       LYS  82 -10.972  -2.193  -7.706
  618   1HD   LYS  82          2HD       LYS  82  -8.974  -2.197  -5.392
  619   2HD   LYS  82          1HD       LYS  82  -9.598  -0.754  -6.242
  620   1HE   LYS  82          2HE       LYS  82 -11.817  -0.966  -5.280
  621   2HE   LYS  82          1HE       LYS  82 -11.482  -2.622  -4.641
  622   1HZ   LYS  82          1HZ       LYS  82 -10.304  -1.883  -2.983
  623   2HZ   LYS  82          2HZ       LYS  82 -11.182  -0.487  -3.123
  624   3HZ   LYS  82          3HZ       LYS  82  -9.599  -0.574  -3.776
  625    H    SER  83           H        SER  83  -9.670  -5.900  -3.346
  626    HA   SER  83           HA       SER  83 -11.056  -8.284  -4.309
  627   1HB   SER  83          2HB       SER  83  -9.458  -7.861  -1.740
  628   2HB   SER  83          1HB       SER  83 -10.088  -9.418  -2.396
  629    HG   SER  83           HG       SER  83  -7.937  -7.848  -3.162
  630    H    LYS  84           H        LYS  84 -12.167  -5.500  -3.147
  631    HA   LYS  84           HA       LYS  84 -13.359  -6.420  -0.703
  632   1HB   LYS  84          2HB       LYS  84 -12.434  -4.091  -1.138
  633   2HB   LYS  84          1HB       LYS  84 -13.848  -3.788  -2.180
  634   1HG   LYS  84          2HG       LYS  84 -15.357  -4.220  -0.156
  635   2HG   LYS  84          1HG       LYS  84 -13.879  -4.555   0.796
  636   1HD   LYS  84          2HD       LYS  84 -13.156  -2.124  -0.063
  637   2HD   LYS  84          1HD       LYS  84 -14.899  -1.933  -0.405
  638   1HE   LYS  84          2HE       LYS  84 -14.455  -0.971   1.787
  639   2HE   LYS  84          1HE       LYS  84 -15.358  -2.504   2.085
  640   1HZ   LYS  84          1HZ       LYS  84 -13.322  -3.571   2.701
  641   2HZ   LYS  84          2HZ       LYS  84 -13.348  -2.067   3.478
  642   3HZ   LYS  84          3HZ       LYS  84 -12.392  -2.295   2.100
  643    H    ARG  85           H        ARG  85 -15.526  -6.756  -0.230
  644    HA   ARG  85           HA       ARG  85 -17.463  -6.089  -2.289
  645   1HB   ARG  85          2HB       ARG  85 -17.175  -8.571  -2.333
  646   2HB   ARG  85          1HB       ARG  85 -17.490  -8.627  -0.573
  647   1HG   ARG  85          2HG       ARG  85 -19.768  -7.719  -0.909
  648   2HG   ARG  85          1HG       ARG  85 -19.485  -7.507  -2.657
  649   1HD   ARG  85          2HD       ARG  85 -19.454 -10.220  -1.165
  650   2HD   ARG  85          1HD       ARG  85 -20.890  -9.545  -2.042
  651    HE   ARG  85           HE       ARG  85 -18.892  -9.406  -3.970
  652   1HH1  ARG  85          1HH1      ARG  85 -20.312 -12.075  -2.070
  653   2HH1  ARG  85          2HH1      ARG  85 -19.723 -13.297  -3.128
  654   1HH2  ARG  85          1HH2      ARG  85 -18.263 -11.037  -5.419
  655   2HH2  ARG  85          2HH2      ARG  85 -18.586 -12.717  -5.035
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1  -9.155  -5.395 -13.589
    2   2H    MET   1          2HT       MET   1  -7.994  -4.335 -12.969
    3   3H    MET   1          3HT       MET   1  -9.493  -4.553 -12.207
    4    HA   MET   1           HA       MET   1  -8.982  -6.798 -11.658
    5   1HB   MET   1          2HB       MET   1  -6.228  -6.129 -12.862
    6   2HB   MET   1          1HB       MET   1  -6.607  -7.619 -11.963
    7   1HG   MET   1          2HG       MET   1  -7.956  -6.782 -14.594
    8   2HG   MET   1          1HG       MET   1  -6.558  -7.857 -14.452
    9   1HE   MET   1          1HE       MET   1  -7.640 -11.208 -13.606
   10   2HE   MET   1          2HE       MET   1  -6.453  -9.971 -13.090
   11   3HE   MET   1          3HE       MET   1  -6.813 -10.189 -14.831
   12    H    ALA   2           H        ALA   2  -6.401  -4.309 -11.446
   13    HA   ALA   2           HA       ALA   2  -6.700  -4.270  -8.533
   14   1HB   ALA   2          1HB       ALA   2  -4.405  -4.927  -9.225
   15   2HB   ALA   2          2HB       ALA   2  -4.330  -3.216  -8.678
   16   3HB   ALA   2          3HB       ALA   2  -4.358  -3.585 -10.431
   17    H    TYR   3           H        TYR   3  -5.723  -1.841  -7.965
   18    HA   TYR   3           HA       TYR   3  -6.724   0.003  -9.955
   19   1HB   TYR   3          2HB       TYR   3  -7.911   1.434  -8.624
   20   2HB   TYR   3          1HB       TYR   3  -8.545  -0.180  -8.159
   21    HD1  TYR   3           1HD      TYR   3  -7.299   2.867  -7.151
   22    HD2  TYR   3           2HD      TYR   3  -7.213  -1.221  -6.003
   23    HE1  TYR   3           1HE      TYR   3  -6.773   3.530  -4.833
   24    HE2  TYR   3           2HE      TYR   3  -6.817  -0.572  -3.684
   25    HH   TYR   3           HH       TYR   3  -6.541   1.174  -2.241
   26    H    SER   4           H        SER   4  -5.677   2.182  -9.695
   27    HA   SER   4           HA       SER   4  -3.284   2.040  -8.094
   28   1HB   SER   4          2HB       SER   4  -1.740   2.675  -9.867
   29   2HB   SER   4          1HB       SER   4  -2.472   1.073 -10.168
   30    HG   SER   4           HG       SER   4  -2.321   2.757 -11.914
   31    H    VAL   5           H        VAL   5  -2.481   4.000  -7.458
   32    HA   VAL   5           HA       VAL   5  -3.600   6.403  -8.562
   33    HB   VAL   5           HB       VAL   5  -5.359   6.133  -7.129
   34   1HG1  VAL   5          1HG1      VAL   5  -5.210   5.377  -4.801
   35   2HG1  VAL   5          2HG1      VAL   5  -3.471   4.916  -5.058
   36   3HG1  VAL   5          3HG1      VAL   5  -4.799   4.111  -6.000
   37   1HG2  VAL   5          1HG2      VAL   5  -5.123   7.760  -5.337
   38   2HG2  VAL   5          2HG2      VAL   5  -4.211   8.355  -6.774
   39   3HG2  VAL   5          3HG2      VAL   5  -3.336   7.644  -5.365
   40    H    THR   6           H        THR   6  -2.284   8.096  -8.405
   41    HA   THR   6           HA       THR   6   0.246   7.689  -6.996
   42    HB   THR   6           HB       THR   6  -0.523   9.885  -8.927
   43    HG1  THR   6           1HG      THR   6  -0.198   7.977  -9.973
   44   1HG2  THR   6          1HG2      THR   6   1.238  10.590  -7.199
   45   2HG2  THR   6          2HG2      THR   6   1.935  10.396  -8.828
   46   3HG2  THR   6          3HG2      THR   6   2.186   9.107  -7.606
   47    H    LEU   7           H        LEU   7   0.339   8.474  -4.959
   48    HA   LEU   7           HA       LEU   7  -1.584  10.510  -4.163
   49   1HB   LEU   7          2HB       LEU   7  -1.340   8.261  -2.983
   50   2HB   LEU   7          1HB       LEU   7   0.302   8.765  -2.501
   51    HG   LEU   7           HG       LEU   7  -0.719  10.717  -1.240
   52   1HD1  LEU   7          1HD1      LEU   7  -3.182  10.643  -0.733
   53   2HD1  LEU   7          2HD1      LEU   7  -3.394   9.330  -1.951
   54   3HD1  LEU   7          3HD1      LEU   7  -2.886  10.984  -2.470
   55   1HD2  LEU   7          1HD2      LEU   7  -1.660   9.264   0.611
   56   2HD2  LEU   7          2HD2      LEU   7  -0.113   8.642  -0.076
   57   3HD2  LEU   7          3HD2      LEU   7  -1.672   7.867  -0.537
   58    H    THR   8           H        THR   8  -0.942  12.474  -3.193
   59    HA   THR   8           HA       THR   8   1.919  13.020  -3.220
   60    HB   THR   8           HB       THR   8   0.733  13.958  -5.227
   61    HG1  THR   8           1HG      THR   8   2.568  14.826  -4.762
   62   1HG2  THR   8          1HG2      THR   8  -0.442  15.937  -3.154
   63   2HG2  THR   8          2HG2      THR   8  -1.392  14.683  -4.048
   64   3HG2  THR   8          3HG2      THR   8  -0.576  16.011  -4.942
   65    H    GLY   9           H        GLY   9   2.565  14.721  -1.796
   66   1HA   GLY   9          2HA       GLY   9   1.986  16.493  -0.405
   67   2HA   GLY   9          1HA       GLY   9   0.495  15.654   0.050
   68    HA   PRO  10           HA       PRO  10   4.001  13.355   2.082
   69   1HB   PRO  10          2HB       PRO  10   6.059  14.966   3.268
   70   2HB   PRO  10          1HB       PRO  10   6.140  14.049   1.739
   71   1HG   PRO  10          2HG       PRO  10   5.402  16.999   2.188
   72   2HG   PRO  10          1HG       PRO  10   6.491  16.312   0.908
   73   1HD   PRO  10          2HD       PRO  10   3.891  16.993   0.361
   74   2HD   PRO  10          1HD       PRO  10   4.568  15.447  -0.334
   75    H    GLY  11           H        GLY  11   3.816  12.466   4.032
   76   1HA   GLY  11          2HA       GLY  11   4.128  13.441   6.447
   77   2HA   GLY  11          1HA       GLY  11   2.402  13.872   6.060
   78    HA   PRO  12           HA       PRO  12   2.402   9.440   7.230
   79   1HB   PRO  12          2HB       PRO  12   0.294  10.672   9.082
   80   2HB   PRO  12          1HB       PRO  12   1.308   9.201   9.376
   81   1HG   PRO  12          2HG       PRO  12   2.034  11.570  10.530
   82   2HG   PRO  12          1HG       PRO  12   3.311  10.601   9.676
   83   1HD   PRO  12          2HD       PRO  12   1.708  12.992   8.569
   84   2HD   PRO  12          1HD       PRO  12   3.508  12.685   8.513
   85    H    TRP  13           H        TRP  13   1.211   8.203   5.894
   86    HA   TRP  13           HA       TRP  13  -0.905   9.482   4.448
   87   1HB   TRP  13          2HB       TRP  13   0.196   6.642   4.168
   88   2HB   TRP  13          1HB       TRP  13  -0.897   7.387   3.057
   89    HD1  TRP  13           HD       TRP  13   2.444   6.430   3.318
   90    HE1  TRP  13           1HE      TRP  13   4.191   7.929   2.109
   91    HE3  TRP  13           3HE      TRP  13  -0.442  10.504   2.399
   92    HZ2  TRP  13           2HZ      TRP  13   4.151  10.202   0.545
   93    HZ3  TRP  13           3HZ      TRP  13   0.452  12.264   0.957
   94    HH2  TRP  13           HH       TRP  13   2.735  12.155   0.084
   95    H    GLY  14           H        GLY  14  -0.658   6.941   6.873
   96   1HA   GLY  14          2HA       GLY  14  -2.185   6.699   8.493
   97   2HA   GLY  14          1HA       GLY  14  -3.450   7.425   7.464
   98    H    PHE  15           H        PHE  15  -1.378   4.583   6.954
   99    HA   PHE  15           HA       PHE  15  -3.782   2.882   7.004
  100   1HB   PHE  15          2HB       PHE  15  -2.860   1.719   4.989
  101   2HB   PHE  15          1HB       PHE  15  -3.045   3.445   4.677
  102    HD1  PHE  15           1HD      PHE  15  -0.999   4.936   4.847
  103    HD2  PHE  15           2HD      PHE  15  -0.738   0.702   5.019
  104    HE1  PHE  15           1HE      PHE  15   1.459   5.067   4.687
  105    HE2  PHE  15           2HE      PHE  15   1.662   0.831   4.566
  106    HZ   PHE  15           HZ       PHE  15   2.783   3.013   4.548
  107    H    ARG  16           H        ARG  16  -3.675   0.692   7.478
  108    HA   ARG  16           HA       ARG  16  -1.706   0.234   9.521
  109   1HB   ARG  16          2HB       ARG  16  -4.400  -1.052   8.753
  110   2HB   ARG  16          1HB       ARG  16  -3.432  -1.610  10.138
  111   1HG   ARG  16          2HG       ARG  16  -4.637   1.254   9.848
  112   2HG   ARG  16          1HG       ARG  16  -5.487  -0.145  10.540
  113   1HD   ARG  16          2HD       ARG  16  -4.675   0.865  12.493
  114   2HD   ARG  16          1HD       ARG  16  -3.500  -0.473  12.100
  115    HE   ARG  16           HE       ARG  16  -2.989   2.412  11.258
  116   1HH1  ARG  16          1HH1      ARG  16  -1.916  -0.430  13.220
  117   2HH1  ARG  16          2HH1      ARG  16  -0.634   0.477  13.910
  118   1HH2  ARG  16          1HH2      ARG  16  -1.225   3.445  12.106
  119   2HH2  ARG  16          2HH2      ARG  16  -0.069   2.601  13.098
  120    H    LEU  17           H        LEU  17  -0.234  -1.606   9.220
  121    HA   LEU  17           HA       LEU  17  -0.832  -3.162   6.807
  122   1HB   LEU  17          2HB       LEU  17   1.897  -2.780   8.103
  123   2HB   LEU  17          1HB       LEU  17   1.512  -3.782   6.673
  124    HG   LEU  17           HG       LEU  17   0.556  -1.515   5.662
  125   1HD1  LEU  17          1HD1      LEU  17   2.181   0.393   6.586
  126   2HD1  LEU  17          2HD1      LEU  17   2.331  -0.684   8.025
  127   3HD1  LEU  17          3HD1      LEU  17   0.709  -0.060   7.533
  128   1HD2  LEU  17          1HD2      LEU  17   2.387  -2.831   4.687
  129   2HD2  LEU  17          2HD2      LEU  17   3.528  -2.265   5.961
  130   3HD2  LEU  17          3HD2      LEU  17   2.884  -1.101   4.736
  131    H    GLN  18           H        GLN  18  -1.165  -5.394   7.034
  132    HA   GLN  18           HA       GLN  18   0.260  -6.686   9.226
  133   1HB   GLN  18          2HB       GLN  18  -2.692  -7.164   8.648
  134   2HB   GLN  18          1HB       GLN  18  -1.680  -8.136   9.746
  135   1HG   GLN  18          2HG       GLN  18  -1.338  -6.212  11.271
  136   2HG   GLN  18          1HG       GLN  18  -2.274  -5.132  10.195
  137   1HE2  GLN  18          1HE2      GLN  18  -2.544  -7.771  12.570
  138   2HE2  GLN  18          2HE2      GLN  18  -4.271  -7.621  12.726
  139    H    GLY  19           H        GLY  19   0.527  -8.970   8.950
  140   1HA   GLY  19          2HA       GLY  19   0.990 -10.778   7.781
  141   2HA   GLY  19          1HA       GLY  19   0.005 -10.160   6.415
  142    H    GLY  20           H        GLY  20   1.247 -10.332   4.621
  143   1HA   GLY  20          2HA       GLY  20   2.711  -9.336   3.265
  144   2HA   GLY  20          1HA       GLY  20   3.739  -8.834   4.627
  145    H    LYS  21           H        LYS  21   5.341  -9.613   2.919
  146    HA   LYS  21           HA       LYS  21   5.107 -12.206   2.041
  147   1HB   LYS  21          2HB       LYS  21   6.439  -9.991   1.179
  148   2HB   LYS  21          1HB       LYS  21   7.816 -10.966   1.763
  149   1HG   LYS  21          2HG       LYS  21   7.500 -11.562  -0.543
  150   2HG   LYS  21          1HG       LYS  21   6.793 -12.916   0.374
  151   1HD   LYS  21          2HD       LYS  21   4.544 -11.295   0.102
  152   2HD   LYS  21          1HD       LYS  21   5.502 -10.725  -1.282
  153   1HE   LYS  21          2HE       LYS  21   4.027 -12.412  -2.115
  154   2HE   LYS  21          1HE       LYS  21   5.658 -13.196  -2.076
  155   1HZ   LYS  21          1HZ       LYS  21   5.010 -14.396  -0.129
  156   2HZ   LYS  21          2HZ       LYS  21   3.685 -14.483  -1.175
  157   3HZ   LYS  21          3HZ       LYS  21   3.635 -13.431   0.108
  158    H    ASP  22           H        ASP  22   7.206 -11.113   4.759
  159    HA   ASP  22           HA       ASP  22   8.440 -13.658   4.851
  160   1HB   ASP  22          2HB       ASP  22   9.639 -12.770   6.749
  161   2HB   ASP  22          1HB       ASP  22   9.625 -11.600   5.398
  162    H    PHE  23           H        PHE  23   5.404 -12.553   5.870
  163    HA   PHE  23           HA       PHE  23   5.057 -14.609   7.877
  164   1HB   PHE  23          2HB       PHE  23   3.290 -12.443   6.599
  165   2HB   PHE  23          1HB       PHE  23   2.622 -13.696   7.676
  166    HD1  PHE  23           1HD      PHE  23   2.395 -13.227   9.845
  167    HD2  PHE  23           2HD      PHE  23   5.320 -11.066   7.648
  168    HE1  PHE  23           1HE      PHE  23   2.709 -11.722  11.745
  169    HE2  PHE  23           2HE      PHE  23   5.644  -9.573   9.540
  170    HZ   PHE  23           HZ       PHE  23   4.320  -9.866  11.588
  171    H    ASN  24           H        ASN  24   5.246 -14.521   4.584
  172    HA   ASN  24           HA       ASN  24   4.602 -15.627   2.924
  173   1HB   ASN  24          2HB       ASN  24   5.363 -17.541   4.374
  174   2HB   ASN  24          1HB       ASN  24   3.642 -17.866   4.749
  175   1HD2  ASN  24          1HD2      ASN  24   5.298 -16.966   1.575
  176   2HD2  ASN  24          2HD2      ASN  24   4.780 -18.413   0.772
  177    H    MET  25           H        MET  25   2.998 -13.657   3.537
  178    HA   MET  25           HA       MET  25   0.376 -14.573   2.621
  179   1HB   MET  25          2HB       MET  25   1.422 -12.512   4.545
  180   2HB   MET  25          1HB       MET  25  -0.045 -12.038   3.709
  181   1HG   MET  25          2HG       MET  25   0.350 -14.563   5.440
  182   2HG   MET  25          1HG       MET  25  -0.489 -13.067   5.932
  183   1HE   MET  25          1HE       MET  25  -2.510 -14.339   6.767
  184   2HE   MET  25          2HE       MET  25  -1.602 -15.828   6.362
  185   3HE   MET  25          3HE       MET  25  -3.325 -15.662   5.870
  186    HA   PRO  26           HA       PRO  26   1.218 -11.585  -0.658
  187   1HB   PRO  26          2HB       PRO  26  -1.373 -10.203  -0.633
  188   2HB   PRO  26          1HB       PRO  26  -0.843 -11.532  -1.686
  189   1HG   PRO  26          2HG       PRO  26  -2.810 -11.649   0.450
  190   2HG   PRO  26          1HG       PRO  26  -2.240 -12.960  -0.627
  191   1HD   PRO  26          2HD       PRO  26  -1.368 -12.075   2.158
  192   2HD   PRO  26          1HD       PRO  26  -1.283 -13.774   1.553
  193    H    LEU  27           H        LEU  27   1.696  -9.118  -0.763
  194    HA   LEU  27           HA       LEU  27   2.023  -8.082   1.838
  195   1HB   LEU  27          2HB       LEU  27   3.279  -7.726  -0.462
  196   2HB   LEU  27          1HB       LEU  27   2.141  -6.370  -0.674
  197    HG   LEU  27           HG       LEU  27   3.822  -6.954   1.812
  198   1HD1  LEU  27          1HD1      LEU  27   4.543  -4.998  -0.460
  199   2HD1  LEU  27          2HD1      LEU  27   5.275  -6.631  -0.197
  200   3HD1  LEU  27          3HD1      LEU  27   5.524  -5.333   1.024
  201   1HD2  LEU  27          1HD2      LEU  27   3.540  -4.447   2.325
  202   2HD2  LEU  27          2HD2      LEU  27   1.981  -5.347   2.348
  203   3HD2  LEU  27          3HD2      LEU  27   2.421  -4.334   0.919
  204    H    THR  28           H        THR  28   0.268  -7.672   3.050
  205    HA   THR  28           HA       THR  28  -2.050  -6.530   1.635
  206    HB   THR  28           HB       THR  28  -3.556  -7.501   2.725
  207    HG1  THR  28           1HG      THR  28  -1.794  -7.659   4.926
  208   1HG2  THR  28          1HG2      THR  28  -1.310  -9.544   3.231
  209   2HG2  THR  28          2HG2      THR  28  -1.786  -8.988   1.579
  210   3HG2  THR  28          3HG2      THR  28  -3.003  -9.833   2.638
  211    H    ILE  29           H        ILE  29  -2.927  -4.735   2.204
  212    HA   ILE  29           HA       ILE  29  -1.969  -3.423   4.700
  213    HB   ILE  29           HB       ILE  29  -3.012  -2.132   2.198
  214   1HG1  ILE  29          2HG1      ILE  29  -0.332  -2.414   3.671
  215   2HG1  ILE  29          1HG1      ILE  29  -0.703  -2.921   2.001
  216   1HG2  ILE  29          1HG2      ILE  29  -2.140  -0.935   4.921
  217   2HG2  ILE  29          2HG2      ILE  29  -3.866  -1.058   4.381
  218   3HG2  ILE  29          3HG2      ILE  29  -2.738  -0.025   3.486
  219   1HD1  ILE  29          1HD1      ILE  29  -0.844  -0.599   1.244
  220   2HD1  ILE  29          2HD1      ILE  29   0.709  -0.846   2.126
  221   3HD1  ILE  29          3HD1      ILE  29  -0.656   0.006   2.943
  222    H    SER  30           H        SER  30  -3.532  -2.874   6.195
  223    HA   SER  30           HA       SER  30  -5.572  -4.922   6.056
  224   1HB   SER  30          2HB       SER  30  -4.735  -3.253   8.479
  225   2HB   SER  30          1HB       SER  30  -5.745  -4.755   8.459
  226    HG   SER  30           HG       SER  30  -3.795  -5.447   8.864
  227    H    ARG  31           H        ARG  31  -5.481  -1.460   7.061
  228    HA   ARG  31           HA       ARG  31  -7.913  -0.945   5.834
  229   1HB   ARG  31          2HB       ARG  31  -9.366  -0.436   7.723
  230   2HB   ARG  31          1HB       ARG  31  -8.916  -2.154   7.719
  231   1HG   ARG  31          2HG       ARG  31  -7.158  -1.639   9.504
  232   2HG   ARG  31          1HG       ARG  31  -7.856   0.024   9.594
  233   1HD   ARG  31          2HD       ARG  31 -10.133  -1.050  10.093
  234   2HD   ARG  31          1HD       ARG  31  -9.300  -2.657  10.104
  235    HE   ARG  31           HE       ARG  31  -8.169  -0.542  11.926
  236   1HH1  ARG  31          1HH1      ARG  31 -10.317  -3.426  11.746
  237   2HH1  ARG  31          2HH1      ARG  31 -10.049  -3.722  13.434
  238   1HH2  ARG  31          1HH2      ARG  31  -8.233  -0.821  14.069
  239   2HH2  ARG  31          2HH2      ARG  31  -9.271  -2.009  14.819
  240    H    ILE  32           H        ILE  32  -8.673   1.336   6.541
  241    HA   ILE  32           HA       ILE  32  -6.310   3.014   6.520
  242    HB   ILE  32           HB       ILE  32  -9.234   3.331   5.860
  243   1HG1  ILE  32          2HG1      ILE  32  -8.506   4.154   3.727
  244   2HG1  ILE  32          1HG1      ILE  32  -6.793   4.105   4.134
  245   1HG2  ILE  32          1HG2      ILE  32  -7.119   5.555   6.141
  246   2HG2  ILE  32          2HG2      ILE  32  -8.700   5.427   7.033
  247   3HG2  ILE  32          3HG2      ILE  32  -8.691   5.710   5.269
  248   1HD1  ILE  32          1HD1      ILE  32  -6.932   1.552   4.202
  249   2HD1  ILE  32          2HD1      ILE  32  -7.417   2.246   2.633
  250   3HD1  ILE  32          3HD1      ILE  32  -8.701   1.691   3.781
  251    H    THR  33           H        THR  33  -5.885   4.561   8.091
  252    HA   THR  33           HA       THR  33  -7.385   4.420  10.546
  253    HB   THR  33           HB       THR  33  -4.966   6.032   9.692
  254    HG1  THR  33           1HG      THR  33  -5.412   4.029  11.636
  255   1HG2  THR  33          1HG2      THR  33  -4.842   6.791  12.083
  256   2HG2  THR  33          2HG2      THR  33  -6.428   5.990  12.424
  257   3HG2  THR  33          3HG2      THR  33  -6.357   7.386  11.318
  258    HA   PRO  34           HA       PRO  34  -9.838   7.627   8.858
  259   1HB   PRO  34          2HB       PRO  34 -11.258   8.552  11.048
  260   2HB   PRO  34          1HB       PRO  34 -11.339   6.823  10.434
  261   1HG   PRO  34          2HG       PRO  34  -9.490   7.724  12.692
  262   2HG   PRO  34          1HG       PRO  34 -10.841   6.499  12.772
  263   1HD   PRO  34          2HD       PRO  34  -8.353   5.646  12.137
  264   2HD   PRO  34          1HD       PRO  34  -9.737   5.057  11.125
  265    H    GLY  35           H        GLY  35 -10.119   9.799   8.530
  266   1HA   GLY  35          2HA       GLY  35  -9.826  12.000   8.891
  267   2HA   GLY  35          1HA       GLY  35  -8.542  11.676  10.096
  268    H    SER  36           H        SER  36  -7.291   9.809   8.049
  269    HA   SER  36           HA       SER  36  -5.581  11.920   7.036
  270   1HB   SER  36          2HB       SER  36  -5.233   8.943   7.545
  271   2HB   SER  36          1HB       SER  36  -3.965   9.947   6.730
  272    HG   SER  36           HG       SER  36  -3.870   9.754   9.096
  273    H    LYS  37           H        LYS  37  -4.296  11.311   4.951
  274    HA   LYS  37           HA       LYS  37  -6.036  11.626   2.872
  275   1HB   LYS  37          2HB       LYS  37  -3.100  10.844   2.970
  276   2HB   LYS  37          1HB       LYS  37  -3.975  11.059   1.425
  277   1HG   LYS  37          2HG       LYS  37  -4.586  13.413   2.115
  278   2HG   LYS  37          1HG       LYS  37  -3.578  13.198   3.583
  279   1HD   LYS  37          2HD       LYS  37  -1.626  12.597   2.068
  280   2HD   LYS  37          1HD       LYS  37  -2.622  13.018   0.649
  281   1HE   LYS  37          2HE       LYS  37  -1.757  14.946   2.923
  282   2HE   LYS  37          1HE       LYS  37  -1.027  14.811   1.274
  283   1HZ   LYS  37          1HZ       LYS  37  -2.441  16.539   1.040
  284   2HZ   LYS  37          2HZ       LYS  37  -3.594  15.967   2.090
  285   3HZ   LYS  37          3HZ       LYS  37  -3.463  15.287   0.527
  286    H    ALA  38           H        ALA  38  -4.635   8.634   4.067
  287    HA   ALA  38           HA       ALA  38  -5.410   6.823   2.147
  288   1HB   ALA  38          1HB       ALA  38  -5.379   6.535   5.186
  289   2HB   ALA  38          2HB       ALA  38  -3.940   6.429   4.107
  290   3HB   ALA  38          3HB       ALA  38  -5.223   5.207   3.956
  291    H    ALA  39           H        ALA  39  -7.521   8.520   4.426
  292    HA   ALA  39           HA       ALA  39  -9.734   6.865   3.565
  293   1HB   ALA  39          1HB       ALA  39  -9.550   7.539   5.996
  294   2HB   ALA  39          2HB       ALA  39 -11.023   8.240   5.247
  295   3HB   ALA  39          3HB       ALA  39  -9.548   9.262   5.515
  296    H    GLN  40           H        GLN  40  -8.677  10.255   3.485
  297    HA   GLN  40           HA       GLN  40 -10.916  11.358   2.397
  298   1HB   GLN  40          2HB       GLN  40  -7.978  12.204   2.195
  299   2HB   GLN  40          1HB       GLN  40  -9.327  13.227   1.667
  300   1HG   GLN  40          2HG       GLN  40 -10.289  12.925   4.094
  301   2HG   GLN  40          1HG       GLN  40  -8.652  12.340   4.538
  302   1HE2  GLN  40          1HE2      GLN  40 -10.569  15.077   3.349
  303   2HE2  GLN  40          2HE2      GLN  40  -9.410  16.317   3.746
  304    H    SER  41           H        SER  41  -8.154  10.068   0.549
  305    HA   SER  41           HA       SER  41  -9.129  11.649  -1.711
  306   1HB   SER  41          2HB       SER  41  -6.857  11.936  -0.818
  307   2HB   SER  41          1HB       SER  41  -6.445  10.264  -1.310
  308    HG   SER  41           HG       SER  41  -7.318  12.399  -2.998
  309    H    GLN  42           H        GLN  42  -7.627   9.983  -3.670
  310    HA   GLN  42           HA       GLN  42  -9.719   8.074  -4.240
  311   1HB   GLN  42          2HB       GLN  42  -7.123   8.789  -5.703
  312   2HB   GLN  42          1HB       GLN  42  -8.327   7.588  -6.267
  313   1HG   GLN  42          2HG       GLN  42 -10.081   9.401  -6.346
  314   2HG   GLN  42          1HG       GLN  42  -8.820  10.615  -5.935
  315   1HE2  GLN  42          1HE2      GLN  42  -7.533  11.382  -7.642
  316   2HE2  GLN  42          2HE2      GLN  42  -7.608  10.750  -9.277
  317    H    LEU  43           H        LEU  43  -7.096   8.139  -2.243
  318    HA   LEU  43           HA       LEU  43  -6.126   5.495  -2.674
  319   1HB   LEU  43          2HB       LEU  43  -5.025   7.605  -1.424
  320   2HB   LEU  43          1HB       LEU  43  -5.874   6.939  -0.010
  321    HG   LEU  43           HG       LEU  43  -4.723   4.646  -0.796
  322   1HD1  LEU  43          1HD1      LEU  43  -2.856   6.712  -2.125
  323   2HD1  LEU  43          2HD1      LEU  43  -3.963   5.621  -3.019
  324   3HD1  LEU  43          3HD1      LEU  43  -2.629   4.922  -2.032
  325   1HD2  LEU  43          1HD2      LEU  43  -2.516   5.336   0.402
  326   2HD2  LEU  43          2HD2      LEU  43  -4.022   5.483   1.339
  327   3HD2  LEU  43          3HD2      LEU  43  -3.267   6.958   0.612
  328    H    SER  44           H        SER  44  -6.857   3.605  -1.892
  329    HA   SER  44           HA       SER  44  -8.321   3.645   0.633
  330   1HB   SER  44          2HB       SER  44  -9.055   1.857  -1.781
  331   2HB   SER  44          1HB       SER  44  -9.742   1.755  -0.119
  332    HG   SER  44           HG       SER  44 -10.087   3.700  -2.116
  333    H    GLN  45           H        GLN  45  -5.713   3.368   0.974
  334    HA   GLN  45           HA       GLN  45  -4.588   1.096  -0.155
  335   1HB   GLN  45          2HB       GLN  45  -3.451   3.201   0.266
  336   2HB   GLN  45          1HB       GLN  45  -3.899   3.142   2.030
  337   1HG   GLN  45          2HG       GLN  45  -2.298   1.683   2.576
  338   2HG   GLN  45          1HG       GLN  45  -2.531   0.762   1.046
  339   1HE2  GLN  45          2HE2      GLN  45  -1.231   3.990   2.153
  340   2HE2  GLN  45          1HE2      GLN  45   0.267   3.905   1.269
  341    H    GLY  46           H        GLY  46  -5.256  -0.897   0.429
  342   1HA   GLY  46          2HA       GLY  46  -5.190  -1.985   2.966
  343   2HA   GLY  46          1HA       GLY  46  -6.789  -1.202   2.734
  344    H    ASP  47           H        ASP  47  -4.529  -3.245   0.748
  345    HA   ASP  47           HA       ASP  47  -6.397  -5.295   0.585
  346   1HB   ASP  47          2HB       ASP  47  -6.998  -3.175  -1.125
  347   2HB   ASP  47          1HB       ASP  47  -5.971  -4.121  -2.219
  348    H    LEU  48           H        LEU  48  -5.287  -6.521  -1.887
  349    HA   LEU  48           HA       LEU  48  -2.724  -7.188  -0.782
  350   1HB   LEU  48          2HB       LEU  48  -4.104  -8.270  -3.277
  351   2HB   LEU  48          1HB       LEU  48  -2.573  -8.826  -2.565
  352    HG   LEU  48           HG       LEU  48  -3.947 -10.442  -1.768
  353   1HD1  LEU  48          1HD1      LEU  48  -4.631 -10.133   0.585
  354   2HD1  LEU  48          2HD1      LEU  48  -4.454  -8.337   0.453
  355   3HD1  LEU  48          3HD1      LEU  48  -3.008  -9.413   0.232
  356   1HD2  LEU  48          1HD2      LEU  48  -6.023  -9.437  -2.806
  357   2HD2  LEU  48          2HD2      LEU  48  -6.092  -8.277  -1.396
  358   3HD2  LEU  48          3HD2      LEU  48  -6.338 -10.062  -1.102
  359    H    VAL  49           H        VAL  49  -0.995  -5.951  -1.281
  360    HA   VAL  49           HA       VAL  49  -1.172  -4.129  -3.426
  361    HB   VAL  49           HB       VAL  49   1.050  -4.737  -1.457
  362   1HG1  VAL  49          1HG1      VAL  49   1.559  -2.285  -1.955
  363   2HG1  VAL  49          2HG1      VAL  49   0.447  -2.371  -3.366
  364   3HG1  VAL  49          3HG1      VAL  49   1.947  -3.405  -3.326
  365   1HG2  VAL  49          1HG2      VAL  49  -1.317  -2.743  -1.386
  366   2HG2  VAL  49          2HG2      VAL  49   0.076  -2.745  -0.259
  367   3HG2  VAL  49          3HG2      VAL  49  -1.059  -4.132  -0.264
  368    H    VAL  50           H        VAL  50  -0.027  -4.090  -5.401
  369    HA   VAL  50           HA       VAL  50   1.409  -6.526  -6.079
  370    HB   VAL  50           HB       VAL  50   0.569  -4.400  -8.081
  371   1HG1  VAL  50          1HG1      VAL  50   2.288  -6.146  -8.719
  372   2HG1  VAL  50          2HG1      VAL  50   0.718  -6.393  -9.565
  373   3HG1  VAL  50          3HG1      VAL  50   1.155  -7.436  -8.163
  374   1HG2  VAL  50          1HG2      VAL  50  -1.493  -4.883  -7.013
  375   2HG2  VAL  50          2HG2      VAL  50  -1.121  -6.667  -6.923
  376   3HG2  VAL  50          3HG2      VAL  50  -1.409  -5.854  -8.520
  377    H    ALA  51           H        ALA  51   1.591  -3.117  -7.080
  378    HA   ALA  51           HA       ALA  51   4.511  -3.255  -6.833
  379   1HB   ALA  51          1HB       ALA  51   4.635  -1.880  -8.937
  380   2HB   ALA  51          2HB       ALA  51   2.839  -1.901  -9.042
  381   3HB   ALA  51          3HB       ALA  51   3.772  -3.426  -9.235
  382    H    ILE  52           H        ILE  52   5.622  -1.391  -6.326
  383    HA   ILE  52           HA       ILE  52   4.020   0.986  -5.695
  384    HB   ILE  52           HB       ILE  52   5.173  -0.324  -3.794
  385   1HG1  ILE  52          2HG1      ILE  52   5.587   2.726  -4.166
  386   2HG1  ILE  52          1HG1      ILE  52   4.022   1.946  -3.768
  387   1HG2  ILE  52          1HG2      ILE  52   7.442  -0.503  -4.833
  388   2HG2  ILE  52          2HG2      ILE  52   7.497   0.390  -3.272
  389   3HG2  ILE  52          3HG2      ILE  52   7.597   1.296  -4.806
  390   1HD1  ILE  52          1HD1      ILE  52   6.568   1.911  -2.012
  391   2HD1  ILE  52          2HD1      ILE  52   5.031   1.037  -1.621
  392   3HD1  ILE  52          3HD1      ILE  52   5.066   2.833  -1.717
  393    H    ASP  53           H        ASP  53   4.699   2.771  -6.915
  394    HA   ASP  53           HA       ASP  53   5.757   3.867  -8.504
  395   1HB   ASP  53          2HB       ASP  53   8.075   2.771  -6.843
  396   2HB   ASP  53          1HB       ASP  53   8.235   4.145  -7.987
  397    H    GLY  54           H        GLY  54   5.236   1.013  -9.178
  398   1HA   GLY  54          2HA       GLY  54   5.379  -0.096 -11.137
  399   2HA   GLY  54          1HA       GLY  54   6.755   0.930 -11.646
  400    H    VAL  55           H        VAL  55   7.083  -0.487  -8.453
  401    HA   VAL  55           HA       VAL  55   8.741  -2.590  -9.611
  402    HB   VAL  55           HB       VAL  55   9.008  -1.300  -6.874
  403   1HG1  VAL  55          1HG1      VAL  55   9.845  -3.692  -7.107
  404   2HG1  VAL  55          2HG1      VAL  55  11.218  -2.533  -6.951
  405   3HG1  VAL  55          3HG1      VAL  55  10.773  -3.208  -8.561
  406   1HG2  VAL  55          1HG2      VAL  55   9.531   0.421  -8.561
  407   2HG2  VAL  55          2HG2      VAL  55  10.541  -0.752  -9.492
  408   3HG2  VAL  55          3HG2      VAL  55  11.060  -0.211  -7.854
  409    H    ASN  56           H        ASN  56   8.138  -4.650  -9.126
  410    HA   ASN  56           HA       ASN  56   5.699  -4.954  -7.709
  411   1HB   ASN  56          2HB       ASN  56   5.739  -7.263  -8.480
  412   2HB   ASN  56          1HB       ASN  56   6.138  -6.057  -9.766
  413   1HD2  ASN  56          1HD2      ASN  56   8.894  -6.930  -7.709
  414   2HD2  ASN  56          2HD2      ASN  56   9.628  -7.835  -9.010
  415    H    THR  57           H        THR  57   5.214  -5.692  -5.720
  416    HA   THR  57           HA       THR  57   7.403  -5.951  -3.908
  417    HB   THR  57           HB       THR  57   5.737  -5.843  -2.168
  418    HG1  THR  57           1HG      THR  57   3.898  -5.545  -4.310
  419   1HG2  THR  57          1HG2      THR  57   5.026  -3.510  -2.620
  420   2HG2  THR  57          2HG2      THR  57   5.395  -3.691  -4.374
  421   3HG2  THR  57          3HG2      THR  57   6.723  -3.765  -3.153
  422    H    ASP  58           H        ASP  58   7.619  -8.060  -5.465
  423    HA   ASP  58           HA       ASP  58   6.086 -10.252  -4.461
  424   1HB   ASP  58          2HB       ASP  58   7.014  -9.760  -6.903
  425   2HB   ASP  58          1HB       ASP  58   8.536 -10.510  -6.294
  426    H    THR  59           H        THR  59   9.359  -9.006  -4.036
  427    HA   THR  59           HA       THR  59   9.684 -10.915  -1.841
  428    HB   THR  59           HB       THR  59  10.958 -11.574  -3.840
  429    HG1  THR  59           1HG      THR  59  12.800 -10.850  -1.887
  430   1HG2  THR  59          1HG2      THR  59  12.644  -9.036  -3.300
  431   2HG2  THR  59          2HG2      THR  59  11.588  -9.322  -4.730
  432   3HG2  THR  59          3HG2      THR  59  13.019 -10.361  -4.454
  433    H    MET  60           H        MET  60   8.512  -8.278  -1.756
  434    HA   MET  60           HA       MET  60  10.420  -6.839  -0.102
  435   1HB   MET  60          2HB       MET  60   7.986  -6.171  -1.861
  436   2HB   MET  60          1HB       MET  60   8.573  -5.029  -0.610
  437   1HG   MET  60          2HG       MET  60   9.445  -4.271  -2.655
  438   2HG   MET  60          1HG       MET  60  10.805  -4.976  -1.734
  439   1HE   MET  60          1HE       MET  60  11.986  -5.487  -5.355
  440   2HE   MET  60          2HE       MET  60  12.298  -4.787  -3.731
  441   3HE   MET  60          3HE       MET  60  10.984  -4.121  -4.772
  442    H    THR  61           H        THR  61   9.756  -6.641   2.072
  443    HA   THR  61           HA       THR  61   7.360  -8.109   2.773
  444    HB   THR  61           HB       THR  61   8.067  -8.150   4.981
  445    HG1  THR  61           1HG      THR  61   9.627  -7.027   5.758
  446   1HG2  THR  61          1HG2      THR  61   9.230  -9.643   3.235
  447   2HG2  THR  61          2HG2      THR  61  10.177  -9.357   4.740
  448   3HG2  THR  61          3HG2      THR  61  10.581  -8.453   3.226
  449    H    HIS  62           H        HIS  62   6.122  -7.073   4.841
  450    HA   HIS  62           HA       HIS  62   4.994  -4.734   3.966
  451   1HB   HIS  62          2HB       HIS  62   3.587  -4.820   5.747
  452   2HB   HIS  62          1HB       HIS  62   4.156  -6.513   5.621
  453    HD1  HIS  62           1HD      HIS  62   5.129  -3.430   7.806
  454    HD2  HIS  62           2HD      HIS  62   4.583  -7.588   8.028
  455    HE1  HIS  62           1HE      HIS  62   5.297  -4.114  10.236
  456    H    LEU  63           H        LEU  63   7.529  -5.180   6.336
  457    HA   LEU  63           HA       LEU  63   7.968  -2.523   7.042
  458   1HB   LEU  63          2HB       LEU  63   9.047  -4.458   8.179
  459   2HB   LEU  63          1HB       LEU  63   9.971  -4.809   6.688
  460    HG   LEU  63           HG       LEU  63  11.035  -2.486   6.897
  461   1HD1  LEU  63          1HD1      LEU  63   9.412  -1.408   8.477
  462   2HD1  LEU  63          2HD1      LEU  63  11.069  -1.457   9.176
  463   3HD1  LEU  63          3HD1      LEU  63   9.825  -2.635   9.740
  464   1HD2  LEU  63          1HD2      LEU  63  12.197  -4.563   7.395
  465   2HD2  LEU  63          2HD2      LEU  63  11.517  -4.576   9.076
  466   3HD2  LEU  63          3HD2      LEU  63  12.679  -3.278   8.574
  467    H    GLU  64           H        GLU  64   9.375  -4.377   4.328
  468    HA   GLU  64           HA       GLU  64  10.931  -2.308   3.341
  469   1HB   GLU  64          2HB       GLU  64  10.521  -4.956   2.653
  470   2HB   GLU  64          1HB       GLU  64   9.756  -4.147   1.246
  471   1HG   GLU  64          2HG       GLU  64  11.884  -2.772   0.962
  472   2HG   GLU  64          1HG       GLU  64  12.559  -3.618   2.409
  473    H    ALA  65           H        ALA  65   7.594  -3.254   2.453
  474    HA   ALA  65           HA       ALA  65   7.156  -1.249   0.618
  475   1HB   ALA  65          1HB       ALA  65   5.808  -3.274   0.929
  476   2HB   ALA  65          2HB       ALA  65   4.736  -1.811   1.034
  477   3HB   ALA  65          3HB       ALA  65   5.232  -2.688   2.539
  478    H    GLN  66           H        GLN  66   6.742  -1.116   4.156
  479    HA   GLN  66           HA       GLN  66   5.735   1.466   4.276
  480   1HB   GLN  66          2HB       GLN  66   7.435  -0.249   6.136
  481   2HB   GLN  66          1HB       GLN  66   6.964   1.425   6.610
  482   1HG   GLN  66          2HG       GLN  66   4.531   0.819   6.313
  483   2HG   GLN  66          1HG       GLN  66   5.044  -0.839   5.836
  484   1HE2  GLN  66          1HE2      GLN  66   4.749   1.423   8.586
  485   2HE2  GLN  66          2HE2      GLN  66   4.745   0.162   9.777
  486    H    ASN  67           H        ASN  67   9.128   0.365   4.305
  487    HA   ASN  67           HA       ASN  67  10.263   2.927   4.374
  488   1HB   ASN  67          2HB       ASN  67  11.215   0.148   3.480
  489   2HB   ASN  67          1HB       ASN  67  12.326   1.551   3.496
  490   1HD2  ASN  67          1HD2      ASN  67  12.944  -0.633   5.098
  491   2HD2  ASN  67          2HD2      ASN  67  12.684  -0.200   6.766
  492    H    LYS  68           H        LYS  68   9.269   0.921   1.634
  493    HA   LYS  68           HA       LYS  68  10.182   2.670  -0.352
  494   1HB   LYS  68          2HB       LYS  68   8.004   0.550  -0.455
  495   2HB   LYS  68          1HB       LYS  68   8.693   1.462  -1.844
  496   1HG   LYS  68          2HG       LYS  68  11.009   0.643  -1.038
  497   2HG   LYS  68          1HG       LYS  68  10.129  -0.629  -0.124
  498   1HD   LYS  68          2HD       LYS  68   9.012  -1.435  -2.109
  499   2HD   LYS  68          1HD       LYS  68   9.662  -0.077  -3.090
  500   1HE   LYS  68          2HE       LYS  68  11.427  -2.230  -1.725
  501   2HE   LYS  68          1HE       LYS  68  10.880  -2.277  -3.458
  502   1HZ   LYS  68          1HZ       LYS  68  11.841   0.146  -3.437
  503   2HZ   LYS  68          2HZ       LYS  68  12.840  -1.188  -3.695
  504   3HZ   LYS  68          3HZ       LYS  68  12.785  -0.423  -2.181
  505    H    ILE  69           H        ILE  69   6.831   2.422   1.088
  506    HA   ILE  69           HA       ILE  69   5.814   4.661  -0.034
  507    HB   ILE  69           HB       ILE  69   5.425   3.157   2.545
  508   1HG1  ILE  69          2HG1      ILE  69   3.931   3.712  -0.062
  509   2HG1  ILE  69          1HG1      ILE  69   4.359   2.113   0.571
  510   1HG2  ILE  69          1HG2      ILE  69   5.011   5.567   3.179
  511   2HG2  ILE  69          2HG2      ILE  69   3.531   4.588   3.151
  512   3HG2  ILE  69          3HG2      ILE  69   3.897   5.676   1.755
  513   1HD1  ILE  69          1HD1      ILE  69   2.727   2.223   2.360
  514   2HD1  ILE  69          2HD1      ILE  69   2.008   2.342   0.723
  515   3HD1  ILE  69          3HD1      ILE  69   2.117   3.820   1.740
  516    H    LYS  70           H        LYS  70   7.780   4.565   2.958
  517    HA   LYS  70           HA       LYS  70   7.379   7.267   3.473
  518   1HB   LYS  70          2HB       LYS  70   8.992   5.013   4.553
  519   2HB   LYS  70          1HB       LYS  70   9.721   6.607   4.853
  520   1HG   LYS  70          2HG       LYS  70   8.312   5.884   6.716
  521   2HG   LYS  70          1HG       LYS  70   7.805   7.444   6.000
  522   1HD   LYS  70          2HD       LYS  70   5.918   6.325   4.811
  523   2HD   LYS  70          1HD       LYS  70   6.474   4.729   5.400
  524   1HE   LYS  70          2HE       LYS  70   4.553   5.487   6.705
  525   2HE   LYS  70          1HE       LYS  70   6.014   5.437   7.771
  526   1HZ   LYS  70          1HZ       LYS  70   4.931   7.877   6.438
  527   2HZ   LYS  70          2HZ       LYS  70   6.231   7.860   7.475
  528   3HZ   LYS  70          3HZ       LYS  70   4.699   7.431   8.068
  529    H    SER  71           H        SER  71   9.450   5.989   1.088
  530    HA   SER  71           HA       SER  71  11.262   8.284   1.291
  531   1HB   SER  71          2HB       SER  71  12.552   6.993  -0.518
  532   2HB   SER  71          1HB       SER  71  12.568   6.370   1.155
  533    HG   SER  71           HG       SER  71  11.165   4.819   0.648
  534    H    ALA  72           H        ALA  72   8.308   7.704   0.100
  535    HA   ALA  72           HA       ALA  72   8.687   9.209  -2.378
  536   1HB   ALA  72          1HB       ALA  72   7.589   6.857  -2.261
  537   2HB   ALA  72          2HB       ALA  72   6.533   8.139  -2.981
  538   3HB   ALA  72          3HB       ALA  72   6.304   7.619  -1.264
  539    H    SER  73           H        SER  73   7.133  10.997  -2.773
  540    HA   SER  73           HA       SER  73   5.568  11.863  -0.545
  541   1HB   SER  73          2HB       SER  73   6.757  14.064  -0.250
  542   2HB   SER  73          1HB       SER  73   7.575  12.632   0.439
  543    HG   SER  73           HG       SER  73   9.047  12.684  -1.131
  544    H    TYR  74           H        TYR  74   7.132  13.271  -3.466
  545    HA   TYR  74           HA       TYR  74   4.806  14.896  -3.937
  546   1HB   TYR  74          2HB       TYR  74   7.292  14.239  -5.636
  547   2HB   TYR  74          1HB       TYR  74   5.971  15.315  -6.202
  548    HD1  TYR  74           1HD      TYR  74   5.264  17.178  -4.487
  549    HD2  TYR  74           2HD      TYR  74   9.081  15.334  -4.725
  550    HE1  TYR  74           1HE      TYR  74   6.279  19.183  -3.537
  551    HE2  TYR  74           2HE      TYR  74  10.115  17.347  -3.792
  552    HH   TYR  74           HH       TYR  74   8.186  20.168  -2.826
  553    H    ASN  75           H        ASN  75   6.253  11.929  -5.184
  554    HA   ASN  75           HA       ASN  75   3.652  11.156  -6.290
  555   1HB   ASN  75          2HB       ASN  75   5.197  11.724  -8.122
  556   2HB   ASN  75          1HB       ASN  75   6.485  10.687  -7.391
  557   1HD2  ASN  75          1HD2      ASN  75   5.920   8.243  -7.287
  558   2HD2  ASN  75          2HD2      ASN  75   5.160   7.631  -8.708
  559    H    LEU  76           H        LEU  76   2.985   9.335  -5.570
  560    HA   LEU  76           HA       LEU  76   4.779   7.238  -4.661
  561   1HB   LEU  76          2HB       LEU  76   4.216   8.433  -2.581
  562   2HB   LEU  76          1HB       LEU  76   2.495   8.449  -2.995
  563    HG   LEU  76           HG       LEU  76   2.274   6.050  -2.573
  564   1HD1  LEU  76          1HD1      LEU  76   5.309   5.912  -2.034
  565   2HD1  LEU  76          2HD1      LEU  76   4.489   5.195  -3.491
  566   3HD1  LEU  76          3HD1      LEU  76   4.095   4.622  -1.820
  567   1HD2  LEU  76          1HD2      LEU  76   2.951   5.960  -0.169
  568   2HD2  LEU  76          2HD2      LEU  76   2.336   7.623  -0.571
  569   3HD2  LEU  76          3HD2      LEU  76   4.098   7.307  -0.411
  570    H    SER  77           H        SER  77   4.184   5.678  -6.196
  571    HA   SER  77           HA       SER  77   1.382   5.768  -7.087
  572   1HB   SER  77          2HB       SER  77   3.020   6.269  -8.828
  573   2HB   SER  77          1HB       SER  77   3.888   4.754  -8.456
  574    HG   SER  77           HG       SER  77   1.398   5.131  -9.735
  575    H    LEU  78           H        LEU  78   0.173   4.368  -5.913
  576    HA   LEU  78           HA       LEU  78   1.358   1.770  -5.285
  577   1HB   LEU  78          2HB       LEU  78  -1.335   2.804  -4.341
  578   2HB   LEU  78          1HB       LEU  78  -0.362   1.449  -3.706
  579    HG   LEU  78           HG       LEU  78  -0.207   3.105  -2.083
  580   1HD1  LEU  78          1HD1      LEU  78   2.106   3.726  -1.879
  581   2HD1  LEU  78          2HD1      LEU  78   2.395   3.528  -3.653
  582   3HD1  LEU  78          3HD1      LEU  78   2.018   2.098  -2.624
  583   1HD2  LEU  78          1HD2      LEU  78   0.089   5.383  -2.227
  584   2HD2  LEU  78          2HD2      LEU  78  -1.102   5.007  -3.532
  585   3HD2  LEU  78          3HD2      LEU  78   0.615   5.343  -3.959
  586    H    THR  79           H        THR  79   0.595  -0.134  -6.185
  587    HA   THR  79           HA       THR  79  -1.976  -0.089  -7.558
  588    HB   THR  79           HB       THR  79   0.533  -1.602  -8.423
  589    HG1  THR  79           1HG      THR  79   0.459   0.523  -9.202
  590   1HG2  THR  79          1HG2      THR  79  -2.374  -1.613  -9.463
  591   2HG2  THR  79          2HG2      THR  79  -1.504  -3.006  -8.698
  592   3HG2  THR  79          3HG2      THR  79  -0.961  -2.385 -10.291
  593    H    LEU  80           H        LEU  80  -3.266  -1.340  -6.183
  594    HA   LEU  80           HA       LEU  80  -2.223  -3.919  -5.313
  595   1HB   LEU  80          2HB       LEU  80  -3.337  -3.726  -3.238
  596   2HB   LEU  80          1HB       LEU  80  -2.136  -2.391  -3.444
  597    HG   LEU  80           HG       LEU  80  -5.123  -2.207  -3.818
  598   1HD1  LEU  80          1HD1      LEU  80  -4.250  -2.687  -1.493
  599   2HD1  LEU  80          2HD1      LEU  80  -5.156  -1.093  -1.619
  600   3HD1  LEU  80          3HD1      LEU  80  -3.315  -1.124  -1.561
  601   1HD2  LEU  80          1HD2      LEU  80  -2.719  -0.322  -3.991
  602   2HD2  LEU  80          2HD2      LEU  80  -4.278   0.419  -3.387
  603   3HD2  LEU  80          3HD2      LEU  80  -4.197  -0.329  -5.053
  604    H    GLN  81           H        GLN  81  -3.959  -5.470  -4.875
  605    HA   GLN  81           HA       GLN  81  -5.731  -5.364  -7.166
  606   1HB   GLN  81          2HB       GLN  81  -5.305  -7.722  -5.289
  607   2HB   GLN  81          1HB       GLN  81  -6.033  -7.706  -6.926
  608   1HG   GLN  81          2HG       GLN  81  -3.753  -7.020  -7.870
  609   2HG   GLN  81          1HG       GLN  81  -3.076  -7.217  -6.203
  610   1HE2  GLN  81          1HE2      GLN  81  -1.648  -8.878  -7.103
  611   2HE2  GLN  81          2HE2      GLN  81  -2.263 -10.446  -7.528
  612    H    LYS  82           H        LYS  82  -7.984  -5.222  -7.015
  613    HA   LYS  82           HA       LYS  82  -9.084  -4.818  -4.485
  614   1HB   LYS  82          2HB       LYS  82 -10.271  -5.130  -7.278
  615   2HB   LYS  82          1HB       LYS  82 -11.303  -4.888  -5.856
  616   1HG   LYS  82          2HG       LYS  82  -9.226  -2.951  -6.987
  617   2HG   LYS  82          1HG       LYS  82 -10.997  -2.752  -6.895
  618   1HD   LYS  82          2HD       LYS  82  -8.975  -2.810  -4.605
  619   2HD   LYS  82          1HD       LYS  82  -9.852  -1.373  -5.179
  620   1HE   LYS  82          2HE       LYS  82 -11.831  -1.892  -4.080
  621   2HE   LYS  82          1HE       LYS  82 -11.610  -3.674  -4.201
  622   1HZ   LYS  82          1HZ       LYS  82  -9.763  -3.436  -2.549
  623   2HZ   LYS  82          2HZ       LYS  82 -11.260  -3.158  -1.953
  624   3HZ   LYS  82          3HZ       LYS  82 -10.283  -1.856  -2.254
  625    H    SER  83           H        SER  83  -9.186  -6.226  -3.027
  626    HA   SER  83           HA       SER  83 -11.195  -8.316  -3.483
  627   1HB   SER  83          2HB       SER  83  -9.013  -9.384  -3.014
  628   2HB   SER  83          1HB       SER  83  -8.859  -8.431  -1.514
  629    HG   SER  83           HG       SER  83 -10.797 -10.399  -2.170
  630    H    LYS  84           H        LYS  84  -9.719  -6.528  -0.727
  631    HA   LYS  84           HA       LYS  84 -12.225  -6.794   0.662
  632   1HB   LYS  84          2HB       LYS  84  -9.405  -6.062   1.488
  633   2HB   LYS  84          1HB       LYS  84 -10.796  -5.788   2.590
  634   1HG   LYS  84          2HG       LYS  84 -11.409  -8.141   2.570
  635   2HG   LYS  84          1HG       LYS  84 -10.143  -8.503   1.366
  636   1HD   LYS  84          2HD       LYS  84  -9.455  -9.255   3.527
  637   2HD   LYS  84          1HD       LYS  84  -8.356  -7.978   2.988
  638   1HE   LYS  84          2HE       LYS  84 -10.657  -7.086   4.791
  639   2HE   LYS  84          1HE       LYS  84  -9.444  -8.214   5.510
  640   1HZ   LYS  84          1HZ       LYS  84  -8.939  -5.511   4.391
  641   2HZ   LYS  84          2HZ       LYS  84  -7.709  -6.634   4.614
  642   3HZ   LYS  84          3HZ       LYS  84  -8.612  -6.130   5.927
  643    H    ARG  85           H        ARG  85 -13.224  -5.103   1.892
  644    HA   ARG  85           HA       ARG  85 -12.544  -2.402   0.963
  645   1HB   ARG  85          2HB       ARG  85 -14.728  -1.696   1.848
  646   2HB   ARG  85          1HB       ARG  85 -14.788  -2.716   0.382
  647   1HG   ARG  85          2HG       ARG  85 -15.522  -4.672   1.635
  648   2HG   ARG  85          1HG       ARG  85 -15.223  -3.843   3.198
  649   1HD   ARG  85          2HD       ARG  85 -17.027  -2.126   2.598
  650   2HD   ARG  85          1HD       ARG  85 -17.373  -3.087   1.111
  651    HE   ARG  85           HE       ARG  85 -18.273  -4.857   2.497
  652   1HH1  ARG  85          1HH1      ARG  85 -16.699  -2.472   4.708
  653   2HH1  ARG  85          2HH1      ARG  85 -17.475  -3.177   6.080
  654   1HH2  ARG  85          1HH2      ARG  85 -19.043  -5.748   4.244
  655   2HH2  ARG  85          2HH2      ARG  85 -18.521  -5.256   5.845
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1  -7.474  -8.535 -10.690
    2   2H    MET   1          2HT       MET   1  -8.606  -8.806 -11.891
    3   3H    MET   1          3HT       MET   1  -9.110  -8.342 -10.333
    4    HA   MET   1           HA       MET   1  -7.611  -6.724 -12.295
    5   1HB   MET   1          2HB       MET   1 -10.361  -6.318 -10.993
    6   2HB   MET   1          1HB       MET   1  -9.551  -5.144 -12.067
    7   1HG   MET   1          2HG       MET   1  -9.527  -6.928 -13.895
    8   2HG   MET   1          1HG       MET   1 -10.513  -7.954 -12.826
    9   1HE   MET   1          1HE       MET   1 -10.242  -4.859 -15.129
   10   2HE   MET   1          2HE       MET   1 -10.546  -3.975 -13.601
   11   3HE   MET   1          3HE       MET   1 -11.780  -3.972 -14.897
   12    H    ALA   2           H        ALA   2  -6.820  -4.632 -11.686
   13    HA   ALA   2           HA       ALA   2  -6.666  -4.175  -8.829
   14   1HB   ALA   2          1HB       ALA   2  -4.741  -5.657  -9.180
   15   2HB   ALA   2          2HB       ALA   2  -4.143  -3.982  -8.943
   16   3HB   ALA   2          3HB       ALA   2  -4.198  -4.689 -10.605
   17    H    TYR   3           H        TYR   3  -6.150  -2.157  -8.182
   18    HA   TYR   3           HA       TYR   3  -6.591  -0.190 -10.303
   19   1HB   TYR   3          2HB       TYR   3  -7.735   1.246  -8.916
   20   2HB   TYR   3          1HB       TYR   3  -8.520  -0.359  -8.847
   21    HD1  TYR   3           1HD      TYR   3  -7.605   2.391  -7.104
   22    HD2  TYR   3           2HD      TYR   3  -7.495  -1.831  -6.688
   23    HE1  TYR   3           1HE      TYR   3  -7.861   2.634  -4.679
   24    HE2  TYR   3           2HE      TYR   3  -7.791  -1.611  -4.279
   25    HH   TYR   3           HH       TYR   3  -8.197  -0.191  -2.538
   26    H    SER   4           H        SER   4  -5.612   1.834 -10.178
   27    HA   SER   4           HA       SER   4  -3.088   1.831  -8.699
   28   1HB   SER   4          2HB       SER   4  -2.091   3.066 -10.660
   29   2HB   SER   4          1HB       SER   4  -2.537   1.369 -11.000
   30    HG   SER   4           HG       SER   4  -3.891   3.718 -11.796
   31    H    VAL   5           H        VAL   5  -2.622   3.712  -7.621
   32    HA   VAL   5           HA       VAL   5  -3.829   6.148  -8.502
   33    HB   VAL   5           HB       VAL   5  -5.581   5.711  -7.046
   34   1HG1  VAL   5          1HG1      VAL   5  -5.362   4.932  -4.765
   35   2HG1  VAL   5          2HG1      VAL   5  -3.609   4.557  -5.030
   36   3HG1  VAL   5          3HG1      VAL   5  -4.898   3.702  -5.993
   37   1HG2  VAL   5          1HG2      VAL   5  -5.342   7.361  -5.273
   38   2HG2  VAL   5          2HG2      VAL   5  -4.462   7.973  -6.724
   39   3HG2  VAL   5          3HG2      VAL   5  -3.554   7.281  -5.331
   40    H    THR   6           H        THR   6  -2.531   7.843  -8.173
   41    HA   THR   6           HA       THR   6   0.017   7.291  -6.816
   42    HB   THR   6           HB       THR   6  -0.606   9.429  -8.879
   43    HG1  THR   6           1HG      THR   6  -0.627   7.256  -9.676
   44   1HG2  THR   6          1HG2      THR   6   1.360   9.947  -7.330
   45   2HG2  THR   6          2HG2      THR   6   1.957   9.501  -8.962
   46   3HG2  THR   6          3HG2      THR   6   2.037   8.302  -7.644
   47    H    LEU   7           H        LEU   7   0.180   8.251  -4.855
   48    HA   LEU   7           HA       LEU   7  -1.575  10.507  -4.258
   49   1HB   LEU   7          2HB       LEU   7  -1.542   8.372  -2.913
   50   2HB   LEU   7          1HB       LEU   7   0.150   8.705  -2.475
   51    HG   LEU   7           HG       LEU   7  -0.602  10.805  -1.291
   52   1HD1  LEU   7          1HD1      LEU   7  -3.055  11.067  -0.771
   53   2HD1  LEU   7          2HD1      LEU   7  -3.436   9.761  -1.950
   54   3HD1  LEU   7          3HD1      LEU   7  -2.721  11.322  -2.520
   55   1HD2  LEU   7          1HD2      LEU   7  -1.711   9.544   0.615
   56   2HD2  LEU   7          2HD2      LEU   7  -0.281   8.677  -0.059
   57   3HD2  LEU   7          3HD2      LEU   7  -1.938   8.143  -0.495
   58    H    THR   8           H        THR   8  -0.750  12.514  -3.492
   59    HA   THR   8           HA       THR   8   2.148  12.718  -3.287
   60    HB   THR   8           HB       THR   8   1.436  13.699  -5.426
   61    HG1  THR   8           1HG      THR   8   2.195  15.818  -3.787
   62   1HG2  THR   8          1HG2      THR   8  -0.051  15.773  -3.664
   63   2HG2  THR   8          2HG2      THR   8  -0.840  14.543  -4.730
   64   3HG2  THR   8          3HG2      THR   8   0.202  15.822  -5.447
   65    H    GLY   9           H        GLY   9   2.808  14.330  -1.675
   66   1HA   GLY   9          2HA       GLY   9   1.084  15.936  -0.332
   67   2HA   GLY   9          1HA       GLY   9   1.036  14.342   0.527
   68    HA   PRO  10           HA       PRO  10   4.725  16.704   1.830
   69   1HB   PRO  10          2HB       PRO  10   4.003  17.785   4.262
   70   2HB   PRO  10          1HB       PRO  10   3.558  18.525   2.682
   71   1HG   PRO  10          2HG       PRO  10   1.793  16.699   4.405
   72   2HG   PRO  10          1HG       PRO  10   1.372  18.309   3.692
   73   1HD   PRO  10          2HD       PRO  10   0.734  15.919   2.423
   74   2HD   PRO  10          1HD       PRO  10   1.227  17.401   1.485
   75    H    GLY  11           H        GLY  11   2.656  14.684   3.881
   76   1HA   GLY  11          2HA       GLY  11   5.024  13.368   4.975
   77   2HA   GLY  11          1HA       GLY  11   3.941  14.335   6.054
   78    HA   PRO  12           HA       PRO  12   3.367   9.910   5.778
   79   1HB   PRO  12          2HB       PRO  12   2.222  10.437   8.589
   80   2HB   PRO  12          1HB       PRO  12   3.109   8.957   8.043
   81   1HG   PRO  12          2HG       PRO  12   4.486  10.935   9.325
   82   2HG   PRO  12          1HG       PRO  12   5.191  10.244   7.797
   83   1HD   PRO  12          2HD       PRO  12   3.656  12.865   8.165
   84   2HD   PRO  12          1HD       PRO  12   5.116  12.490   7.141
   85    H    TRP  13           H        TRP  13   1.997   8.374   5.365
   86    HA   TRP  13           HA       TRP  13  -0.717   9.145   4.781
   87   1HB   TRP  13          2HB       TRP  13   0.596   6.536   3.947
   88   2HB   TRP  13          1HB       TRP  13  -0.584   7.432   3.060
   89    HD1  TRP  13           HD       TRP  13   2.992   6.675   3.474
   90    HE1  TRP  13           1HE      TRP  13   4.465   8.037   1.818
   91    HE3  TRP  13           3HE      TRP  13  -0.312  10.340   2.355
   92    HZ2  TRP  13           2HZ      TRP  13   4.203  10.350   0.297
   93    HZ3  TRP  13           3HZ      TRP  13   0.370  12.131   0.828
   94    HH2  TRP  13           HH       TRP  13   2.594  12.134  -0.194
   95    H    GLY  14           H        GLY  14  -2.261   8.568   6.274
   96   1HA   GLY  14          2HA       GLY  14  -1.598   6.742   8.343
   97   2HA   GLY  14          1HA       GLY  14  -3.123   7.634   8.087
   98    H    PHE  15           H        PHE  15  -1.336   4.797   6.875
   99    HA   PHE  15           HA       PHE  15  -3.862   3.287   6.917
  100   1HB   PHE  15          2HB       PHE  15  -3.035   2.027   4.926
  101   2HB   PHE  15          1HB       PHE  15  -2.985   3.767   4.596
  102    HD1  PHE  15           1HD      PHE  15  -0.875   4.954   4.643
  103    HD2  PHE  15           2HD      PHE  15  -0.977   0.741   5.121
  104    HE1  PHE  15           1HE      PHE  15   1.602   4.858   4.501
  105    HE2  PHE  15           2HE      PHE  15   1.396   0.621   4.606
  106    HZ   PHE  15           HZ       PHE  15   2.726   2.674   4.473
  107    H    ARG  16           H        ARG  16  -3.741   0.983   7.336
  108    HA   ARG  16           HA       ARG  16  -1.797   0.606   9.427
  109   1HB   ARG  16          2HB       ARG  16  -4.603  -0.514   8.964
  110   2HB   ARG  16          1HB       ARG  16  -3.524  -1.152  10.218
  111   1HG   ARG  16          2HG       ARG  16  -4.687   1.723  10.010
  112   2HG   ARG  16          1HG       ARG  16  -5.186   0.417  11.105
  113   1HD   ARG  16          2HD       ARG  16  -3.860   1.670  12.575
  114   2HD   ARG  16          1HD       ARG  16  -2.693   0.429  11.930
  115    HE   ARG  16           HE       ARG  16  -2.712   2.831  10.272
  116   1HH1  ARG  16          1HH1      ARG  16  -1.330   1.663  13.402
  117   2HH1  ARG  16          2HH1      ARG  16   0.254   2.183  12.941
  118   1HH2  ARG  16          1HH2      ARG  16  -0.562   3.329   9.820
  119   2HH2  ARG  16          2HH2      ARG  16   0.618   3.353  11.066
  120    H    LEU  17           H        LEU  17  -0.374  -1.016   9.387
  121    HA   LEU  17           HA       LEU  17  -0.337  -2.402   6.878
  122   1HB   LEU  17          2HB       LEU  17   1.846  -1.728   8.923
  123   2HB   LEU  17          1HB       LEU  17   2.110  -2.767   7.493
  124    HG   LEU  17           HG       LEU  17   0.953  -0.743   6.198
  125   1HD1  LEU  17          1HD1      LEU  17   1.831   1.467   7.214
  126   2HD1  LEU  17          2HD1      LEU  17   2.101   0.550   8.751
  127   3HD1  LEU  17          3HD1      LEU  17   0.434   0.721   8.045
  128   1HD2  LEU  17          1HD2      LEU  17   3.156  -1.653   5.685
  129   2HD2  LEU  17          2HD2      LEU  17   3.886  -0.834   7.128
  130   3HD2  LEU  17          3HD2      LEU  17   3.244   0.145   5.741
  131    H    GLN  18           H        GLN  18  -0.540  -4.568   6.629
  132    HA   GLN  18           HA       GLN  18   0.001  -6.315   8.886
  133   1HB   GLN  18          2HB       GLN  18  -2.615  -6.205   7.327
  134   2HB   GLN  18          1HB       GLN  18  -2.114  -7.575   8.377
  135   1HG   GLN  18          2HG       GLN  18  -1.899  -5.892  10.295
  136   2HG   GLN  18          1HG       GLN  18  -2.707  -4.671   9.272
  137   1HE2  GLN  18          1HE2      GLN  18  -3.549  -6.060  11.837
  138   2HE2  GLN  18          2HE2      GLN  18  -5.122  -6.722  11.458
  139    H    GLY  19           H        GLY  19  -0.201  -8.712   7.956
  140   1HA   GLY  19          2HA       GLY  19   0.462 -10.248   6.582
  141   2HA   GLY  19          1HA       GLY  19   0.120  -9.120   5.237
  142    H    GLY  20           H        GLY  20   1.767 -10.083   4.022
  143   1HA   GLY  20          2HA       GLY  20   3.555  -9.157   3.079
  144   2HA   GLY  20          1HA       GLY  20   4.377  -8.940   4.666
  145    H    LYS  21           H        LYS  21   5.596  -9.953   2.301
  146    HA   LYS  21           HA       LYS  21   5.506 -12.624   2.002
  147   1HB   LYS  21          2HB       LYS  21   7.052 -10.428   0.980
  148   2HB   LYS  21          1HB       LYS  21   8.201 -11.711   1.411
  149   1HG   LYS  21          2HG       LYS  21   7.662 -12.220  -0.800
  150   2HG   LYS  21          1HG       LYS  21   6.647 -13.343   0.144
  151   1HD   LYS  21          2HD       LYS  21   4.882 -11.271  -0.078
  152   2HD   LYS  21          1HD       LYS  21   5.878 -10.889  -1.507
  153   1HE   LYS  21          2HE       LYS  21   4.385 -13.529  -0.888
  154   2HE   LYS  21          1HE       LYS  21   3.856 -12.275  -2.072
  155   1HZ   LYS  21          1HZ       LYS  21   6.491 -13.649  -2.355
  156   2HZ   LYS  21          2HZ       LYS  21   5.581 -12.900  -3.543
  157   3HZ   LYS  21          3HZ       LYS  21   5.071 -14.354  -2.850
  158    H    ASP  22           H        ASP  22   7.370 -10.917   4.365
  159    HA   ASP  22           HA       ASP  22   9.058 -12.780   5.399
  160   1HB   ASP  22          2HB       ASP  22   8.886 -10.339   5.746
  161   2HB   ASP  22          1HB       ASP  22   7.333 -10.541   6.616
  162    H    PHE  23           H        PHE  23   5.511 -12.491   5.892
  163    HA   PHE  23           HA       PHE  23   5.561 -14.660   7.820
  164   1HB   PHE  23          2HB       PHE  23   3.422 -12.672   6.834
  165   2HB   PHE  23          1HB       PHE  23   3.132 -13.935   8.077
  166    HD1  PHE  23           1HD      PHE  23   4.300 -13.855  10.217
  167    HD2  PHE  23           2HD      PHE  23   4.601 -10.689   7.405
  168    HE1  PHE  23           1HE      PHE  23   5.075 -12.357  11.992
  169    HE2  PHE  23           2HE      PHE  23   5.395  -9.187   9.176
  170    HZ   PHE  23           HZ       PHE  23   5.624 -10.018  11.472
  171    H    ASN  24           H        ASN  24   5.816 -14.703   4.674
  172    HA   ASN  24           HA       ASN  24   5.124 -15.756   2.945
  173   1HB   ASN  24          2HB       ASN  24   3.984 -17.859   4.856
  174   2HB   ASN  24          1HB       ASN  24   4.231 -18.074   3.088
  175   1HD2  ASN  24          1HD2      ASN  24   5.744 -18.304   6.182
  176   2HD2  ASN  24          2HD2      ASN  24   7.376 -18.570   5.614
  177    H    MET  25           H        MET  25   3.601 -13.666   3.327
  178    HA   MET  25           HA       MET  25   0.902 -14.558   2.642
  179   1HB   MET  25          2HB       MET  25   2.100 -12.561   4.508
  180   2HB   MET  25          1HB       MET  25   0.714 -11.921   3.679
  181   1HG   MET  25          2HG       MET  25   0.884 -14.477   5.419
  182   2HG   MET  25          1HG       MET  25   0.213 -12.901   5.924
  183   1HE   MET  25          1HE       MET  25  -1.705 -14.425   6.894
  184   2HE   MET  25          2HE       MET  25  -0.999 -15.890   6.137
  185   3HE   MET  25          3HE       MET  25  -2.741 -15.515   5.916
  186    HA   PRO  26           HA       PRO  26   1.475 -11.538  -0.677
  187   1HB   PRO  26          2HB       PRO  26  -1.149 -10.364  -0.702
  188   2HB   PRO  26          1HB       PRO  26  -0.635 -11.820  -1.579
  189   1HG   PRO  26          2HG       PRO  26  -2.403 -11.654   0.791
  190   2HG   PRO  26          1HG       PRO  26  -2.101 -13.015  -0.336
  191   1HD   PRO  26          2HD       PRO  26  -0.876 -12.180   2.304
  192   2HD   PRO  26          1HD       PRO  26  -0.803 -13.865   1.667
  193    H    LEU  27           H        LEU  27   1.662  -9.093  -0.866
  194    HA   LEU  27           HA       LEU  27   2.120  -7.984   1.704
  195   1HB   LEU  27          2HB       LEU  27   3.305  -7.762  -0.671
  196   2HB   LEU  27          1HB       LEU  27   2.177  -6.394  -0.911
  197    HG   LEU  27           HG       LEU  27   3.770  -6.831   1.651
  198   1HD1  LEU  27          1HD1      LEU  27   4.940  -5.227  -0.693
  199   2HD1  LEU  27          2HD1      LEU  27   5.334  -6.964  -0.354
  200   3HD1  LEU  27          3HD1      LEU  27   5.732  -5.712   0.867
  201   1HD2  LEU  27          1HD2      LEU  27   3.671  -4.320   1.889
  202   2HD2  LEU  27          2HD2      LEU  27   2.021  -5.000   1.706
  203   3HD2  LEU  27          3HD2      LEU  27   2.820  -4.200   0.299
  204    H    THR  28           H        THR  28   0.443  -7.401   2.944
  205    HA   THR  28           HA       THR  28  -1.949  -6.464   1.522
  206    HB   THR  28           HB       THR  28  -3.372  -7.346   2.912
  207    HG1  THR  28           1HG      THR  28  -2.680  -8.439   4.841
  208   1HG2  THR  28          1HG2      THR  28  -1.097  -9.419   3.046
  209   2HG2  THR  28          2HG2      THR  28  -1.716  -8.810   1.472
  210   3HG2  THR  28          3HG2      THR  28  -2.837  -9.666   2.625
  211    H    ILE  29           H        ILE  29  -3.011  -4.713   2.076
  212    HA   ILE  29           HA       ILE  29  -2.122  -3.307   4.536
  213    HB   ILE  29           HB       ILE  29  -3.167  -2.010   2.049
  214   1HG1  ILE  29          2HG1      ILE  29  -0.500  -2.248   3.527
  215   2HG1  ILE  29          1HG1      ILE  29  -0.818  -2.657   1.826
  216   1HG2  ILE  29          1HG2      ILE  29  -2.525  -0.953   4.894
  217   2HG2  ILE  29          2HG2      ILE  29  -4.147  -0.999   4.092
  218   3HG2  ILE  29          3HG2      ILE  29  -2.888   0.088   3.474
  219   1HD1  ILE  29          1HD1      ILE  29  -0.841  -0.280   1.180
  220   2HD1  ILE  29          2HD1      ILE  29   0.567  -0.571   2.249
  221   3HD1  ILE  29          3HD1      ILE  29  -0.900   0.232   2.903
  222    H    SER  30           H        SER  30  -3.777  -2.634   5.918
  223    HA   SER  30           HA       SER  30  -6.123  -4.365   5.665
  224   1HB   SER  30          2HB       SER  30  -4.570  -4.648   7.508
  225   2HB   SER  30          1HB       SER  30  -4.825  -2.998   8.083
  226    HG   SER  30           HG       SER  30  -6.103  -5.144   8.715
  227    H    ARG  31           H        ARG  31  -5.884  -1.258   7.456
  228    HA   ARG  31           HA       ARG  31  -8.005  -0.196   5.760
  229   1HB   ARG  31          2HB       ARG  31  -8.110  -0.798   8.734
  230   2HB   ARG  31          1HB       ARG  31  -9.105   0.523   8.065
  231   1HG   ARG  31          2HG       ARG  31 -10.478  -0.879   6.812
  232   2HG   ARG  31          1HG       ARG  31  -9.285  -2.205   6.750
  233   1HD   ARG  31          2HD       ARG  31 -11.205  -2.836   8.204
  234   2HD   ARG  31          1HD       ARG  31  -9.648  -2.786   9.096
  235    HE   ARG  31           HE       ARG  31 -10.334  -0.886  10.276
  236   1HH1  ARG  31          1HH1      ARG  31 -12.823  -1.450   7.740
  237   2HH1  ARG  31          2HH1      ARG  31 -13.888  -0.252   8.422
  238   1HH2  ARG  31          1HH2      ARG  31 -12.009   0.238  11.338
  239   2HH2  ARG  31          2HH2      ARG  31 -13.408   0.742  10.461
  240    H    ILE  32           H        ILE  32  -8.459   2.072   6.255
  241    HA   ILE  32           HA       ILE  32  -6.016   3.553   6.615
  242    HB   ILE  32           HB       ILE  32  -8.796   4.006   5.621
  243   1HG1  ILE  32          2HG1      ILE  32  -7.892   4.789   3.641
  244   2HG1  ILE  32          1HG1      ILE  32  -6.297   5.132   4.279
  245   1HG2  ILE  32          1HG2      ILE  32  -6.801   6.242   6.340
  246   2HG2  ILE  32          2HG2      ILE  32  -8.500   6.028   6.982
  247   3HG2  ILE  32          3HG2      ILE  32  -8.228   6.416   5.254
  248   1HD1  ILE  32          1HD1      ILE  32  -5.813   2.625   4.378
  249   2HD1  ILE  32          2HD1      ILE  32  -6.207   3.228   2.741
  250   3HD1  ILE  32          3HD1      ILE  32  -7.457   2.329   3.683
  251    H    THR  33           H        THR  33  -5.808   5.279   8.161
  252    HA   THR  33           HA       THR  33  -7.006   4.768  10.669
  253    HB   THR  33           HB       THR  33  -5.161   6.945   9.696
  254    HG1  THR  33           1HG      THR  33  -3.682   5.765  10.696
  255   1HG2  THR  33          1HG2      THR  33  -4.800   7.450  12.137
  256   2HG2  THR  33          2HG2      THR  33  -6.128   6.303  12.573
  257   3HG2  THR  33          3HG2      THR  33  -6.489   7.813  11.677
  258    HA   PRO  34           HA       PRO  34 -10.486   7.444  10.117
  259   1HB   PRO  34          2HB       PRO  34  -9.501   8.158  12.962
  260   2HB   PRO  34          1HB       PRO  34 -11.215   8.158  12.406
  261   1HG   PRO  34          2HG       PRO  34 -10.212   5.923  13.647
  262   2HG   PRO  34          1HG       PRO  34 -11.149   5.708  12.106
  263   1HD   PRO  34          2HD       PRO  34  -8.127   5.600  12.501
  264   2HD   PRO  34          1HD       PRO  34  -9.175   4.723  11.308
  265    H    GLY  35           H        GLY  35 -10.593   9.190   8.911
  266   1HA   GLY  35          2HA       GLY  35 -10.686  11.336   8.474
  267   2HA   GLY  35          1HA       GLY  35  -9.869  11.686  10.028
  268    H    SER  36           H        SER  36  -7.872   9.621   8.388
  269    HA   SER  36           HA       SER  36  -6.039  11.751   7.991
  270   1HB   SER  36          2HB       SER  36  -5.821   8.743   7.462
  271   2HB   SER  36          1HB       SER  36  -4.432   9.890   7.374
  272    HG   SER  36           HG       SER  36  -4.855  10.388   9.584
  273    H    LYS  37           H        LYS  37  -4.568  11.804   6.027
  274    HA   LYS  37           HA       LYS  37  -6.007  12.481   3.794
  275   1HB   LYS  37          2HB       LYS  37  -3.714  13.264   4.456
  276   2HB   LYS  37          1HB       LYS  37  -3.054  11.679   3.946
  277   1HG   LYS  37          2HG       LYS  37  -3.835  12.127   1.595
  278   2HG   LYS  37          1HG       LYS  37  -4.581  13.656   2.149
  279   1HD   LYS  37          2HD       LYS  37  -2.267  14.431   2.903
  280   2HD   LYS  37          1HD       LYS  37  -1.581  12.937   2.216
  281   1HE   LYS  37          2HE       LYS  37  -1.274  14.832   0.655
  282   2HE   LYS  37          1HE       LYS  37  -2.400  13.628  -0.083
  283   1HZ   LYS  37          1HZ       LYS  37  -3.067  16.040  -0.215
  284   2HZ   LYS  37          2HZ       LYS  37  -3.333  16.000   1.447
  285   3HZ   LYS  37          3HZ       LYS  37  -4.225  14.990   0.390
  286    H    ALA  38           H        ALA  38  -4.496   9.456   4.620
  287    HA   ALA  38           HA       ALA  38  -4.816   7.895   2.360
  288   1HB   ALA  38          1HB       ALA  38  -5.083   7.100   5.274
  289   2HB   ALA  38          2HB       ALA  38  -3.527   7.396   4.407
  290   3HB   ALA  38          3HB       ALA  38  -4.585   6.074   3.868
  291    H    ALA  39           H        ALA  39  -7.438   9.135   4.374
  292    HA   ALA  39           HA       ALA  39  -9.267   7.208   3.255
  293   1HB   ALA  39          1HB       ALA  39  -9.427   8.072   5.678
  294   2HB   ALA  39          2HB       ALA  39 -10.915   8.384   4.719
  295   3HB   ALA  39          3HB       ALA  39  -9.728   9.706   5.023
  296    H    GLN  40           H        GLN  40  -8.273  10.514   2.736
  297    HA   GLN  40           HA       GLN  40 -10.757  11.483   1.991
  298   1HB   GLN  40          2HB       GLN  40  -7.891  12.481   1.730
  299   2HB   GLN  40          1HB       GLN  40  -9.245  13.510   1.235
  300   1HG   GLN  40          2HG       GLN  40  -8.958  12.343   4.085
  301   2HG   GLN  40          1HG       GLN  40  -8.301  13.931   3.564
  302   1HE2  GLN  40          1HE2      GLN  40  -9.597  15.591   4.247
  303   2HE2  GLN  40          2HE2      GLN  40 -11.332  15.527   4.305
  304    H    SER  41           H        SER  41  -8.204  10.229  -0.125
  305    HA   SER  41           HA       SER  41  -9.393  11.810  -2.287
  306   1HB   SER  41          2HB       SER  41  -7.233  11.875  -3.294
  307   2HB   SER  41          1HB       SER  41  -7.144  12.342  -1.567
  308    HG   SER  41           HG       SER  41  -5.490  10.946  -2.047
  309    H    GLN  42           H        GLN  42  -7.429   9.880  -3.926
  310    HA   GLN  42           HA       GLN  42  -9.611   8.110  -4.749
  311   1HB   GLN  42          2HB       GLN  42  -6.966   8.937  -6.045
  312   2HB   GLN  42          1HB       GLN  42  -8.103   7.731  -6.733
  313   1HG   GLN  42          2HG       GLN  42  -9.862   9.458  -7.003
  314   2HG   GLN  42          1HG       GLN  42  -8.842  10.678  -6.175
  315   1HE2  GLN  42          1HE2      GLN  42  -8.885   8.494  -9.062
  316   2HE2  GLN  42          2HE2      GLN  42  -7.805   9.482 -10.019
  317    H    LEU  43           H        LEU  43  -7.091   8.305  -2.591
  318    HA   LEU  43           HA       LEU  43  -5.998   5.702  -2.957
  319   1HB   LEU  43          2HB       LEU  43  -4.941   7.843  -1.808
  320   2HB   LEU  43          1HB       LEU  43  -5.883   7.344  -0.382
  321    HG   LEU  43           HG       LEU  43  -4.735   4.946  -0.896
  322   1HD1  LEU  43          1HD1      LEU  43  -2.781   6.927  -2.201
  323   2HD1  LEU  43          2HD1      LEU  43  -3.779   5.738  -3.092
  324   3HD1  LEU  43          3HD1      LEU  43  -2.497   5.161  -1.953
  325   1HD2  LEU  43          1HD2      LEU  43  -2.636   5.846   0.477
  326   2HD2  LEU  43          2HD2      LEU  43  -4.248   5.800   1.232
  327   3HD2  LEU  43          3HD2      LEU  43  -3.603   7.354   0.582
  328    H    SER  44           H        SER  44  -6.632   3.772  -2.033
  329    HA   SER  44           HA       SER  44  -7.623   4.074   0.628
  330   1HB   SER  44          2HB       SER  44  -9.698   3.876  -1.030
  331   2HB   SER  44          1HB       SER  44  -9.310   2.145  -1.032
  332    HG   SER  44           HG       SER  44  -9.991   3.902   1.060
  333    H    GLN  45           H        GLN  45  -5.107   3.334   0.361
  334    HA   GLN  45           HA       GLN  45  -4.362   0.906  -0.226
  335   1HB   GLN  45          2HB       GLN  45  -3.784   2.632   2.231
  336   2HB   GLN  45          1HB       GLN  45  -2.791   1.208   1.780
  337   1HG   GLN  45          2HG       GLN  45  -2.160   2.147  -0.332
  338   2HG   GLN  45          1HG       GLN  45  -3.212   3.594  -0.122
  339   1HE2  GLN  45          2HE2      GLN  45  -0.249   3.113  -0.314
  340   2HE2  GLN  45          1HE2      GLN  45   0.518   3.950   1.061
  341    H    GLY  46           H        GLY  46  -5.271  -1.030   0.083
  342   1HA   GLY  46          2HA       GLY  46  -5.435  -2.239   2.529
  343   2HA   GLY  46          1HA       GLY  46  -7.004  -1.414   2.325
  344    H    ASP  47           H        ASP  47  -4.739  -3.452   0.426
  345    HA   ASP  47           HA       ASP  47  -6.432  -5.587   0.503
  346   1HB   ASP  47          2HB       ASP  47  -7.554  -4.129  -1.435
  347   2HB   ASP  47          1HB       ASP  47  -6.160  -4.610  -2.425
  348    H    LEU  48           H        LEU  48  -5.304  -6.898  -1.921
  349    HA   LEU  48           HA       LEU  48  -2.660  -7.365  -0.925
  350   1HB   LEU  48          2HB       LEU  48  -4.125  -8.555  -3.329
  351   2HB   LEU  48          1HB       LEU  48  -2.521  -9.033  -2.695
  352    HG   LEU  48           HG       LEU  48  -3.854 -10.691  -1.808
  353   1HD1  LEU  48          1HD1      LEU  48  -4.251 -10.403   0.585
  354   2HD1  LEU  48          2HD1      LEU  48  -4.203  -8.609   0.451
  355   3HD1  LEU  48          3HD1      LEU  48  -2.711  -9.574   0.093
  356   1HD2  LEU  48          1HD2      LEU  48  -6.070  -9.411  -2.548
  357   2HD2  LEU  48          2HD2      LEU  48  -5.952  -8.659  -0.888
  358   3HD2  LEU  48          3HD2      LEU  48  -6.134 -10.451  -1.027
  359    H    VAL  49           H        VAL  49  -1.119  -5.969  -1.469
  360    HA   VAL  49           HA       VAL  49  -1.462  -4.183  -3.645
  361    HB   VAL  49           HB       VAL  49   0.888  -4.646  -1.756
  362   1HG1  VAL  49          1HG1      VAL  49   1.331  -2.222  -2.266
  363   2HG1  VAL  49          2HG1      VAL  49   0.012  -2.243  -3.502
  364   3HG1  VAL  49          3HG1      VAL  49   1.497  -3.252  -3.744
  365   1HG2  VAL  49          1HG2      VAL  49  -1.680  -2.970  -1.543
  366   2HG2  VAL  49          2HG2      VAL  49  -0.200  -2.672  -0.530
  367   3HG2  VAL  49          3HG2      VAL  49  -1.090  -4.221  -0.387
  368    H    VAL  50           H        VAL  50  -0.538  -4.475  -5.710
  369    HA   VAL  50           HA       VAL  50   0.882  -6.954  -6.168
  370    HB   VAL  50           HB       VAL  50   0.285  -4.901  -8.312
  371   1HG1  VAL  50          1HG1      VAL  50   1.775  -6.893  -8.804
  372   2HG1  VAL  50          2HG1      VAL  50   0.203  -6.976  -9.682
  373   3HG1  VAL  50          3HG1      VAL  50   0.463  -7.990  -8.218
  374   1HG2  VAL  50          1HG2      VAL  50  -1.846  -5.064  -7.269
  375   2HG2  VAL  50          2HG2      VAL  50  -1.703  -6.861  -7.024
  376   3HG2  VAL  50          3HG2      VAL  50  -1.871  -6.164  -8.679
  377    H    ALA  51           H        ALA  51   1.246  -3.497  -6.805
  378    HA   ALA  51           HA       ALA  51   4.149  -3.727  -6.602
  379   1HB   ALA  51          1HB       ALA  51   4.371  -2.060  -8.454
  380   2HB   ALA  51          2HB       ALA  51   2.577  -2.033  -8.648
  381   3HB   ALA  51          3HB       ALA  51   3.507  -3.533  -9.033
  382    H    ILE  52           H        ILE  52   5.188  -2.133  -5.535
  383    HA   ILE  52           HA       ILE  52   3.536   0.016  -4.435
  384    HB   ILE  52           HB       ILE  52   4.165  -2.081  -3.034
  385   1HG1  ILE  52          2HG1      ILE  52   4.325   0.818  -1.984
  386   2HG1  ILE  52          1HG1      ILE  52   2.824  -0.083  -2.385
  387   1HG2  ILE  52          1HG2      ILE  52   6.632  -1.905  -3.374
  388   2HG2  ILE  52          2HG2      ILE  52   6.171  -1.820  -1.636
  389   3HG2  ILE  52          3HG2      ILE  52   6.622  -0.317  -2.524
  390   1HD1  ILE  52          1HD1      ILE  52   4.818  -0.696  -0.129
  391   2HD1  ILE  52          2HD1      ILE  52   3.547  -1.872  -0.656
  392   3HD1  ILE  52          3HD1      ILE  52   3.080  -0.267   0.019
  393    H    ASP  53           H        ASP  53   4.308   1.972  -4.782
  394    HA   ASP  53           HA       ASP  53   5.439   3.545  -5.648
  395   1HB   ASP  53          2HB       ASP  53   7.040   2.980  -3.758
  396   2HB   ASP  53          1HB       ASP  53   8.054   2.110  -4.969
  397    H    GLY  54           H        GLY  54   4.681   1.110  -7.130
  398   1HA   GLY  54          2HA       GLY  54   4.599   0.734  -9.379
  399   2HA   GLY  54          1HA       GLY  54   6.112   1.665  -9.616
  400    H    VAL  55           H        VAL  55   6.701  -0.436  -7.007
  401    HA   VAL  55           HA       VAL  55   8.129  -2.118  -8.903
  402    HB   VAL  55           HB       VAL  55   8.687  -1.693  -5.961
  403   1HG1  VAL  55          1HG1      VAL  55   9.571  -3.847  -6.932
  404   2HG1  VAL  55          2HG1      VAL  55  10.915  -2.679  -6.665
  405   3HG1  VAL  55          3HG1      VAL  55  10.264  -2.936  -8.326
  406   1HG2  VAL  55          1HG2      VAL  55   8.961   0.478  -7.145
  407   2HG2  VAL  55          2HG2      VAL  55   9.904  -0.332  -8.454
  408   3HG2  VAL  55          3HG2      VAL  55  10.563  -0.237  -6.784
  409    H    ASN  56           H        ASN  56   7.556  -4.219  -9.094
  410    HA   ASN  56           HA       ASN  56   5.346  -5.164  -7.739
  411   1HB   ASN  56          2HB       ASN  56   5.558  -7.181  -8.920
  412   2HB   ASN  56          1HB       ASN  56   6.111  -5.865 -10.033
  413   1HD2  ASN  56          1HD2      ASN  56   8.670  -5.622 -10.109
  414   2HD2  ASN  56          2HD2      ASN  56   9.616  -7.030  -9.683
  415    H    THR  57           H        THR  57   4.927  -6.506  -6.096
  416    HA   THR  57           HA       THR  57   6.857  -6.474  -4.076
  417    HB   THR  57           HB       THR  57   5.034  -7.466  -2.673
  418    HG1  THR  57           1HG      THR  57   3.514  -7.060  -5.016
  419   1HG2  THR  57          1HG2      THR  57   3.586  -5.460  -2.846
  420   2HG2  THR  57          2HG2      THR  57   4.306  -5.018  -4.434
  421   3HG2  THR  57          3HG2      THR  57   5.324  -4.999  -2.950
  422    H    ASP  58           H        ASP  58   8.033  -8.127  -5.848
  423    HA   ASP  58           HA       ASP  58   7.631 -10.807  -4.942
  424   1HB   ASP  58          2HB       ASP  58   8.621  -9.902  -7.244
  425   2HB   ASP  58          1HB       ASP  58  10.189  -9.935  -6.375
  426    H    THR  59           H        THR  59  10.400  -8.554  -4.425
  427    HA   THR  59           HA       THR  59  11.053 -10.189  -2.086
  428    HB   THR  59           HB       THR  59  12.827  -9.926  -3.784
  429    HG1  THR  59           1HG      THR  59  13.173  -8.735  -1.279
  430   1HG2  THR  59          1HG2      THR  59  12.791  -6.946  -2.908
  431   2HG2  THR  59          2HG2      THR  59  12.331  -7.576  -4.542
  432   3HG2  THR  59          3HG2      THR  59  14.016  -7.746  -3.945
  433    H    MET  60           H        MET  60   9.140  -7.700  -2.568
  434    HA   MET  60           HA       MET  60  10.022  -5.990  -0.446
  435   1HB   MET  60          2HB       MET  60   7.648  -6.283  -2.275
  436   2HB   MET  60          1HB       MET  60   7.401  -5.361  -0.762
  437   1HG   MET  60          2HG       MET  60   7.951  -3.580  -1.875
  438   2HG   MET  60          1HG       MET  60   9.626  -4.063  -1.531
  439   1HE   MET  60          1HE       MET  60  10.717  -6.063  -3.713
  440   2HE   MET  60          2HE       MET  60  11.314  -4.503  -3.050
  441   3HE   MET  60          3HE       MET  60  11.219  -4.758  -4.828
  442    H    THR  61           H        THR  61   9.863  -6.401   1.634
  443    HA   THR  61           HA       THR  61   7.983  -8.405   2.583
  444    HB   THR  61           HB       THR  61   9.377  -8.231   4.664
  445    HG1  THR  61           1HG      THR  61  11.419  -7.106   4.159
  446   1HG2  THR  61          1HG2      THR  61   9.881  -9.889   2.856
  447   2HG2  THR  61          2HG2      THR  61  11.379  -9.301   3.652
  448   3HG2  THR  61          3HG2      THR  61  10.923  -8.681   2.021
  449    H    HIS  62           H        HIS  62   7.271  -7.779   4.968
  450    HA   HIS  62           HA       HIS  62   5.594  -5.657   5.007
  451   1HB   HIS  62          2HB       HIS  62   5.735  -7.667   6.577
  452   2HB   HIS  62          1HB       HIS  62   7.051  -6.822   7.441
  453    HD1  HIS  62           1HD      HIS  62   3.331  -6.919   6.969
  454    HD2  HIS  62           2HD      HIS  62   6.133  -4.565   9.007
  455    HE1  HIS  62           1HE      HIS  62   2.053  -5.391   8.580
  456    H    LEU  63           H        LEU  63   8.955  -5.747   6.225
  457    HA   LEU  63           HA       LEU  63   9.047  -3.045   6.983
  458   1HB   LEU  63          2HB       LEU  63  10.566  -4.800   7.854
  459   2HB   LEU  63          1HB       LEU  63  11.285  -4.974   6.225
  460    HG   LEU  63           HG       LEU  63  12.002  -2.553   6.320
  461   1HD1  LEU  63          1HD1      LEU  63  10.434  -1.614   7.987
  462   2HD1  LEU  63          2HD1      LEU  63  12.121  -1.428   8.564
  463   3HD1  LEU  63          3HD1      LEU  63  11.070  -2.714   9.265
  464   1HD2  LEU  63          1HD2      LEU  63  13.541  -4.396   6.800
  465   2HD2  LEU  63          2HD2      LEU  63  13.108  -4.357   8.554
  466   3HD2  LEU  63          3HD2      LEU  63  13.928  -2.937   7.786
  467    H    GLU  64           H        GLU  64  10.296  -4.647   3.948
  468    HA   GLU  64           HA       GLU  64  11.366  -2.306   3.024
  469   1HB   GLU  64          2HB       GLU  64  11.374  -4.890   2.095
  470   2HB   GLU  64          1HB       GLU  64  10.306  -4.125   0.879
  471   1HG   GLU  64          2HG       GLU  64  12.135  -2.249   0.726
  472   2HG   GLU  64          1HG       GLU  64  13.131  -3.312   1.776
  473    H    ALA  65           H        ALA  65   8.072  -3.563   2.422
  474    HA   ALA  65           HA       ALA  65   7.378  -1.556   0.588
  475   1HB   ALA  65          1HB       ALA  65   6.322  -3.752   0.756
  476   2HB   ALA  65          2HB       ALA  65   5.047  -2.498   1.068
  477   3HB   ALA  65          3HB       ALA  65   5.775  -3.418   2.440
  478    H    GLN  66           H        GLN  66   7.037  -1.747   4.113
  479    HA   GLN  66           HA       GLN  66   5.663   0.606   4.566
  480   1HB   GLN  66          2HB       GLN  66   6.114  -1.053   6.334
  481   2HB   GLN  66          1HB       GLN  66   7.841  -0.948   6.016
  482   1HG   GLN  66          2HG       GLN  66   7.831   0.159   7.939
  483   2HG   GLN  66          1HG       GLN  66   7.669   1.583   6.896
  484   1HE2  GLN  66          1HE2      GLN  66   5.106   2.016   6.401
  485   2HE2  GLN  66          2HE2      GLN  66   4.122   1.998   7.848
  486    H    ASN  67           H        ASN  67   9.166   0.010   4.273
  487    HA   ASN  67           HA       ASN  67   9.921   2.687   4.454
  488   1HB   ASN  67          2HB       ASN  67  11.253   0.103   3.531
  489   2HB   ASN  67          1HB       ASN  67  12.131   1.668   3.421
  490   1HD2  ASN  67          1HD2      ASN  67  13.609   0.513   4.961
  491   2HD2  ASN  67          2HD2      ASN  67  13.257   0.703   6.644
  492    H    LYS  68           H        LYS  68   9.136   0.777   1.536
  493    HA   LYS  68           HA       LYS  68  10.032   2.752  -0.215
  494   1HB   LYS  68          2HB       LYS  68   7.903   0.608  -0.670
  495   2HB   LYS  68          1HB       LYS  68   8.602   1.679  -1.929
  496   1HG   LYS  68          2HG       LYS  68  10.927   0.728  -0.923
  497   2HG   LYS  68          1HG       LYS  68   9.873  -0.668  -0.532
  498   1HD   LYS  68          2HD       LYS  68   9.050  -0.591  -2.963
  499   2HD   LYS  68          1HD       LYS  68  10.346   0.592  -3.303
  500   1HE   LYS  68          2HE       LYS  68  10.743  -2.258  -2.160
  501   2HE   LYS  68          1HE       LYS  68  10.960  -1.808  -3.895
  502   1HZ   LYS  68          1HZ       LYS  68  12.860  -0.593  -3.386
  503   2HZ   LYS  68          2HZ       LYS  68  12.947  -1.946  -2.342
  504   3HZ   LYS  68          3HZ       LYS  68  12.538  -0.454  -1.745
  505    H    ILE  69           H        ILE  69   6.621   2.225   0.982
  506    HA   ILE  69           HA       ILE  69   5.530   4.495   0.028
  507    HB   ILE  69           HB       ILE  69   5.208   2.865   2.555
  508   1HG1  ILE  69          2HG1      ILE  69   3.564   3.399   0.012
  509   2HG1  ILE  69          1HG1      ILE  69   4.429   1.895   0.323
  510   1HG2  ILE  69          1HG2      ILE  69   4.556   5.129   3.249
  511   2HG2  ILE  69          2HG2      ILE  69   3.070   4.203   2.937
  512   3HG2  ILE  69          3HG2      ILE  69   3.648   5.374   1.705
  513   1HD1  ILE  69          1HD1      ILE  69   2.983   1.373   2.290
  514   2HD1  ILE  69          2HD1      ILE  69   2.086   1.484   0.738
  515   3HD1  ILE  69          3HD1      ILE  69   1.970   2.820   1.923
  516    H    LYS  70           H        LYS  70   7.576   4.216   2.934
  517    HA   LYS  70           HA       LYS  70   7.228   6.924   3.639
  518   1HB   LYS  70          2HB       LYS  70   8.721   4.513   4.559
  519   2HB   LYS  70          1HB       LYS  70   9.496   6.051   4.994
  520   1HG   LYS  70          2HG       LYS  70   8.016   5.185   6.757
  521   2HG   LYS  70          1HG       LYS  70   7.634   6.843   6.200
  522   1HD   LYS  70          2HD       LYS  70   5.661   6.030   4.941
  523   2HD   LYS  70          1HD       LYS  70   6.088   4.338   5.287
  524   1HE   LYS  70          2HE       LYS  70   4.225   5.214   6.735
  525   2HE   LYS  70          1HE       LYS  70   5.639   4.633   7.701
  526   1HZ   LYS  70          1HZ       LYS  70   5.249   7.489   6.944
  527   2HZ   LYS  70          2HZ       LYS  70   6.351   6.836   8.043
  528   3HZ   LYS  70          3HZ       LYS  70   4.736   6.822   8.433
  529    H    SER  71           H        SER  71   9.045   5.756   1.050
  530    HA   SER  71           HA       SER  71  11.074   7.827   1.419
  531   1HB   SER  71          2HB       SER  71  11.787   5.530   0.752
  532   2HB   SER  71          1HB       SER  71  10.867   5.700  -0.767
  533    HG   SER  71           HG       SER  71  12.275   7.192  -1.440
  534    H    ALA  72           H        ALA  72   7.975   7.562   0.319
  535    HA   ALA  72           HA       ALA  72   8.367   9.316  -1.996
  536   1HB   ALA  72          1HB       ALA  72   7.233   7.129  -2.328
  537   2HB   ALA  72          2HB       ALA  72   6.074   8.481  -2.605
  538   3HB   ALA  72          3HB       ALA  72   6.050   7.544  -1.050
  539    H    SER  73           H        SER  73   7.157  11.135  -2.293
  540    HA   SER  73           HA       SER  73   5.232  12.047  -0.397
  541   1HB   SER  73          2HB       SER  73   6.371  14.258   0.054
  542   2HB   SER  73          1HB       SER  73   7.066  12.849   0.904
  543    HG   SER  73           HG       SER  73   8.843  13.198  -0.027
  544    H    TYR  74           H        TYR  74   7.500  13.251  -2.812
  545    HA   TYR  74           HA       TYR  74   5.793  14.785  -4.286
  546   1HB   TYR  74          2HB       TYR  74   7.531  14.522  -6.133
  547   2HB   TYR  74          1HB       TYR  74   8.134  15.073  -4.544
  548    HD1  TYR  74           1HD      TYR  74   8.092  12.310  -6.922
  549    HD2  TYR  74           2HD      TYR  74   9.473  13.655  -3.142
  550    HE1  TYR  74           1HE      TYR  74   9.604  10.389  -6.799
  551    HE2  TYR  74           2HE      TYR  74  10.984  11.736  -3.005
  552    HH   TYR  74           HH       TYR  74  11.278   9.420  -5.672
  553    H    ASN  75           H        ASN  75   6.389  11.266  -4.771
  554    HA   ASN  75           HA       ASN  75   3.671  11.180  -5.480
  555   1HB   ASN  75          2HB       ASN  75   3.861   9.959  -7.653
  556   2HB   ASN  75          1HB       ASN  75   4.350  11.675  -7.737
  557   1HD2  ASN  75          1HD2      ASN  75   5.934   8.399  -7.167
  558   2HD2  ASN  75          2HD2      ASN  75   7.155   8.711  -8.353
  559    H    LEU  76           H        LEU  76   2.762   9.325  -4.824
  560    HA   LEU  76           HA       LEU  76   4.486   6.987  -4.412
  561   1HB   LEU  76          2HB       LEU  76   3.898   8.091  -2.262
  562   2HB   LEU  76          1HB       LEU  76   2.182   8.097  -2.720
  563    HG   LEU  76           HG       LEU  76   2.083   5.638  -2.608
  564   1HD1  LEU  76          1HD1      LEU  76   5.031   5.740  -1.695
  565   2HD1  LEU  76          2HD1      LEU  76   4.488   5.098  -3.299
  566   3HD1  LEU  76          3HD1      LEU  76   3.991   4.275  -1.778
  567   1HD2  LEU  76          1HD2      LEU  76   2.350   5.377  -0.161
  568   2HD2  LEU  76          2HD2      LEU  76   1.720   7.027  -0.521
  569   3HD2  LEU  76          3HD2      LEU  76   3.454   6.792  -0.097
  570    H    SER  77           H        SER  77   3.954   5.875  -6.267
  571    HA   SER  77           HA       SER  77   1.175   5.507  -6.977
  572   1HB   SER  77          2HB       SER  77   2.819   5.963  -8.731
  573   2HB   SER  77          1HB       SER  77   3.804   4.576  -8.185
  574    HG   SER  77           HG       SER  77   1.307   4.538  -9.541
  575    H    LEU  78           H        LEU  78  -0.047   3.965  -6.084
  576    HA   LEU  78           HA       LEU  78   1.230   1.393  -5.398
  577   1HB   LEU  78          2HB       LEU  78  -1.322   2.778  -4.491
  578   2HB   LEU  78          1HB       LEU  78  -1.089   1.037  -4.244
  579    HG   LEU  78           HG       LEU  78  -0.503   2.972  -2.412
  580   1HD1  LEU  78          1HD1      LEU  78   0.554   1.058  -1.147
  581   2HD1  LEU  78          2HD1      LEU  78   0.660   0.136  -2.696
  582   3HD1  LEU  78          3HD1      LEU  78  -0.955   0.568  -2.014
  583   1HD2  LEU  78          1HD2      LEU  78   1.921   2.930  -1.929
  584   2HD2  LEU  78          2HD2      LEU  78   1.587   3.759  -3.490
  585   3HD2  LEU  78          3HD2      LEU  78   2.246   2.078  -3.478
  586    H    THR  79           H        THR  79   0.331  -0.489  -6.184
  587    HA   THR  79           HA       THR  79  -2.100  -0.323  -7.746
  588    HB   THR  79           HB       THR  79   0.352  -1.945  -8.574
  589    HG1  THR  79           1HG      THR  79   0.025   0.485  -9.001
  590   1HG2  THR  79          1HG2      THR  79  -2.477  -1.582  -9.758
  591   2HG2  THR  79          2HG2      THR  79  -1.788  -3.107  -9.056
  592   3HG2  THR  79          3HG2      THR  79  -1.109  -2.434 -10.584
  593    H    LEU  80           H        LEU  80  -3.472  -1.575  -6.442
  594    HA   LEU  80           HA       LEU  80  -2.542  -4.165  -5.470
  595   1HB   LEU  80          2HB       LEU  80  -3.742  -3.907  -3.444
  596   2HB   LEU  80          1HB       LEU  80  -2.629  -2.486  -3.602
  597    HG   LEU  80           HG       LEU  80  -5.603  -2.666  -4.146
  598   1HD1  LEU  80          1HD1      LEU  80  -4.703  -2.725  -1.734
  599   2HD1  LEU  80          2HD1      LEU  80  -5.936  -1.407  -2.102
  600   3HD1  LEU  80          3HD1      LEU  80  -4.159  -1.000  -2.034
  601   1HD2  LEU  80          1HD2      LEU  80  -3.442  -0.532  -4.429
  602   2HD2  LEU  80          2HD2      LEU  80  -5.134   0.064  -4.013
  603   3HD2  LEU  80          3HD2      LEU  80  -4.831  -0.852  -5.572
  604    H    GLN  81           H        GLN  81  -4.610  -5.576  -4.957
  605    HA   GLN  81           HA       GLN  81  -6.151  -5.426  -7.332
  606   1HB   GLN  81          2HB       GLN  81  -6.403  -7.316  -5.004
  607   2HB   GLN  81          1HB       GLN  81  -7.277  -7.421  -6.574
  608   1HG   GLN  81          2HG       GLN  81  -5.072  -7.591  -7.783
  609   2HG   GLN  81          1HG       GLN  81  -4.229  -7.644  -6.185
  610   1HE2  GLN  81          1HE2      GLN  81  -3.732  -9.750  -7.721
  611   2HE2  GLN  81          2HE2      GLN  81  -4.610 -11.154  -7.177
  612    H    LYS  82           H        LYS  82  -8.429  -5.451  -7.585
  613    HA   LYS  82           HA       LYS  82  -9.729  -3.547  -5.980
  614   1HB   LYS  82          2HB       LYS  82  -9.829  -4.096  -8.576
  615   2HB   LYS  82          1HB       LYS  82 -11.069  -5.284  -8.104
  616   1HG   LYS  82          2HG       LYS  82 -12.269  -3.247  -8.633
  617   2HG   LYS  82          1HG       LYS  82 -12.216  -3.274  -6.848
  618   1HD   LYS  82          2HD       LYS  82  -9.826  -2.022  -7.417
  619   2HD   LYS  82          1HD       LYS  82 -10.751  -1.527  -8.856
  620   1HE   LYS  82          2HE       LYS  82 -12.587  -0.596  -7.346
  621   2HE   LYS  82          1HE       LYS  82 -11.609  -1.080  -5.905
  622   1HZ   LYS  82          1HZ       LYS  82  -9.864   0.432  -6.662
  623   2HZ   LYS  82          2HZ       LYS  82 -11.323   1.246  -6.471
  624   3HZ   LYS  82          3HZ       LYS  82 -10.776   0.872  -8.014
  625    H    SER  83           H        SER  83 -10.009  -4.302  -3.928
  626    HA   SER  83           HA       SER  83 -11.427  -6.599  -3.286
  627   1HB   SER  83          2HB       SER  83  -9.970  -5.146  -1.816
  628   2HB   SER  83          1HB       SER  83 -11.352  -4.020  -1.647
  629    HG   SER  83           HG       SER  83 -11.006  -5.722  -0.026
  630    H    LYS  84           H        LYS  84 -13.415  -6.102  -1.628
  631    HA   LYS  84           HA       LYS  84 -15.588  -5.489  -3.466
  632   1HB   LYS  84          2HB       LYS  84 -15.435  -7.037  -0.878
  633   2HB   LYS  84          1HB       LYS  84 -17.011  -6.478  -1.537
  634   1HG   LYS  84          2HG       LYS  84 -16.649  -7.590  -3.652
  635   2HG   LYS  84          1HG       LYS  84 -14.989  -8.080  -3.183
  636   1HD   LYS  84          2HD       LYS  84 -15.841  -9.616  -1.493
  637   2HD   LYS  84          1HD       LYS  84 -17.510  -8.999  -1.673
  638   1HE   LYS  84          2HE       LYS  84 -17.099 -11.246  -2.808
  639   2HE   LYS  84          1HE       LYS  84 -17.732  -9.962  -3.917
  640   1HZ   LYS  84          1HZ       LYS  84 -15.793 -11.327  -4.742
  641   2HZ   LYS  84          2HZ       LYS  84 -14.827 -10.527  -3.624
  642   3HZ   LYS  84          3HZ       LYS  84 -15.618  -9.642  -4.826
  643    H    ARG  85           H        ARG  85 -16.462  -3.616  -3.593
  644    HA   ARG  85           HA       ARG  85 -17.137  -2.168  -1.209
  645   1HB   ARG  85          2HB       ARG  85 -14.905  -1.442  -2.698
  646   2HB   ARG  85          1HB       ARG  85 -16.164  -0.508  -3.537
  647   1HG   ARG  85          2HG       ARG  85 -15.529  -0.470  -0.516
  648   2HG   ARG  85          1HG       ARG  85 -14.917   0.713  -1.716
  649   1HD   ARG  85          2HD       ARG  85 -17.238   1.537  -2.144
  650   2HD   ARG  85          1HD       ARG  85 -17.892   0.334  -0.960
  651    HE   ARG  85           HE       ARG  85 -16.590   1.373   0.816
  652   1HH1  ARG  85          1HH1      ARG  85 -16.887   3.609  -1.922
  653   2HH1  ARG  85          2HH1      ARG  85 -15.570   4.609  -1.378
  654   1HH2  ARG  85          1HH2      ARG  85 -15.121   2.912   1.661
  655   2HH2  ARG  85          2HH2      ARG  85 -14.659   4.273   0.709
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1  -6.750  -7.893 -11.489
    2   2H    MET   1          2HT       MET   1  -8.061  -8.334 -12.446
    3   3H    MET   1          3HT       MET   1  -8.172  -8.412 -10.767
    4    HA   MET   1           HA       MET   1  -7.918  -5.971 -12.392
    5   1HB   MET   1          2HB       MET   1 -10.191  -6.916 -12.350
    6   2HB   MET   1          1HB       MET   1 -10.143  -7.020 -10.567
    7   1HG   MET   1          2HG       MET   1 -11.516  -5.145 -11.368
    8   2HG   MET   1          1HG       MET   1 -10.168  -4.593 -10.347
    9   1HE   MET   1          1HE       MET   1 -10.801  -1.617 -12.681
   10   2HE   MET   1          2HE       MET   1 -10.536  -2.196 -11.001
   11   3HE   MET   1          3HE       MET   1 -11.953  -2.777 -11.944
   12    H    ALA   2           H        ALA   2  -6.305  -4.765 -11.556
   13    HA   ALA   2           HA       ALA   2  -6.526  -4.101  -8.712
   14   1HB   ALA   2          1HB       ALA   2  -4.369  -5.240  -9.168
   15   2HB   ALA   2          2HB       ALA   2  -4.056  -3.500  -8.886
   16   3HB   ALA   2          3HB       ALA   2  -4.058  -4.148 -10.567
   17    H    TYR   3           H        TYR   3  -5.507  -1.906  -8.286
   18    HA   TYR   3           HA       TYR   3  -6.235  -0.036 -10.394
   19   1HB   TYR   3          2HB       TYR   3  -7.610   1.303  -9.148
   20   2HB   TYR   3          1HB       TYR   3  -8.213  -0.351  -8.826
   21    HD1  TYR   3           1HD      TYR   3  -7.468   2.655  -7.521
   22    HD2  TYR   3           2HD      TYR   3  -6.943  -1.456  -6.535
   23    HE1  TYR   3           1HE      TYR   3  -7.425   3.228  -5.124
   24    HE2  TYR   3           2HE      TYR   3  -6.967  -0.908  -4.190
   25    HH   TYR   3           HH       TYR   3  -7.177   0.743  -2.632
   26    H    SER   4           H        SER   4  -5.170   1.996 -10.266
   27    HA   SER   4           HA       SER   4  -2.869   1.991  -8.449
   28   1HB   SER   4          2HB       SER   4  -2.301   1.325 -10.909
   29   2HB   SER   4          1HB       SER   4  -2.641   3.038 -11.309
   30    HG   SER   4           HG       SER   4  -0.530   3.029 -10.766
   31    H    VAL   5           H        VAL   5  -2.727   3.840  -7.310
   32    HA   VAL   5           HA       VAL   5  -3.849   6.257  -8.448
   33    HB   VAL   5           HB       VAL   5  -5.675   5.734  -7.191
   34   1HG1  VAL   5          1HG1      VAL   5  -5.589   4.966  -4.827
   35   2HG1  VAL   5          2HG1      VAL   5  -3.810   4.684  -5.001
   36   3HG1  VAL   5          3HG1      VAL   5  -4.992   3.761  -6.026
   37   1HG2  VAL   5          1HG2      VAL   5  -5.744   7.342  -5.357
   38   2HG2  VAL   5          2HG2      VAL   5  -4.808   8.050  -6.724
   39   3HG2  VAL   5          3HG2      VAL   5  -3.956   7.417  -5.264
   40    H    THR   6           H        THR   6  -2.783   8.048  -8.027
   41    HA   THR   6           HA       THR   6  -0.157   7.723  -6.784
   42    HB   THR   6           HB       THR   6  -1.112   9.885  -8.674
   43    HG1  THR   6           1HG      THR   6   0.526   7.663  -9.221
   44   1HG2  THR   6          1HG2      THR   6   0.925  10.510  -7.282
   45   2HG2  THR   6          2HG2      THR   6   1.380  10.225  -8.993
   46   3HG2  THR   6          3HG2      THR   6   1.718   8.963  -7.758
   47    H    LEU   7           H        LEU   7   0.043   8.584  -4.773
   48    HA   LEU   7           HA       LEU   7  -1.850  10.603  -3.939
   49   1HB   LEU   7          2HB       LEU   7  -1.240   8.285  -2.878
   50   2HB   LEU   7          1HB       LEU   7   0.243   9.079  -2.305
   51    HG   LEU   7           HG       LEU   7  -1.152  10.684  -0.984
   52   1HD1  LEU   7          1HD1      LEU   7  -3.649  10.119  -0.698
   53   2HD1  LEU   7          2HD1      LEU   7  -3.508   9.032  -2.122
   54   3HD1  LEU   7          3HD1      LEU   7  -3.247  10.810  -2.309
   55   1HD2  LEU   7          1HD2      LEU   7  -1.929   8.941   0.683
   56   2HD2  LEU   7          2HD2      LEU   7  -0.323   8.527  -0.034
   57   3HD2  LEU   7          3HD2      LEU   7  -1.805   7.685  -0.607
   58    H    THR   8           H        THR   8  -1.199  12.542  -2.861
   59    HA   THR   8           HA       THR   8   1.510  13.418  -3.526
   60    HB   THR   8           HB       THR   8  -0.253  14.470  -4.900
   61    HG1  THR   8           1HG      THR   8   0.435  16.568  -4.464
   62   1HG2  THR   8          1HG2      THR   8  -1.066  15.861  -2.254
   63   2HG2  THR   8          2HG2      THR   8  -2.036  14.580  -3.088
   64   3HG2  THR   8          3HG2      THR   8  -1.735  16.153  -3.898
   65    H    GLY   9           H        GLY   9   2.151  15.263  -2.126
   66   1HA   GLY   9          2HA       GLY   9   2.959  14.182   0.093
   67   2HA   GLY   9          1HA       GLY   9   2.922  15.932  -0.196
   68    HA   PRO  10           HA       PRO  10   1.195  16.757   3.277
   69   1HB   PRO  10          2HB       PRO  10  -1.525  17.715   2.323
   70   2HB   PRO  10          1HB       PRO  10  -0.345  18.562   3.399
   71   1HG   PRO  10          2HG       PRO  10  -0.483  19.224   0.737
   72   2HG   PRO  10          1HG       PRO  10   1.143  19.005   1.522
   73   1HD   PRO  10          2HD       PRO  10  -0.414  16.988  -0.201
   74   2HD   PRO  10          1HD       PRO  10   1.345  17.450  -0.249
   75    H    GLY  11           H        GLY  11   1.007  15.100   4.613
   76   1HA   GLY  11          2HA       GLY  11  -0.591  14.248   6.277
   77   2HA   GLY  11          1HA       GLY  11  -1.632  13.806   4.901
   78    HA   PRO  12           HA       PRO  12   2.083  11.106   4.446
   79   1HB   PRO  12          2HB       PRO  12   3.743  10.463   6.526
   80   2HB   PRO  12          1HB       PRO  12   3.750  12.084   5.744
   81   1HG   PRO  12          2HG       PRO  12   2.183  11.277   8.264
   82   2HG   PRO  12          1HG       PRO  12   3.383  12.639   8.105
   83   1HD   PRO  12          2HD       PRO  12   0.653  13.036   7.750
   84   2HD   PRO  12          1HD       PRO  12   1.869  13.898   6.696
   85    H    TRP  13           H        TRP  13  -0.123  10.027   4.465
   86    HA   TRP  13           HA       TRP  13  -1.281   8.173   4.575
   87   1HB   TRP  13          2HB       TRP  13   0.592   6.223   3.841
   88   2HB   TRP  13          1HB       TRP  13  -0.449   7.098   2.834
   89    HD1  TRP  13           HD       TRP  13   3.036   6.417   3.670
   90    HE1  TRP  13           1HE      TRP  13   4.598   7.661   2.002
   91    HE3  TRP  13           3HE      TRP  13  -0.130  10.077   2.194
   92    HZ2  TRP  13           2HZ      TRP  13   4.555  10.067   0.577
   93    HZ3  TRP  13           3HZ      TRP  13   0.745  11.933   0.890
   94    HH2  TRP  13           HH       TRP  13   3.057  11.933   0.065
   95    H    GLY  14           H        GLY  14  -2.059   7.964   6.623
   96   1HA   GLY  14          2HA       GLY  14  -0.692   6.139   8.407
   97   2HA   GLY  14          1HA       GLY  14  -2.170   7.102   8.691
   98    H    PHE  15           H        PHE  15  -1.056   4.385   6.663
   99    HA   PHE  15           HA       PHE  15  -3.632   3.042   7.069
  100   1HB   PHE  15          2HB       PHE  15  -2.966   1.739   5.012
  101   2HB   PHE  15          1HB       PHE  15  -2.904   3.487   4.740
  102    HD1  PHE  15           1HD      PHE  15  -0.843   4.619   4.465
  103    HD2  PHE  15           2HD      PHE  15  -0.837   0.455   5.316
  104    HE1  PHE  15           1HE      PHE  15   1.596   4.522   4.079
  105    HE2  PHE  15           2HE      PHE  15   1.499   0.326   4.644
  106    HZ   PHE  15           HZ       PHE  15   2.758   2.366   4.164
  107    H    ARG  16           H        ARG  16  -3.491   0.549   7.084
  108    HA   ARG  16           HA       ARG  16  -1.767   0.041   9.375
  109   1HB   ARG  16          2HB       ARG  16  -4.664  -0.658   8.837
  110   2HB   ARG  16          1HB       ARG  16  -3.667  -1.755   9.837
  111   1HG   ARG  16          2HG       ARG  16  -4.748  -0.402  11.365
  112   2HG   ARG  16          1HG       ARG  16  -3.042   0.131  11.333
  113   1HD   ARG  16          2HD       ARG  16  -3.837   2.137   9.828
  114   2HD   ARG  16          1HD       ARG  16  -5.518   1.552  10.123
  115    HE   ARG  16           HE       ARG  16  -5.337   2.153  12.402
  116   1HH1  ARG  16          1HH1      ARG  16  -2.180   2.708  10.796
  117   2HH1  ARG  16          2HH1      ARG  16  -1.489   3.469  12.198
  118   1HH2  ARG  16          1HH2      ARG  16  -4.092   2.709  14.353
  119   2HH2  ARG  16          2HH2      ARG  16  -2.706   3.701  14.138
  120    H    LEU  17           H        LEU  17  -0.326  -1.552   9.178
  121    HA   LEU  17           HA       LEU  17  -0.475  -3.083   6.717
  122   1HB   LEU  17          2HB       LEU  17   1.885  -2.568   8.599
  123   2HB   LEU  17          1HB       LEU  17   1.938  -3.522   7.089
  124    HG   LEU  17           HG       LEU  17   0.942  -1.380   5.936
  125   1HD1  LEU  17          1HD1      LEU  17   2.007   0.728   7.090
  126   2HD1  LEU  17          2HD1      LEU  17   2.099  -0.300   8.581
  127   3HD1  LEU  17          3HD1      LEU  17   0.493   0.066   7.813
  128   1HD2  LEU  17          1HD2      LEU  17   3.156  -2.401   5.463
  129   2HD2  LEU  17          2HD2      LEU  17   3.853  -1.582   6.916
  130   3HD2  LEU  17          3HD2      LEU  17   3.259  -0.602   5.511
  131    H    GLN  18           H        GLN  18  -0.967  -5.238   6.744
  132    HA   GLN  18           HA       GLN  18  -0.024  -6.794   9.023
  133   1HB   GLN  18          2HB       GLN  18  -2.905  -6.799   8.021
  134   2HB   GLN  18          1HB       GLN  18  -2.180  -8.082   9.051
  135   1HG   GLN  18          2HG       GLN  18  -1.594  -6.242  10.759
  136   2HG   GLN  18          1HG       GLN  18  -2.554  -5.102   9.767
  137   1HE2  GLN  18          1HE2      GLN  18  -2.849  -8.378  11.327
  138   2HE2  GLN  18          2HE2      GLN  18  -4.459  -8.119  11.907
  139    H    GLY  19           H        GLY  19   1.258  -8.283   8.299
  140   1HA   GLY  19          2HA       GLY  19   1.706 -10.210   7.293
  141   2HA   GLY  19          1HA       GLY  19   0.362  -9.983   6.139
  142    H    GLY  20           H        GLY  20   2.767 -11.103   5.436
  143   1HA   GLY  20          2HA       GLY  20   3.099  -9.934   3.062
  144   2HA   GLY  20          1HA       GLY  20   4.505  -9.370   4.069
  145    H    LYS  21           H        LYS  21   5.455 -10.919   2.150
  146    HA   LYS  21           HA       LYS  21   5.107 -13.584   2.330
  147   1HB   LYS  21          2HB       LYS  21   6.843 -11.845   0.875
  148   2HB   LYS  21          1HB       LYS  21   7.869 -13.113   1.571
  149   1HG   LYS  21          2HG       LYS  21   7.206 -14.040  -0.474
  150   2HG   LYS  21          1HG       LYS  21   6.115 -14.816   0.702
  151   1HD   LYS  21          2HD       LYS  21   4.476 -12.772   0.076
  152   2HD   LYS  21          1HD       LYS  21   5.588 -12.554  -1.297
  153   1HE   LYS  21          2HE       LYS  21   3.707 -13.835  -2.096
  154   2HE   LYS  21          1HE       LYS  21   5.108 -14.976  -2.014
  155   1HZ   LYS  21          1HZ       LYS  21   4.229 -15.935  -0.063
  156   2HZ   LYS  21          2HZ       LYS  21   2.927 -15.781  -1.090
  157   3HZ   LYS  21          3HZ       LYS  21   3.108 -14.689   0.185
  158    H    ASP  22           H        ASP  22   7.066 -11.719   4.521
  159    HA   ASP  22           HA       ASP  22   8.586 -13.717   5.642
  160   1HB   ASP  22          2HB       ASP  22   8.746 -11.230   5.899
  161   2HB   ASP  22          1HB       ASP  22   7.248 -11.257   6.895
  162    H    PHE  23           H        PHE  23   5.130 -13.089   6.066
  163    HA   PHE  23           HA       PHE  23   4.989 -15.188   8.114
  164   1HB   PHE  23          2HB       PHE  23   3.354 -12.696   7.403
  165   2HB   PHE  23          1HB       PHE  23   2.551 -14.060   8.246
  166    HD1  PHE  23           1HD      PHE  23   3.474 -14.948  10.337
  167    HD2  PHE  23           2HD      PHE  23   4.770 -11.264   8.676
  168    HE1  PHE  23           1HE      PHE  23   4.287 -14.251  12.539
  169    HE2  PHE  23           2HE      PHE  23   5.559 -10.546  10.889
  170    HZ   PHE  23           HZ       PHE  23   5.324 -12.048  12.824
  171    H    ASN  24           H        ASN  24   5.191 -15.409   5.030
  172    HA   ASN  24           HA       ASN  24   4.320 -16.510   3.403
  173   1HB   ASN  24          2HB       ASN  24   3.043 -18.165   5.636
  174   2HB   ASN  24          1HB       ASN  24   3.094 -18.655   3.905
  175   1HD2  ASN  24          1HD2      ASN  24   4.210 -20.259   5.866
  176   2HD2  ASN  24          2HD2      ASN  24   5.936 -20.292   5.599
  177    H    MET  25           H        MET  25   3.056 -14.179   3.720
  178    HA   MET  25           HA       MET  25   0.278 -14.777   3.001
  179   1HB   MET  25          2HB       MET  25   1.630 -12.412   4.361
  180   2HB   MET  25          1HB       MET  25  -0.014 -12.267   3.817
  181   1HG   MET  25          2HG       MET  25  -0.380 -14.520   5.269
  182   2HG   MET  25          1HG       MET  25   1.123 -13.988   6.066
  183   1HE   MET  25          1HE       MET  25  -1.447 -13.268   8.770
  184   2HE   MET  25          2HE       MET  25   0.174 -13.906   8.339
  185   3HE   MET  25          3HE       MET  25  -1.296 -14.638   7.618
  186    HA   PRO  26           HA       PRO  26   1.377 -11.964  -0.433
  187   1HB   PRO  26          2HB       PRO  26  -1.177 -10.601  -0.590
  188   2HB   PRO  26          1HB       PRO  26  -0.644 -12.000  -1.550
  189   1HG   PRO  26          2HG       PRO  26  -2.699 -11.979   0.515
  190   2HG   PRO  26          1HG       PRO  26  -2.111 -13.344  -0.487
  191   1HD   PRO  26          2HD       PRO  26  -1.307 -12.339   2.283
  192   2HD   PRO  26          1HD       PRO  26  -1.260 -14.070   1.769
  193    H    LEU  27           H        LEU  27   1.778  -9.577  -0.607
  194    HA   LEU  27           HA       LEU  27   2.048  -8.335   1.909
  195   1HB   LEU  27          2HB       LEU  27   3.147  -8.123  -0.579
  196   2HB   LEU  27          1HB       LEU  27   2.143  -6.655  -0.594
  197    HG   LEU  27           HG       LEU  27   4.172  -7.506   1.554
  198   1HD1  LEU  27          1HD1      LEU  27   4.444  -5.329  -0.622
  199   2HD1  LEU  27          2HD1      LEU  27   5.190  -6.971  -0.691
  200   3HD1  LEU  27          3HD1      LEU  27   5.696  -5.820   0.596
  201   1HD2  LEU  27          1HD2      LEU  27   4.013  -5.099   2.361
  202   2HD2  LEU  27          2HD2      LEU  27   2.456  -5.987   2.552
  203   3HD2  LEU  27          3HD2      LEU  27   2.671  -4.823   1.191
  204    H    THR  28           H        THR  28   0.233  -7.884   3.054
  205    HA   THR  28           HA       THR  28  -2.002  -6.721   1.546
  206    HB   THR  28           HB       THR  28  -3.550  -7.758   2.452
  207    HG1  THR  28           1HG      THR  28  -2.062  -8.061   4.833
  208   1HG2  THR  28          1HG2      THR  28  -1.337  -9.746   3.243
  209   2HG2  THR  28          2HG2      THR  28  -1.652  -9.259   1.531
  210   3HG2  THR  28          3HG2      THR  28  -2.954 -10.084   2.490
  211    H    ILE  29           H        ILE  29  -3.321  -5.215   2.429
  212    HA   ILE  29           HA       ILE  29  -2.300  -3.723   4.789
  213    HB   ILE  29           HB       ILE  29  -3.764  -2.722   2.356
  214   1HG1  ILE  29          2HG1      ILE  29  -1.132  -3.247   2.286
  215   2HG1  ILE  29          1HG1      ILE  29  -1.937  -1.935   1.425
  216   1HG2  ILE  29          1HG2      ILE  29  -2.890  -1.327   4.985
  217   2HG2  ILE  29          2HG2      ILE  29  -4.566  -1.494   4.314
  218   3HG2  ILE  29          3HG2      ILE  29  -3.387  -0.426   3.524
  219   1HD1  ILE  29          1HD1      ILE  29  -1.254  -0.284   3.144
  220   2HD1  ILE  29          2HD1      ILE  29   0.171  -1.190   2.583
  221   3HD1  ILE  29          3HD1      ILE  29  -0.565  -1.596   4.180
  222    H    SER  30           H        SER  30  -3.915  -3.105   6.293
  223    HA   SER  30           HA       SER  30  -6.454  -4.535   5.967
  224   1HB   SER  30          2HB       SER  30  -5.202  -5.219   7.881
  225   2HB   SER  30          1HB       SER  30  -5.069  -3.551   8.489
  226    HG   SER  30           HG       SER  30  -6.814  -5.009   9.295
  227    H    ARG  31           H        ARG  31  -5.839  -1.583   7.883
  228    HA   ARG  31           HA       ARG  31  -8.165  -0.411   6.519
  229   1HB   ARG  31          2HB       ARG  31  -7.561  -1.089   9.347
  230   2HB   ARG  31          1HB       ARG  31  -8.112   0.582   9.159
  231   1HG   ARG  31          2HG       ARG  31  -9.954  -0.757   9.710
  232   2HG   ARG  31          1HG       ARG  31 -10.188  -0.149   8.051
  233   1HD   ARG  31          2HD       ARG  31  -9.713  -2.370   7.099
  234   2HD   ARG  31          1HD       ARG  31  -9.238  -3.014   8.730
  235    HE   ARG  31           HE       ARG  31 -11.626  -2.308   9.454
  236   1HH1  ARG  31          1HH1      ARG  31 -10.875  -3.983   6.355
  237   2HH1  ARG  31          2HH1      ARG  31 -12.415  -4.708   6.339
  238   1HH2  ARG  31          1HH2      ARG  31 -13.789  -2.918   9.019
  239   2HH2  ARG  31          2HH2      ARG  31 -14.084  -3.949   7.653
  240    H    ILE  32           H        ILE  32  -8.447   1.948   6.924
  241    HA   ILE  32           HA       ILE  32  -5.936   3.400   6.795
  242    HB   ILE  32           HB       ILE  32  -8.759   3.692   5.791
  243   1HG1  ILE  32          2HG1      ILE  32  -7.555   4.631   3.806
  244   2HG1  ILE  32          1HG1      ILE  32  -5.988   4.125   4.454
  245   1HG2  ILE  32          1HG2      ILE  32  -6.807   6.043   6.115
  246   2HG2  ILE  32          2HG2      ILE  32  -8.441   5.881   6.909
  247   3HG2  ILE  32          3HG2      ILE  32  -8.326   6.026   5.137
  248   1HD1  ILE  32          1HD1      ILE  32  -7.023   1.688   4.398
  249   2HD1  ILE  32          2HD1      ILE  32  -6.829   2.515   2.805
  250   3HD1  ILE  32          3HD1      ILE  32  -8.452   2.470   3.589
  251    H    THR  33           H        THR  33  -5.562   5.154   8.230
  252    HA   THR  33           HA       THR  33  -7.319   5.420  10.483
  253    HB   THR  33           HB       THR  33  -4.885   7.088   9.759
  254    HG1  THR  33           1HG      THR  33  -4.217   5.091  10.137
  255   1HG2  THR  33          1HG2      THR  33  -4.946   7.695  12.168
  256   2HG2  THR  33          2HG2      THR  33  -6.415   6.662  12.420
  257   3HG2  THR  33          3HG2      THR  33  -6.526   8.150  11.436
  258    HA   PRO  34           HA       PRO  34  -9.221   8.883   8.317
  259   1HB   PRO  34          2HB       PRO  34 -10.612  10.121  10.361
  260   2HB   PRO  34          1HB       PRO  34 -11.017   8.456   9.737
  261   1HG   PRO  34          2HG       PRO  34  -9.232   8.983  12.164
  262   2HG   PRO  34          1HG       PRO  34 -10.801   8.049  12.107
  263   1HD   PRO  34          2HD       PRO  34  -8.457   6.731  11.735
  264   2HD   PRO  34          1HD       PRO  34  -9.825   6.377  10.601
  265    H    GLY  35           H        GLY  35  -9.175  11.195   8.127
  266   1HA   GLY  35          2HA       GLY  35  -8.361  13.235   8.513
  267   2HA   GLY  35          1HA       GLY  35  -7.186  12.591   9.705
  268    H    SER  36           H        SER  36  -6.264  10.537   7.962
  269    HA   SER  36           HA       SER  36  -4.144  11.998   6.755
  270   1HB   SER  36          2HB       SER  36  -3.929   9.873   8.075
  271   2HB   SER  36          1HB       SER  36  -4.793   9.004   6.783
  272    HG   SER  36           HG       SER  36  -2.220  10.095   6.872
  273    H    LYS  37           H        LYS  37  -3.299  11.532   4.563
  274    HA   LYS  37           HA       LYS  37  -5.047  11.849   2.457
  275   1HB   LYS  37          2HB       LYS  37  -2.196  10.834   2.777
  276   2HB   LYS  37          1HB       LYS  37  -2.959  10.752   1.168
  277   1HG   LYS  37          2HG       LYS  37  -2.707  13.354   2.753
  278   2HG   LYS  37          1HG       LYS  37  -1.519  12.768   1.553
  279   1HD   LYS  37          2HD       LYS  37  -3.358  12.674  -0.189
  280   2HD   LYS  37          1HD       LYS  37  -4.470  13.413   1.012
  281   1HE   LYS  37          2HE       LYS  37  -2.887  15.420   1.148
  282   2HE   LYS  37          1HE       LYS  37  -1.918  14.699  -0.192
  283   1HZ   LYS  37          1HZ       LYS  37  -3.550  16.274  -0.996
  284   2HZ   LYS  37          2HZ       LYS  37  -4.791  15.452  -0.228
  285   3HZ   LYS  37          3HZ       LYS  37  -4.002  14.729  -1.538
  286    H    ALA  38           H        ALA  38  -3.929   8.995   4.036
  287    HA   ALA  38           HA       ALA  38  -4.775   6.866   2.521
  288   1HB   ALA  38          1HB       ALA  38  -4.948   7.297   5.542
  289   2HB   ALA  38          2HB       ALA  38  -3.451   6.856   4.634
  290   3HB   ALA  38          3HB       ALA  38  -4.834   5.723   4.668
  291    H    ALA  39           H        ALA  39  -6.782   9.033   4.547
  292    HA   ALA  39           HA       ALA  39  -9.125   7.470   3.842
  293   1HB   ALA  39          1HB       ALA  39  -8.724   8.196   6.231
  294   2HB   ALA  39          2HB       ALA  39 -10.223   8.941   5.571
  295   3HB   ALA  39          3HB       ALA  39  -8.711   9.908   5.701
  296    H    GLN  40           H        GLN  40  -7.820  10.754   3.520
  297    HA   GLN  40           HA       GLN  40 -10.036  12.013   2.617
  298   1HB   GLN  40          2HB       GLN  40  -7.056  12.478   2.244
  299   2HB   GLN  40          1HB       GLN  40  -8.217  13.638   1.572
  300   1HG   GLN  40          2HG       GLN  40  -8.028  12.852   4.559
  301   2HG   GLN  40          1HG       GLN  40  -7.345  14.328   3.809
  302   1HE2  GLN  40          1HE2      GLN  40  -9.962  13.289   5.614
  303   2HE2  GLN  40          2HE2      GLN  40 -11.067  14.552   5.128
  304    H    SER  41           H        SER  41  -7.633  10.399   0.568
  305    HA   SER  41           HA       SER  41  -8.763  11.810  -1.717
  306   1HB   SER  41          2HB       SER  41  -6.288  11.659  -0.907
  307   2HB   SER  41          1HB       SER  41  -6.222  10.140  -1.841
  308    HG   SER  41           HG       SER  41  -6.673  11.389  -3.684
  309    H    GLN  42           H        GLN  42  -7.698   9.684  -3.690
  310    HA   GLN  42           HA       GLN  42 -10.147   8.247  -3.711
  311   1HB   GLN  42          2HB       GLN  42  -7.840   7.832  -5.657
  312   2HB   GLN  42          1HB       GLN  42  -9.591   7.621  -5.877
  313   1HG   GLN  42          2HG       GLN  42  -9.359   9.547  -7.032
  314   2HG   GLN  42          1HG       GLN  42  -9.663  10.290  -5.432
  315   1HE2  GLN  42          1HE2      GLN  42  -7.873  10.799  -8.066
  316   2HE2  GLN  42          2HE2      GLN  42  -6.311  11.233  -7.388
  317    H    LEU  43           H        LEU  43  -7.557   7.770  -1.949
  318    HA   LEU  43           HA       LEU  43  -6.621   5.214  -2.618
  319   1HB   LEU  43          2HB       LEU  43  -5.614   7.359  -1.319
  320   2HB   LEU  43          1HB       LEU  43  -6.259   6.535   0.111
  321    HG   LEU  43           HG       LEU  43  -4.917   4.435  -0.880
  322   1HD1  LEU  43          1HD1      LEU  43  -3.379   6.773  -2.185
  323   2HD1  LEU  43          2HD1      LEU  43  -4.444   5.643  -3.092
  324   3HD1  LEU  43          3HD1      LEU  43  -2.978   5.015  -2.248
  325   1HD2  LEU  43          1HD2      LEU  43  -2.740   5.419   0.193
  326   2HD2  LEU  43          2HD2      LEU  43  -4.166   5.292   1.247
  327   3HD2  LEU  43          3HD2      LEU  43  -3.711   6.890   0.531
  328    H    SER  44           H        SER  44  -7.168   3.191  -1.891
  329    HA   SER  44           HA       SER  44  -8.024   3.083   0.866
  330   1HB   SER  44          2HB       SER  44 -10.167   2.911  -0.424
  331   2HB   SER  44          1HB       SER  44  -9.522   1.467  -1.264
  332    HG   SER  44           HG       SER  44 -10.836   1.084   0.651
  333    H    GLN  45           H        GLN  45  -5.511   2.629   0.795
  334    HA   GLN  45           HA       GLN  45  -4.627   0.205   0.001
  335   1HB   GLN  45          2HB       GLN  45  -4.058   1.784   2.566
  336   2HB   GLN  45          1HB       GLN  45  -2.990   0.533   1.821
  337   1HG   GLN  45          2HG       GLN  45  -2.735   1.857  -0.195
  338   2HG   GLN  45          1HG       GLN  45  -3.779   3.169   0.440
  339   1HE2  GLN  45          2HE2      GLN  45  -0.650   1.753   0.607
  340   2HE2  GLN  45          1HE2      GLN  45   0.146   3.155   1.347
  341    H    GLY  46           H        GLY  46  -5.512  -1.713   0.347
  342   1HA   GLY  46          2HA       GLY  46  -5.787  -2.787   2.898
  343   2HA   GLY  46          1HA       GLY  46  -7.387  -2.162   2.433
  344    H    ASP  47           H        ASP  47  -4.841  -3.663   0.385
  345    HA   ASP  47           HA       ASP  47  -6.366  -6.063   0.120
  346   1HB   ASP  47          2HB       ASP  47  -7.268  -4.111  -1.524
  347   2HB   ASP  47          1HB       ASP  47  -5.823  -4.511  -2.496
  348    H    LEU  48           H        LEU  48  -5.028  -6.965  -2.234
  349    HA   LEU  48           HA       LEU  48  -2.447  -7.457  -1.050
  350   1HB   LEU  48          2HB       LEU  48  -3.775  -8.629  -3.548
  351   2HB   LEU  48          1HB       LEU  48  -2.197  -9.100  -2.850
  352    HG   LEU  48           HG       LEU  48  -3.476 -10.777  -1.955
  353   1HD1  LEU  48          1HD1      LEU  48  -4.090 -10.434   0.371
  354   2HD1  LEU  48          2HD1      LEU  48  -4.302  -8.664   0.142
  355   3HD1  LEU  48          3HD1      LEU  48  -2.647  -9.379  -0.020
  356   1HD2  LEU  48          1HD2      LEU  48  -5.625  -9.846  -3.039
  357   2HD2  LEU  48          2HD2      LEU  48  -5.807  -8.818  -1.545
  358   3HD2  LEU  48          3HD2      LEU  48  -5.868 -10.625  -1.394
  359    H    VAL  49           H        VAL  49  -0.894  -6.117  -1.396
  360    HA   VAL  49           HA       VAL  49  -1.094  -4.163  -3.447
  361    HB   VAL  49           HB       VAL  49   1.101  -4.697  -1.415
  362   1HG1  VAL  49          1HG1      VAL  49   1.539  -2.241  -1.750
  363   2HG1  VAL  49          2HG1      VAL  49   0.316  -2.212  -3.087
  364   3HG1  VAL  49          3HG1      VAL  49   1.837  -3.185  -3.257
  365   1HG2  VAL  49          1HG2      VAL  49  -1.438  -2.942  -1.256
  366   2HG2  VAL  49          2HG2      VAL  49  -0.065  -2.910  -0.093
  367   3HG2  VAL  49          3HG2      VAL  49  -1.064  -4.388  -0.240
  368    H    VAL  50           H        VAL  50   0.102  -4.146  -5.411
  369    HA   VAL  50           HA       VAL  50   1.705  -6.535  -5.902
  370    HB   VAL  50           HB       VAL  50   0.724  -4.730  -8.109
  371   1HG1  VAL  50          1HG1      VAL  50   2.357  -6.590  -8.545
  372   2HG1  VAL  50          2HG1      VAL  50   0.741  -6.946  -9.261
  373   3HG1  VAL  50          3HG1      VAL  50   1.241  -7.756  -7.732
  374   1HG2  VAL  50          1HG2      VAL  50  -1.315  -4.975  -6.930
  375   2HG2  VAL  50          2HG2      VAL  50  -0.996  -6.725  -6.527
  376   3HG2  VAL  50          3HG2      VAL  50  -1.318  -6.208  -8.230
  377    H    ALA  51           H        ALA  51   1.602  -3.059  -6.658
  378    HA   ALA  51           HA       ALA  51   4.519  -3.089  -6.826
  379   1HB   ALA  51          1HB       ALA  51   4.462  -1.567  -8.797
  380   2HB   ALA  51          2HB       ALA  51   2.666  -1.621  -8.798
  381   3HB   ALA  51          3HB       ALA  51   3.609  -3.105  -9.164
  382    H    ILE  52           H        ILE  52   5.613  -1.346  -6.228
  383    HA   ILE  52           HA       ILE  52   4.154   0.840  -4.943
  384    HB   ILE  52           HB       ILE  52   5.274  -1.072  -3.590
  385   1HG1  ILE  52          2HG1      ILE  52   4.235   0.859  -2.525
  386   2HG1  ILE  52          1HG1      ILE  52   5.770   0.434  -1.726
  387   1HG2  ILE  52          1HG2      ILE  52   7.465  -1.026  -4.727
  388   2HG2  ILE  52          2HG2      ILE  52   7.614  -0.719  -2.954
  389   3HG2  ILE  52          3HG2      ILE  52   7.753   0.644  -4.137
  390   1HD1  ILE  52          1HD1      ILE  52   6.899   2.343  -3.098
  391   2HD1  ILE  52          2HD1      ILE  52   5.743   2.831  -1.823
  392   3HD1  ILE  52          3HD1      ILE  52   5.232   2.856  -3.549
  393    H    ASP  53           H        ASP  53   4.804   2.786  -5.720
  394    HA   ASP  53           HA       ASP  53   5.590   4.166  -7.133
  395   1HB   ASP  53          2HB       ASP  53   7.870   4.854  -6.985
  396   2HB   ASP  53          1HB       ASP  53   7.177   4.416  -5.392
  397    H    GLY  54           H        GLY  54   5.097   1.485  -8.206
  398   1HA   GLY  54          2HA       GLY  54   4.735   0.978 -10.426
  399   2HA   GLY  54          1HA       GLY  54   6.157   1.960 -10.900
  400    H    VAL  55           H        VAL  55   6.931   0.001  -8.190
  401    HA   VAL  55           HA       VAL  55   8.266  -1.895  -9.976
  402    HB   VAL  55           HB       VAL  55   9.010  -0.870  -7.208
  403   1HG1  VAL  55          1HG1      VAL  55   9.853  -3.211  -7.756
  404   2HG1  VAL  55          2HG1      VAL  55  11.180  -1.993  -7.708
  405   3HG1  VAL  55          3HG1      VAL  55  10.553  -2.572  -9.290
  406   1HG2  VAL  55          1HG2      VAL  55   9.241   0.990  -8.793
  407   2HG2  VAL  55          2HG2      VAL  55  10.040  -0.083 -10.011
  408   3HG2  VAL  55          3HG2      VAL  55  10.869   0.323  -8.463
  409    H    ASN  56           H        ASN  56   7.833  -4.079  -9.590
  410    HA   ASN  56           HA       ASN  56   5.687  -4.575  -7.847
  411   1HB   ASN  56          2HB       ASN  56   5.573  -6.718  -8.596
  412   2HB   ASN  56          1HB       ASN  56   6.126  -5.745 -10.017
  413   1HD2  ASN  56          1HD2      ASN  56   8.932  -5.751  -9.781
  414   2HD2  ASN  56          2HD2      ASN  56   9.511  -7.383  -9.672
  415    H    THR  57           H        THR  57   5.484  -5.425  -5.788
  416    HA   THR  57           HA       THR  57   7.879  -5.428  -4.241
  417    HB   THR  57           HB       THR  57   6.211  -5.742  -2.353
  418    HG1  THR  57           1HG      THR  57   4.469  -6.542  -3.619
  419   1HG2  THR  57          1HG2      THR  57   5.451  -3.393  -2.528
  420   2HG2  THR  57          2HG2      THR  57   5.842  -3.358  -4.282
  421   3HG2  THR  57          3HG2      THR  57   7.168  -3.518  -3.070
  422    H    ASP  58           H        ASP  58   8.400  -7.410  -5.764
  423    HA   ASP  58           HA       ASP  58   7.179  -9.830  -5.296
  424   1HB   ASP  58          2HB       ASP  58   9.275 -10.795  -6.357
  425   2HB   ASP  58          1HB       ASP  58   8.438  -9.501  -7.265
  426    H    THR  59           H        THR  59  10.319  -8.857  -4.002
  427    HA   THR  59           HA       THR  59  10.020 -10.942  -1.958
  428    HB   THR  59           HB       THR  59  11.887 -11.116  -3.568
  429    HG1  THR  59           1HG      THR  59  12.862 -10.544  -1.008
  430   1HG2  THR  59          1HG2      THR  59  12.999  -8.587  -2.173
  431   2HG2  THR  59          2HG2      THR  59  12.379  -8.675  -3.866
  432   3HG2  THR  59          3HG2      THR  59  13.833  -9.612  -3.395
  433    H    MET  60           H        MET  60   9.364  -7.884  -2.252
  434    HA   MET  60           HA       MET  60  10.398  -6.699   0.111
  435   1HB   MET  60          2HB       MET  60   8.228  -6.186  -1.948
  436   2HB   MET  60          1HB       MET  60   8.268  -5.168  -0.472
  437   1HG   MET  60          2HG       MET  60   9.351  -3.905  -2.088
  438   2HG   MET  60          1HG       MET  60  10.655  -4.510  -1.032
  439   1HE   MET  60          1HE       MET  60  12.334  -6.359  -1.629
  440   2HE   MET  60          2HE       MET  60  12.792  -4.696  -2.137
  441   3HE   MET  60          3HE       MET  60  13.113  -6.085  -3.223
  442    H    THR  61           H        THR  61   9.765  -7.002   2.092
  443    HA   THR  61           HA       THR  61   7.347  -8.443   2.756
  444    HB   THR  61           HB       THR  61   8.306  -8.555   4.956
  445    HG1  THR  61           1HG      THR  61  10.482  -7.105   3.893
  446   1HG2  THR  61          1HG2      THR  61   9.087 -10.066   3.020
  447   2HG2  THR  61          2HG2      THR  61  10.363  -9.813   4.280
  448   3HG2  THR  61          3HG2      THR  61  10.430  -8.927   2.720
  449    H    HIS  62           H        HIS  62   6.259  -7.425   4.935
  450    HA   HIS  62           HA       HIS  62   5.018  -5.149   4.279
  451   1HB   HIS  62          2HB       HIS  62   4.053  -5.070   6.364
  452   2HB   HIS  62          1HB       HIS  62   4.461  -6.793   6.135
  453    HD1  HIS  62           1HD      HIS  62   6.937  -7.431   7.499
  454    HD2  HIS  62           2HD      HIS  62   4.614  -4.201   8.812
  455    HE1  HIS  62           1HE      HIS  62   7.720  -6.823   9.841
  456    H    LEU  63           H        LEU  63   7.678  -5.159   6.608
  457    HA   LEU  63           HA       LEU  63   8.089  -2.480   6.975
  458   1HB   LEU  63          2HB       LEU  63   9.195  -4.330   8.229
  459   2HB   LEU  63          1HB       LEU  63  10.117  -4.764   6.757
  460    HG   LEU  63           HG       LEU  63  11.155  -2.418   6.823
  461   1HD1  LEU  63          1HD1      LEU  63   9.487  -1.277   8.312
  462   2HD1  LEU  63          2HD1      LEU  63  11.146  -1.221   9.011
  463   3HD1  LEU  63          3HD1      LEU  63   9.937  -2.389   9.663
  464   1HD2  LEU  63          1HD2      LEU  63  12.335  -4.443   7.476
  465   2HD2  LEU  63          2HD2      LEU  63  11.672  -4.333   9.159
  466   3HD2  LEU  63          3HD2      LEU  63  12.802  -3.055   8.539
  467    H    GLU  64           H        GLU  64   9.537  -4.491   4.379
  468    HA   GLU  64           HA       GLU  64  11.043  -2.447   3.254
  469   1HB   GLU  64          2HB       GLU  64  10.010  -5.126   2.601
  470   2HB   GLU  64          1HB       GLU  64  10.234  -4.209   1.112
  471   1HG   GLU  64          2HG       GLU  64  12.586  -4.111   1.338
  472   2HG   GLU  64          1HG       GLU  64  12.500  -4.027   3.129
  473    H    ALA  65           H        ALA  65   7.733  -3.539   2.358
  474    HA   ALA  65           HA       ALA  65   7.401  -1.610   0.354
  475   1HB   ALA  65          1HB       ALA  65   6.216  -3.773   0.608
  476   2HB   ALA  65          2HB       ALA  65   5.033  -2.402   0.449
  477   3HB   ALA  65          3HB       ALA  65   5.366  -3.150   2.069
  478    H    GLN  66           H        GLN  66   6.626  -1.570   3.817
  479    HA   GLN  66           HA       GLN  66   5.441   0.908   3.977
  480   1HB   GLN  66          2HB       GLN  66   5.416  -0.673   5.779
  481   2HB   GLN  66          1HB       GLN  66   7.175  -0.833   5.793
  482   1HG   GLN  66          2HG       GLN  66   7.561   1.196   6.903
  483   2HG   GLN  66          1HG       GLN  66   5.870   1.819   6.634
  484   1HE2  GLN  66          1HE2      GLN  66   4.493   1.513   8.400
  485   2HE2  GLN  66          2HE2      GLN  66   4.662   0.230   9.561
  486    H    ASN  67           H        ASN  67   8.931   0.079   4.223
  487    HA   ASN  67           HA       ASN  67   9.809   2.729   4.379
  488   1HB   ASN  67          2HB       ASN  67  11.042   0.020   3.669
  489   2HB   ASN  67          1HB       ASN  67  12.037   1.503   3.465
  490   1HD2  ASN  67          1HD2      ASN  67  12.754  -0.523   5.311
  491   2HD2  ASN  67          2HD2      ASN  67  12.591   0.174   6.906
  492    H    LYS  68           H        LYS  68   9.165   0.735   1.499
  493    HA   LYS  68           HA       LYS  68  10.168   2.570  -0.337
  494   1HB   LYS  68          2HB       LYS  68   7.845   0.601  -0.529
  495   2HB   LYS  68          1HB       LYS  68   8.570   1.429  -1.929
  496   1HG   LYS  68          2HG       LYS  68  10.427  -0.253  -0.183
  497   2HG   LYS  68          1HG       LYS  68   9.190  -1.068  -1.166
  498   1HD   LYS  68          2HD       LYS  68  10.070   0.459  -3.123
  499   2HD   LYS  68          1HD       LYS  68  11.532   0.654  -2.106
  500   1HE   LYS  68          2HE       LYS  68  11.766  -1.908  -2.075
  501   2HE   LYS  68          1HE       LYS  68  10.279  -2.019  -3.068
  502   1HZ   LYS  68          1HZ       LYS  68  11.464  -0.485  -4.683
  503   2HZ   LYS  68          2HZ       LYS  68  12.035  -2.068  -4.627
  504   3HZ   LYS  68          3HZ       LYS  68  12.894  -0.854  -3.866
  505    H    ILE  69           H        ILE  69   6.818   2.188   0.930
  506    HA   ILE  69           HA       ILE  69   5.739   4.465  -0.105
  507    HB   ILE  69           HB       ILE  69   5.211   2.803   2.351
  508   1HG1  ILE  69          2HG1      ILE  69   4.013   3.213  -0.430
  509   2HG1  ILE  69          1HG1      ILE  69   4.356   1.668   0.407
  510   1HG2  ILE  69          1HG2      ILE  69   4.598   5.105   3.006
  511   2HG2  ILE  69          2HG2      ILE  69   3.151   4.128   2.742
  512   3HG2  ILE  69          3HG2      ILE  69   3.660   5.301   1.469
  513   1HD1  ILE  69          1HD1      ILE  69   2.511   1.913   1.945
  514   2HD1  ILE  69          2HD1      ILE  69   2.021   1.837   0.221
  515   3HD1  ILE  69          3HD1      ILE  69   1.978   3.415   1.068
  516    H    LYS  70           H        LYS  70   7.403   4.205   3.064
  517    HA   LYS  70           HA       LYS  70   7.038   6.950   3.588
  518   1HB   LYS  70          2HB       LYS  70   8.263   4.573   4.909
  519   2HB   LYS  70          1HB       LYS  70   8.983   6.122   5.374
  520   1HG   LYS  70          2HG       LYS  70   7.267   5.481   6.940
  521   2HG   LYS  70          1HG       LYS  70   6.902   7.043   6.139
  522   1HD   LYS  70          2HD       LYS  70   5.230   5.990   4.696
  523   2HD   LYS  70          1HD       LYS  70   5.656   4.362   5.309
  524   1HE   LYS  70          2HE       LYS  70   3.538   5.162   6.279
  525   2HE   LYS  70          1HE       LYS  70   4.791   4.983   7.576
  526   1HZ   LYS  70          1HZ       LYS  70   4.333   7.606   6.256
  527   2HZ   LYS  70          2HZ       LYS  70   5.027   7.266   7.748
  528   3HZ   LYS  70          3HZ       LYS  70   3.377   7.079   7.559
  529    H    SER  71           H        SER  71   9.029   5.794   1.267
  530    HA   SER  71           HA       SER  71  11.170   7.695   1.901
  531   1HB   SER  71          2HB       SER  71  11.720   5.296   1.254
  532   2HB   SER  71          1HB       SER  71  11.026   5.635  -0.362
  533    HG   SER  71           HG       SER  71  12.928   6.341  -0.762
  534    H    ALA  72           H        ALA  72   8.278   7.372   0.229
  535    HA   ALA  72           HA       ALA  72   8.953   9.261  -1.886
  536   1HB   ALA  72          1HB       ALA  72   7.709   7.104  -2.354
  537   2HB   ALA  72          2HB       ALA  72   6.710   8.547  -2.790
  538   3HB   ALA  72          3HB       ALA  72   6.416   7.655  -1.244
  539    H    SER  73           H        SER  73   7.538  11.090  -2.269
  540    HA   SER  73           HA       SER  73   5.692  11.892  -0.237
  541   1HB   SER  73          2HB       SER  73   8.210  13.624  -0.615
  542   2HB   SER  73          1HB       SER  73   6.700  14.097   0.261
  543    HG   SER  73           HG       SER  73   8.067  11.759   0.971
  544    H    TYR  74           H        TYR  74   7.715  12.964  -2.987
  545    HA   TYR  74           HA       TYR  74   5.987  14.952  -3.799
  546   1HB   TYR  74          2HB       TYR  74   8.525  13.940  -4.561
  547   2HB   TYR  74          1HB       TYR  74   7.548  13.630  -6.024
  548    HD1  TYR  74           1HD      TYR  74   6.702  15.515  -7.304
  549    HD2  TYR  74           2HD      TYR  74   8.732  16.132  -3.620
  550    HE1  TYR  74           1HE      TYR  74   6.779  17.917  -7.753
  551    HE2  TYR  74           2HE      TYR  74   8.812  18.527  -4.052
  552    HH   TYR  74           HH       TYR  74   7.878  20.185  -5.268
  553    H    ASN  75           H        ASN  75   6.250  11.582  -4.869
  554    HA   ASN  75           HA       ASN  75   3.419  11.609  -5.258
  555   1HB   ASN  75          2HB       ASN  75   3.467  10.564  -7.550
  556   2HB   ASN  75          1HB       ASN  75   3.984  12.277  -7.508
  557   1HD2  ASN  75          1HD2      ASN  75   5.644   9.022  -7.102
  558   2HD2  ASN  75          2HD2      ASN  75   6.656   9.267  -8.480
  559    H    LEU  76           H        LEU  76   2.505   9.699  -4.672
  560    HA   LEU  76           HA       LEU  76   4.326   7.372  -4.526
  561   1HB   LEU  76          2HB       LEU  76   3.905   8.334  -2.282
  562   2HB   LEU  76          1HB       LEU  76   2.164   8.279  -2.556
  563    HG   LEU  76           HG       LEU  76   2.335   5.704  -2.752
  564   1HD1  LEU  76          1HD1      LEU  76   5.105   6.121  -1.481
  565   2HD1  LEU  76          2HD1      LEU  76   4.907   5.672  -3.231
  566   3HD1  LEU  76          3HD1      LEU  76   4.312   4.578  -1.925
  567   1HD2  LEU  76          1HD2      LEU  76   2.498   5.373  -0.328
  568   2HD2  LEU  76          2HD2      LEU  76   1.569   6.876  -0.693
  569   3HD2  LEU  76          3HD2      LEU  76   3.282   6.988  -0.123
  570    H    SER  77           H        SER  77   3.701   6.203  -6.321
  571    HA   SER  77           HA       SER  77   0.835   5.813  -6.727
  572   1HB   SER  77          2HB       SER  77   3.214   4.921  -8.421
  573   2HB   SER  77          1HB       SER  77   1.486   4.553  -8.768
  574    HG   SER  77           HG       SER  77   2.284   6.346  -9.885
  575    H    LEU  78           H        LEU  78  -0.141   4.141  -5.719
  576    HA   LEU  78           HA       LEU  78   1.449   1.717  -5.252
  577   1HB   LEU  78          2HB       LEU  78  -1.233   2.409  -3.974
  578   2HB   LEU  78          1HB       LEU  78  -0.082   1.122  -3.525
  579    HG   LEU  78           HG       LEU  78   0.033   2.719  -1.823
  580   1HD1  LEU  78          1HD1      LEU  78   2.305   3.488  -1.757
  581   2HD1  LEU  78          2HD1      LEU  78   2.491   3.357  -3.546
  582   3HD1  LEU  78          3HD1      LEU  78   2.251   1.866  -2.547
  583   1HD2  LEU  78          1HD2      LEU  78   0.192   5.046  -1.892
  584   2HD2  LEU  78          2HD2      LEU  78  -1.132   4.575  -3.025
  585   3HD2  LEU  78          3HD2      LEU  78   0.465   5.087  -3.677
  586    H    THR  79           H        THR  79   0.791  -0.162  -6.238
  587    HA   THR  79           HA       THR  79  -1.853  -0.160  -7.505
  588    HB   THR  79           HB       THR  79   0.558  -1.768  -8.426
  589    HG1  THR  79           1HG      THR  79  -0.397   0.770  -9.170
  590   1HG2  THR  79          1HG2      THR  79  -2.205  -1.120  -9.645
  591   2HG2  THR  79          2HG2      THR  79  -1.689  -2.710  -8.956
  592   3HG2  THR  79          3HG2      THR  79  -0.882  -2.080 -10.439
  593    H    LEU  80           H        LEU  80  -3.142  -1.420  -6.192
  594    HA   LEU  80           HA       LEU  80  -2.185  -4.040  -5.342
  595   1HB   LEU  80          2HB       LEU  80  -3.377  -3.874  -3.310
  596   2HB   LEU  80          1HB       LEU  80  -2.205  -2.493  -3.416
  597    HG   LEU  80           HG       LEU  80  -5.172  -2.453  -3.961
  598   1HD1  LEU  80          1HD1      LEU  80  -4.527  -2.833  -1.584
  599   2HD1  LEU  80          2HD1      LEU  80  -5.380  -1.223  -1.840
  600   3HD1  LEU  80          3HD1      LEU  80  -3.554  -1.285  -1.625
  601   1HD2  LEU  80          1HD2      LEU  80  -2.884  -0.444  -4.073
  602   2HD2  LEU  80          2HD2      LEU  80  -4.521   0.228  -3.575
  603   3HD2  LEU  80          3HD2      LEU  80  -4.306  -0.569  -5.201
  604    H    GLN  81           H        GLN  81  -4.222  -5.468  -4.910
  605    HA   GLN  81           HA       GLN  81  -5.796  -5.209  -7.269
  606   1HB   GLN  81          2HB       GLN  81  -5.656  -7.321  -5.129
  607   2HB   GLN  81          1HB       GLN  81  -6.597  -7.458  -6.657
  608   1HG   GLN  81          2HG       GLN  81  -4.610  -7.441  -8.023
  609   2HG   GLN  81          1HG       GLN  81  -3.559  -6.937  -6.649
  610   1HE2  GLN  81          1HE2      GLN  81  -2.285  -8.567  -6.007
  611   2HE2  GLN  81          2HE2      GLN  81  -2.743 -10.244  -5.912
  612    H    LYS  82           H        LYS  82  -8.160  -5.591  -7.323
  613    HA   LYS  82           HA       LYS  82  -9.576  -4.684  -4.939
  614   1HB   LYS  82          2HB       LYS  82 -10.630  -5.384  -7.731
  615   2HB   LYS  82          1HB       LYS  82 -11.575  -4.675  -6.392
  616   1HG   LYS  82          2HG       LYS  82  -9.304  -3.407  -8.015
  617   2HG   LYS  82          1HG       LYS  82 -11.036  -3.019  -8.125
  618   1HD   LYS  82          2HD       LYS  82  -9.185  -2.557  -5.718
  619   2HD   LYS  82          1HD       LYS  82  -9.670  -1.314  -6.899
  620   1HE   LYS  82          2HE       LYS  82 -11.568  -2.696  -4.885
  621   2HE   LYS  82          1HE       LYS  82 -10.919  -1.012  -4.820
  622   1HZ   LYS  82          1HZ       LYS  82 -12.858  -2.170  -6.722
  623   2HZ   LYS  82          2HZ       LYS  82 -12.018  -0.713  -7.058
  624   3HZ   LYS  82          3HZ       LYS  82 -13.048  -0.841  -5.732
  625    H    SER  83           H        SER  83  -9.084  -6.632  -3.637
  626    HA   SER  83           HA       SER  83 -10.534  -9.002  -4.572
  627   1HB   SER  83          2HB       SER  83  -8.377  -8.977  -2.420
  628   2HB   SER  83          1HB       SER  83  -9.008 -10.359  -3.377
  629    HG   SER  83           HG       SER  83  -7.255  -8.290  -3.981
  630    H    LYS  84           H        LYS  84 -11.517  -6.554  -2.964
  631    HA   LYS  84           HA       LYS  84 -10.931  -6.835  -0.423
  632   1HB   LYS  84          2HB       LYS  84 -13.381  -5.522  -1.645
  633   2HB   LYS  84          1HB       LYS  84 -12.986  -5.360   0.089
  634   1HG   LYS  84          2HG       LYS  84 -11.063  -4.575  -2.149
  635   2HG   LYS  84          1HG       LYS  84 -12.207  -3.431  -1.398
  636   1HD   LYS  84          2HD       LYS  84 -10.411  -4.977   0.505
  637   2HD   LYS  84          1HD       LYS  84  -9.614  -3.867  -0.622
  638   1HE   LYS  84          2HE       LYS  84  -9.942  -2.693   1.428
  639   2HE   LYS  84          1HE       LYS  84 -11.061  -1.959   0.219
  640   1HZ   LYS  84          1HZ       LYS  84 -11.900  -2.472   2.551
  641   2HZ   LYS  84          2HZ       LYS  84 -11.985  -4.080   2.110
  642   3HZ   LYS  84          3HZ       LYS  84 -12.887  -2.957   1.259
  643    H    ARG  85           H        ARG  85 -11.380  -7.753   1.355
  644    HA   ARG  85           HA       ARG  85 -13.781  -9.334   1.682
  645   1HB   ARG  85          2HB       ARG  85 -11.665 -10.549   0.703
  646   2HB   ARG  85          1HB       ARG  85 -10.954 -10.371   2.325
  647   1HG   ARG  85          2HG       ARG  85 -13.688 -11.671   1.726
  648   2HG   ARG  85          1HG       ARG  85 -12.160 -12.596   1.668
  649   1HD   ARG  85          2HD       ARG  85 -11.753 -12.315   4.057
  650   2HD   ARG  85          1HD       ARG  85 -13.166 -11.184   4.222
  651    HE   ARG  85           HE       ARG  85 -14.430 -13.272   3.087
  652   1HH1  ARG  85          1HH1      ARG  85 -12.170 -13.388   5.912
  653   2HH1  ARG  85          2HH1      ARG  85 -13.035 -14.692   6.591
  654   1HH2  ARG  85          1HH2      ARG  85 -15.334 -15.081   3.969
  655   2HH2  ARG  85          2HH2      ARG  85 -14.961 -15.541   5.610
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1  -6.980  -7.287 -11.705
    2   2H    MET   1          2HT       MET   1  -8.243  -8.409 -11.565
    3   3H    MET   1          3HT       MET   1  -7.322  -7.978 -10.215
    4    HA   MET   1           HA       MET   1  -8.907  -5.983 -11.689
    5   1HB   MET   1          2HB       MET   1 -10.415  -7.810 -10.895
    6   2HB   MET   1          1HB       MET   1  -9.710  -7.697  -9.257
    7   1HG   MET   1          2HG       MET   1 -10.640  -5.406  -8.996
    8   2HG   MET   1          1HG       MET   1 -11.284  -5.470 -10.665
    9   1HE   MET   1          1HE       MET   1 -13.580  -4.818  -9.969
   10   2HE   MET   1          2HE       MET   1 -12.987  -4.637  -8.280
   11   3HE   MET   1          3HE       MET   1 -14.512  -5.532  -8.615
   12    H    ALA   2           H        ALA   2  -7.539  -4.144 -11.210
   13    HA   ALA   2           HA       ALA   2  -6.978  -3.753  -8.389
   14   1HB   ALA   2          1HB       ALA   2  -5.020  -5.070  -9.071
   15   2HB   ALA   2          2HB       ALA   2  -4.521  -3.362  -8.848
   16   3HB   ALA   2          3HB       ALA   2  -4.765  -4.006 -10.516
   17    H    TYR   3           H        TYR   3  -6.027  -1.714  -7.878
   18    HA   TYR   3           HA       TYR   3  -6.746   0.304  -9.879
   19   1HB   TYR   3          2HB       TYR   3  -8.151   1.472  -8.617
   20   2HB   TYR   3          1HB       TYR   3  -8.619  -0.197  -8.158
   21    HD1  TYR   3           1HD      TYR   3  -7.794   2.951  -7.153
   22    HD2  TYR   3           2HD      TYR   3  -7.219  -1.084  -5.916
   23    HE1  TYR   3           1HE      TYR   3  -7.046   3.740  -4.956
   24    HE2  TYR   3           2HE      TYR   3  -6.532  -0.301  -3.720
   25    HH   TYR   3           HH       TYR   3  -5.012   2.260  -3.604
   26    H    SER   4           H        SER   4  -5.416   1.967 -10.129
   27    HA   SER   4           HA       SER   4  -3.162   2.109  -8.272
   28   1HB   SER   4          2HB       SER   4  -1.800   3.063 -10.076
   29   2HB   SER   4          1HB       SER   4  -2.358   1.398 -10.445
   30    HG   SER   4           HG       SER   4  -2.587   2.907 -12.183
   31    H    VAL   5           H        VAL   5  -2.584   4.102  -7.473
   32    HA   VAL   5           HA       VAL   5  -3.767   6.494  -8.508
   33    HB   VAL   5           HB       VAL   5  -5.572   6.127  -7.132
   34   1HG1  VAL   5          1HG1      VAL   5  -5.410   5.286  -4.796
   35   2HG1  VAL   5          2HG1      VAL   5  -3.672   4.859  -5.110
   36   3HG1  VAL   5          3HG1      VAL   5  -5.001   4.108  -6.080
   37   1HG2  VAL   5          1HG2      VAL   5  -5.412   7.761  -5.332
   38   2HG2  VAL   5          2HG2      VAL   5  -4.439   8.370  -6.725
   39   3HG2  VAL   5          3HG2      VAL   5  -3.623   7.653  -5.286
   40    H    THR   6           H        THR   6  -2.373   8.144  -8.340
   41    HA   THR   6           HA       THR   6   0.053   7.681  -6.786
   42    HB   THR   6           HB       THR   6  -0.590   9.870  -8.767
   43    HG1  THR   6           1HG      THR   6   0.704   8.669 -10.123
   44   1HG2  THR   6          1HG2      THR   6   1.277  10.408  -7.096
   45   2HG2  THR   6          2HG2      THR   6   1.926  10.146  -8.744
   46   3HG2  THR   6          3HG2      THR   6   2.084   8.847  -7.524
   47    H    LEU   7           H        LEU   7   0.221   8.589  -4.802
   48    HA   LEU   7           HA       LEU   7  -1.780  10.602  -4.111
   49   1HB   LEU   7          2HB       LEU   7  -1.663   8.332  -2.978
   50   2HB   LEU   7          1HB       LEU   7  -0.059   8.786  -2.348
   51    HG   LEU   7           HG       LEU   7  -1.093  10.653  -1.056
   52   1HD1  LEU   7          1HD1      LEU   7  -3.622  10.749  -0.844
   53   2HD1  LEU   7          2HD1      LEU   7  -3.757   9.624  -2.243
   54   3HD1  LEU   7          3HD1      LEU   7  -3.049  11.270  -2.468
   55   1HD2  LEU   7          1HD2      LEU   7  -2.346   9.197   0.568
   56   2HD2  LEU   7          2HD2      LEU   7  -0.898   8.327  -0.072
   57   3HD2  LEU   7          3HD2      LEU   7  -2.530   7.943  -0.718
   58    H    THR   8           H        THR   8  -1.226  12.573  -3.267
   59    HA   THR   8           HA       THR   8   1.589  13.303  -3.376
   60    HB   THR   8           HB       THR   8   0.757  15.629  -3.375
   61    HG1  THR   8           1HG      THR   8  -1.446  15.767  -4.069
   62   1HG2  THR   8          1HG2      THR   8   0.000  15.568  -5.737
   63   2HG2  THR   8          2HG2      THR   8  -0.389  13.810  -5.608
   64   3HG2  THR   8          3HG2      THR   8   1.316  14.380  -5.467
   65    H    GLY   9           H        GLY   9   2.620  14.213  -1.609
   66   1HA   GLY   9          2HA       GLY   9   1.304  13.648   0.894
   67   2HA   GLY   9          1HA       GLY   9   3.018  13.889   0.530
   68    HA   PRO  10           HA       PRO  10   1.641  18.041   2.065
   69   1HB   PRO  10          2HB       PRO  10  -1.394  17.685   1.630
   70   2HB   PRO  10          1HB       PRO  10  -0.481  19.237   1.836
   71   1HG   PRO  10          2HG       PRO  10  -1.136  18.361  -0.694
   72   2HG   PRO  10          1HG       PRO  10   0.546  18.969  -0.378
   73   1HD   PRO  10          2HD       PRO  10  -0.402  16.066  -0.563
   74   2HD   PRO  10          1HD       PRO  10   1.149  16.822  -1.134
   75    H    GLY  11           H        GLY  11  -0.306  15.186   2.497
   76   1HA   GLY  11          2HA       GLY  11   0.004  15.460   5.394
   77   2HA   GLY  11          1HA       GLY  11  -1.570  14.967   4.646
   78    HA   PRO  12           HA       PRO  12   1.559  11.527   4.889
   79   1HB   PRO  12          2HB       PRO  12   1.214  10.310   7.324
   80   2HB   PRO  12          1HB       PRO  12   2.077  11.890   7.190
   81   1HG   PRO  12          2HG       PRO  12  -0.907  11.472   7.841
   82   2HG   PRO  12          1HG       PRO  12   0.318  12.399   8.818
   83   1HD   PRO  12          2HD       PRO  12  -1.330  13.616   6.923
   84   2HD   PRO  12          1HD       PRO  12   0.394  14.158   7.178
   85    H    TRP  13           H        TRP  13   1.326   9.183   4.837
   86    HA   TRP  13           HA       TRP  13  -1.372   8.358   4.159
   87   1HB   TRP  13          2HB       TRP  13   0.550   6.243   3.646
   88   2HB   TRP  13          1HB       TRP  13  -0.426   7.055   2.552
   89    HD1  TRP  13           HD       TRP  13   3.025   6.647   3.899
   90    HE1  TRP  13           1HE      TRP  13   4.735   7.859   2.353
   91    HE3  TRP  13           3HE      TRP  13  -0.142   9.807   1.549
   92    HZ2  TRP  13           2HZ      TRP  13   4.720  10.012   0.576
   93    HZ3  TRP  13           3HZ      TRP  13   0.757  11.436  -0.030
   94    HH2  TRP  13           HH       TRP  13   3.167  11.562  -0.488
   95    H    GLY  14           H        GLY  14  -2.398   7.902   6.124
   96   1HA   GLY  14          2HA       GLY  14  -1.010   6.180   8.019
   97   2HA   GLY  14          1HA       GLY  14  -2.561   7.065   8.194
   98    H    PHE  15           H        PHE  15  -1.066   4.289   6.547
   99    HA   PHE  15           HA       PHE  15  -3.620   2.861   6.815
  100   1HB   PHE  15          2HB       PHE  15  -2.837   1.519   4.850
  101   2HB   PHE  15          1HB       PHE  15  -2.858   3.265   4.522
  102    HD1  PHE  15           1HD      PHE  15  -0.862   4.562   4.485
  103    HD2  PHE  15           2HD      PHE  15  -0.568   0.340   5.023
  104    HE1  PHE  15           1HE      PHE  15   1.590   4.691   4.402
  105    HE2  PHE  15           2HE      PHE  15   1.812   0.473   4.584
  106    HZ   PHE  15           HZ       PHE  15   2.923   2.628   4.429
  107    H    ARG  16           H        ARG  16  -3.713   0.610   7.220
  108    HA   ARG  16           HA       ARG  16  -1.876   0.051   9.395
  109   1HB   ARG  16          2HB       ARG  16  -4.780  -0.659   8.833
  110   2HB   ARG  16          1HB       ARG  16  -3.806  -1.838   9.753
  111   1HG   ARG  16          2HG       ARG  16  -5.023  -0.579  11.269
  112   2HG   ARG  16          1HG       ARG  16  -3.285  -0.202  11.483
  113   1HD   ARG  16          2HD       ARG  16  -3.668   2.042  10.320
  114   2HD   ARG  16          1HD       ARG  16  -5.404   1.598  10.100
  115    HE   ARG  16           HE       ARG  16  -5.702   1.599  12.528
  116   1HH1  ARG  16          1HH1      ARG  16  -2.447   2.839  11.761
  117   2HH1  ARG  16          2HH1      ARG  16  -1.924   2.751  13.402
  118   1HH2  ARG  16          1HH2      ARG  16  -5.207   2.009  14.561
  119   2HH2  ARG  16          2HH2      ARG  16  -3.698   2.701  15.020
  120    H    LEU  17           H        LEU  17  -0.472  -1.682   9.151
  121    HA   LEU  17           HA       LEU  17  -0.849  -3.226   6.715
  122   1HB   LEU  17          2HB       LEU  17   1.560  -2.893   8.594
  123   2HB   LEU  17          1HB       LEU  17   1.536  -4.000   7.191
  124    HG   LEU  17           HG       LEU  17   2.730  -2.028   6.575
  125   1HD1  LEU  17          1HD1      LEU  17   1.652  -1.545   4.507
  126   2HD1  LEU  17          2HD1      LEU  17   0.001  -1.802   5.222
  127   3HD1  LEU  17          3HD1      LEU  17   1.130  -3.190   4.980
  128   1HD2  LEU  17          1HD2      LEU  17   2.009   0.237   6.736
  129   2HD2  LEU  17          2HD2      LEU  17   1.716  -0.506   8.345
  130   3HD2  LEU  17          3HD2      LEU  17   0.342  -0.214   7.210
  131    H    GLN  18           H        GLN  18  -1.045  -5.459   6.652
  132    HA   GLN  18           HA       GLN  18  -0.708  -6.916   9.141
  133   1HB   GLN  18          2HB       GLN  18  -3.225  -6.806   7.440
  134   2HB   GLN  18          1HB       GLN  18  -2.845  -8.268   8.401
  135   1HG   GLN  18          2HG       GLN  18  -3.134  -5.427   9.552
  136   2HG   GLN  18          1HG       GLN  18  -4.458  -6.650   9.487
  137   1HE2  GLN  18          1HE2      GLN  18  -3.884  -8.849  10.590
  138   2HE2  GLN  18          2HE2      GLN  18  -2.923  -8.758  12.036
  139    H    GLY  19           H        GLY  19   0.188  -8.790   8.871
  140   1HA   GLY  19          2HA       GLY  19   1.144 -10.572   7.903
  141   2HA   GLY  19          1HA       GLY  19   0.144 -10.267   6.447
  142    H    GLY  20           H        GLY  20   2.096 -11.259   5.433
  143   1HA   GLY  20          2HA       GLY  20   3.254  -9.592   3.795
  144   2HA   GLY  20          1HA       GLY  20   4.386  -9.540   5.195
  145    H    LYS  21           H        LYS  21   5.214 -10.366   2.662
  146    HA   LYS  21           HA       LYS  21   5.205 -12.870   1.982
  147   1HB   LYS  21          2HB       LYS  21   6.475 -10.696   1.119
  148   2HB   LYS  21          1HB       LYS  21   7.857 -11.349   2.028
  149   1HG   LYS  21          2HG       LYS  21   8.139 -12.152  -0.187
  150   2HG   LYS  21          1HG       LYS  21   7.421 -13.562   0.657
  151   1HD   LYS  21          2HD       LYS  21   5.107 -12.557  -0.110
  152   2HD   LYS  21          1HD       LYS  21   6.050 -11.505  -1.184
  153   1HE   LYS  21          2HE       LYS  21   6.051 -14.600  -1.303
  154   2HE   LYS  21          1HE       LYS  21   5.246 -13.463  -2.459
  155   1HZ   LYS  21          1HZ       LYS  21   7.560 -12.491  -2.787
  156   2HZ   LYS  21          2HZ       LYS  21   7.349 -14.044  -3.399
  157   3HZ   LYS  21          3HZ       LYS  21   8.151 -13.811  -1.949
  158    H    ASP  22           H        ASP  22   7.367 -11.680   4.529
  159    HA   ASP  22           HA       ASP  22   8.872 -13.952   4.830
  160   1HB   ASP  22          2HB       ASP  22   9.152 -11.506   5.699
  161   2HB   ASP  22          1HB       ASP  22   8.121 -12.003   7.082
  162    H    PHE  23           H        PHE  23   5.636 -13.277   5.980
  163    HA   PHE  23           HA       PHE  23   5.609 -15.484   7.835
  164   1HB   PHE  23          2HB       PHE  23   3.511 -13.365   7.036
  165   2HB   PHE  23          1HB       PHE  23   3.384 -14.504   8.417
  166    HD1  PHE  23           1HD      PHE  23   5.336 -14.431  10.125
  167    HD2  PHE  23           2HD      PHE  23   4.376 -11.273   7.456
  168    HE1  PHE  23           1HE      PHE  23   6.427 -12.835  11.630
  169    HE2  PHE  23           2HE      PHE  23   5.479  -9.670   8.955
  170    HZ   PHE  23           HZ       PHE  23   6.499 -10.451  11.043
  171    H    ASN  24           H        ASN  24   5.382 -15.280   4.621
  172    HA   ASN  24           HA       ASN  24   4.676 -16.480   3.054
  173   1HB   ASN  24          2HB       ASN  24   4.973 -18.386   4.735
  174   2HB   ASN  24          1HB       ASN  24   3.189 -18.371   4.930
  175   1HD2  ASN  24          1HD2      ASN  24   3.570 -20.692   4.176
  176   2HD2  ASN  24          2HD2      ASN  24   3.593 -20.960   2.457
  177    H    MET  25           H        MET  25   3.269 -14.178   3.699
  178    HA   MET  25           HA       MET  25   0.622 -14.856   2.662
  179   1HB   MET  25          2HB       MET  25   1.649 -13.141   4.848
  180   2HB   MET  25          1HB       MET  25   0.500 -12.269   3.836
  181   1HG   MET  25          2HG       MET  25  -0.902 -13.211   5.407
  182   2HG   MET  25          1HG       MET  25  -1.033 -14.407   4.092
  183   1HE   MET  25          1HE       MET  25  -2.126 -14.927   6.803
  184   2HE   MET  25          2HE       MET  25  -1.552 -16.582   7.197
  185   3HE   MET  25          3HE       MET  25  -2.063 -16.188   5.524
  186    HA   PRO  26           HA       PRO  26   1.602 -11.817  -0.487
  187   1HB   PRO  26          2HB       PRO  26  -0.990 -10.526  -0.684
  188   2HB   PRO  26          1HB       PRO  26  -0.416 -11.957  -1.576
  189   1HG   PRO  26          2HG       PRO  26  -2.429 -11.840   0.555
  190   2HG   PRO  26          1HG       PRO  26  -1.939 -13.212  -0.487
  191   1HD   PRO  26          2HD       PRO  26  -1.028 -12.285   2.273
  192   2HD   PRO  26          1HD       PRO  26  -0.985 -13.995   1.691
  193    H    LEU  27           H        LEU  27   1.951  -9.390  -0.685
  194    HA   LEU  27           HA       LEU  27   2.140  -8.021   1.740
  195   1HB   LEU  27          2HB       LEU  27   3.165  -7.756  -0.750
  196   2HB   LEU  27          1HB       LEU  27   1.794  -6.674  -0.986
  197    HG   LEU  27           HG       LEU  27   3.907  -6.548   1.225
  198   1HD1  LEU  27          1HD1      LEU  27   3.587  -4.934  -1.394
  199   2HD1  LEU  27          2HD1      LEU  27   4.865  -6.144  -0.992
  200   3HD1  LEU  27          3HD1      LEU  27   4.815  -4.564  -0.118
  201   1HD2  LEU  27          1HD2      LEU  27   3.128  -4.169   1.649
  202   2HD2  LEU  27          2HD2      LEU  27   1.883  -5.390   2.066
  203   3HD2  LEU  27          3HD2      LEU  27   1.748  -4.444   0.533
  204    H    THR  28           H        THR  28   0.376  -7.611   2.965
  205    HA   THR  28           HA       THR  28  -2.056  -6.748   1.553
  206    HB   THR  28           HB       THR  28  -3.505  -7.878   2.562
  207    HG1  THR  28           1HG      THR  28  -1.815  -8.121   4.808
  208   1HG2  THR  28          1HG2      THR  28  -1.155  -9.771   3.171
  209   2HG2  THR  28          2HG2      THR  28  -1.608  -9.284   1.491
  210   3HG2  THR  28          3HG2      THR  28  -2.813 -10.168   2.533
  211    H    ILE  29           H        ILE  29  -3.368  -5.313   2.476
  212    HA   ILE  29           HA       ILE  29  -2.330  -3.789   4.791
  213    HB   ILE  29           HB       ILE  29  -3.487  -2.682   2.235
  214   1HG1  ILE  29          2HG1      ILE  29  -0.743  -2.946   3.517
  215   2HG1  ILE  29          1HG1      ILE  29  -1.228  -3.333   1.849
  216   1HG2  ILE  29          1HG2      ILE  29  -2.621  -1.297   4.868
  217   2HG2  ILE  29          2HG2      ILE  29  -4.324  -1.420   4.228
  218   3HG2  ILE  29          3HG2      ILE  29  -3.117  -0.457   3.362
  219   1HD1  ILE  29          1HD1      ILE  29  -1.314  -1.001   1.217
  220   2HD1  ILE  29          2HD1      ILE  29   0.245  -1.312   2.089
  221   3HD1  ILE  29          3HD1      ILE  29  -1.068  -0.439   2.923
  222    H    SER  30           H        SER  30  -4.016  -2.926   6.132
  223    HA   SER  30           HA       SER  30  -6.546  -4.398   5.882
  224   1HB   SER  30          2HB       SER  30  -5.370  -5.022   7.830
  225   2HB   SER  30          1HB       SER  30  -5.017  -3.345   8.288
  226    HG   SER  30           HG       SER  30  -6.804  -3.892   9.464
  227    H    ARG  31           H        ARG  31  -5.857  -1.293   7.587
  228    HA   ARG  31           HA       ARG  31  -8.206  -0.230   6.197
  229   1HB   ARG  31          2HB       ARG  31  -8.113  -1.524   8.614
  230   2HB   ARG  31          1HB       ARG  31  -7.810   0.119   9.191
  231   1HG   ARG  31          2HG       ARG  31 -10.185  -0.774   7.404
  232   2HG   ARG  31          1HG       ARG  31 -10.200  -0.852   9.182
  233   1HD   ARG  31          2HD       ARG  31  -9.970   1.712   7.513
  234   2HD   ARG  31          1HD       ARG  31 -11.436   1.156   8.404
  235    HE   ARG  31           HE       ARG  31  -9.114   2.519   9.514
  236   1HH1  ARG  31          1HH1      ARG  31 -11.795   0.309  10.421
  237   2HH1  ARG  31          2HH1      ARG  31 -11.644   0.690  12.105
  238   1HH2  ARG  31          1HH2      ARG  31  -8.802   2.737  11.769
  239   2HH2  ARG  31          2HH2      ARG  31  -9.943   2.088  12.871
  240    H    ILE  32           H        ILE  32  -8.360   2.065   6.085
  241    HA   ILE  32           HA       ILE  32  -5.940   3.536   6.463
  242    HB   ILE  32           HB       ILE  32  -8.712   4.070   5.446
  243   1HG1  ILE  32          2HG1      ILE  32  -7.701   4.855   3.454
  244   2HG1  ILE  32          1HG1      ILE  32  -6.065   4.849   4.083
  245   1HG2  ILE  32          1HG2      ILE  32  -6.524   6.166   5.996
  246   2HG2  ILE  32          2HG2      ILE  32  -8.208   6.155   6.700
  247   3HG2  ILE  32          3HG2      ILE  32  -7.969   6.407   4.946
  248   1HD1  ILE  32          1HD1      ILE  32  -6.187   2.256   4.099
  249   2HD1  ILE  32          2HD1      ILE  32  -6.354   3.053   2.491
  250   3HD1  ILE  32          3HD1      ILE  32  -7.828   2.439   3.331
  251    H    THR  33           H        THR  33  -5.508   5.089   7.987
  252    HA   THR  33           HA       THR  33  -7.113   5.240  10.332
  253    HB   THR  33           HB       THR  33  -4.510   6.481   9.426
  254    HG1  THR  33           1HG      THR  33  -3.695   5.141  10.860
  255   1HG2  THR  33          1HG2      THR  33  -4.269   7.419  11.759
  256   2HG2  THR  33          2HG2      THR  33  -5.999   7.009  12.087
  257   3HG2  THR  33          3HG2      THR  33  -5.590   8.218  10.841
  258    HA   PRO  34           HA       PRO  34  -9.224   8.766   8.792
  259   1HB   PRO  34          2HB       PRO  34 -10.380   9.821  11.064
  260   2HB   PRO  34          1HB       PRO  34 -10.745   8.143  10.440
  261   1HG   PRO  34          2HG       PRO  34  -8.647   8.728  12.589
  262   2HG   PRO  34          1HG       PRO  34 -10.154   7.719  12.757
  263   1HD   PRO  34          2HD       PRO  34  -7.859   6.505  11.955
  264   2HD   PRO  34          1HD       PRO  34  -9.370   6.146  11.032
  265    H    GLY  35           H        GLY  35  -9.311  11.098   8.774
  266   1HA   GLY  35          2HA       GLY  35  -8.379  13.111   8.816
  267   2HA   GLY  35          1HA       GLY  35  -7.397  12.597  10.227
  268    H    SER  36           H        SER  36  -7.211  10.782   7.322
  269    HA   SER  36           HA       SER  36  -4.436  11.694   6.985
  270   1HB   SER  36          2HB       SER  36  -5.063   9.341   7.835
  271   2HB   SER  36          1HB       SER  36  -5.696   9.000   6.207
  272    HG   SER  36           HG       SER  36  -3.090   9.543   7.112
  273    H    LYS  37           H        LYS  37  -3.455  11.394   4.804
  274    HA   LYS  37           HA       LYS  37  -5.124  12.296   2.666
  275   1HB   LYS  37          2HB       LYS  37  -2.241  11.783   3.167
  276   2HB   LYS  37          1HB       LYS  37  -2.731  11.336   1.519
  277   1HG   LYS  37          2HG       LYS  37  -3.445  14.075   2.690
  278   2HG   LYS  37          1HG       LYS  37  -1.851  13.701   1.958
  279   1HD   LYS  37          2HD       LYS  37  -2.886  12.983  -0.142
  280   2HD   LYS  37          1HD       LYS  37  -4.523  13.387   0.475
  281   1HE   LYS  37          2HE       LYS  37  -3.959  15.781   0.609
  282   2HE   LYS  37          1HE       LYS  37  -2.214  15.435   0.284
  283   1HZ   LYS  37          1HZ       LYS  37  -2.779  14.736  -1.942
  284   2HZ   LYS  37          2HZ       LYS  37  -3.497  16.239  -1.654
  285   3HZ   LYS  37          3HZ       LYS  37  -4.439  14.862  -1.608
  286    H    ALA  38           H        ALA  38  -3.983   9.303   3.951
  287    HA   ALA  38           HA       ALA  38  -4.729   7.470   1.964
  288   1HB   ALA  38          1HB       ALA  38  -4.725   7.096   4.994
  289   2HB   ALA  38          2HB       ALA  38  -3.243   7.126   3.968
  290   3HB   ALA  38          3HB       ALA  38  -4.450   5.859   3.695
  291    H    ALA  39           H        ALA  39  -6.707   9.304   4.241
  292    HA   ALA  39           HA       ALA  39  -8.981   7.632   3.620
  293   1HB   ALA  39          1HB       ALA  39  -8.599   8.459   5.974
  294   2HB   ALA  39          2HB       ALA  39 -10.138   9.097   5.314
  295   3HB   ALA  39          3HB       ALA  39  -8.684  10.159   5.391
  296    H    GLN  40           H        GLN  40  -8.068  11.069   3.300
  297    HA   GLN  40           HA       GLN  40 -10.384  11.968   2.180
  298   1HB   GLN  40          2HB       GLN  40  -7.551  12.864   2.417
  299   2HB   GLN  40          1HB       GLN  40  -8.450  13.701   1.146
  300   1HG   GLN  40          2HG       GLN  40  -9.470  13.487   4.039
  301   2HG   GLN  40          1HG       GLN  40  -8.431  14.818   3.427
  302   1HE2  GLN  40          1HE2      GLN  40 -11.487  14.536   4.340
  303   2HE2  GLN  40          2HE2      GLN  40 -12.271  15.456   3.102
  304    H    SER  41           H        SER  41  -7.588  10.649   0.397
  305    HA   SER  41           HA       SER  41  -8.658  11.858  -2.006
  306   1HB   SER  41          2HB       SER  41  -6.285  12.037  -1.309
  307   2HB   SER  41          1HB       SER  41  -6.079  10.283  -1.595
  308    HG   SER  41           HG       SER  41  -5.668  12.084  -3.315
  309    H    GLN  42           H        GLN  42  -7.498   9.875  -3.790
  310    HA   GLN  42           HA       GLN  42  -9.799   8.153  -3.979
  311   1HB   GLN  42          2HB       GLN  42  -7.452   8.918  -5.698
  312   2HB   GLN  42          1HB       GLN  42  -8.221   7.364  -6.086
  313   1HG   GLN  42          2HG       GLN  42  -9.768  10.024  -5.926
  314   2HG   GLN  42          1HG       GLN  42  -9.099   9.283  -7.424
  315   1HE2  GLN  42          1HE2      GLN  42 -11.753   9.214  -5.138
  316   2HE2  GLN  42          2HE2      GLN  42 -12.597   7.872  -5.869
  317    H    LEU  43           H        LEU  43  -7.324   7.814  -1.999
  318    HA   LEU  43           HA       LEU  43  -6.378   5.230  -2.729
  319   1HB   LEU  43          2HB       LEU  43  -5.152   7.217  -1.499
  320   2HB   LEU  43          1HB       LEU  43  -5.983   6.622  -0.039
  321    HG   LEU  43           HG       LEU  43  -4.942   4.255  -0.810
  322   1HD1  LEU  43          1HD1      LEU  43  -3.055   6.274  -2.191
  323   2HD1  LEU  43          2HD1      LEU  43  -4.191   5.186  -3.045
  324   3HD1  LEU  43          3HD1      LEU  43  -2.828   4.486  -2.088
  325   1HD2  LEU  43          1HD2      LEU  43  -2.797   4.850   0.472
  326   2HD2  LEU  43          2HD2      LEU  43  -4.343   5.243   1.311
  327   3HD2  LEU  43          3HD2      LEU  43  -3.379   6.545   0.517
  328    H    SER  44           H        SER  44  -6.992   3.262  -2.039
  329    HA   SER  44           HA       SER  44  -8.026   3.084   0.662
  330   1HB   SER  44          2HB       SER  44  -9.335   1.633  -1.705
  331   2HB   SER  44          1HB       SER  44  -9.576   1.217   0.039
  332    HG   SER  44           HG       SER  44 -10.350   3.548  -1.333
  333    H    GLN  45           H        GLN  45  -5.587   2.683   0.707
  334    HA   GLN  45           HA       GLN  45  -4.695   0.195  -0.274
  335   1HB   GLN  45          2HB       GLN  45  -3.644   1.933   1.998
  336   2HB   GLN  45          1HB       GLN  45  -2.928   0.376   1.494
  337   1HG   GLN  45          2HG       GLN  45  -2.702   1.296  -0.846
  338   2HG   GLN  45          1HG       GLN  45  -3.030   2.921  -0.204
  339   1HE2  GLN  45          2HE2      GLN  45  -1.176   4.059   0.574
  340   2HE2  GLN  45          1HE2      GLN  45   0.333   3.323   0.966
  341    H    GLY  46           H        GLY  46  -5.613  -1.714   0.255
  342   1HA   GLY  46          2HA       GLY  46  -5.626  -2.639   2.871
  343   2HA   GLY  46          1HA       GLY  46  -7.248  -2.005   2.501
  344    H    ASP  47           H        ASP  47  -4.810  -3.767   0.509
  345    HA   ASP  47           HA       ASP  47  -6.484  -6.043   0.213
  346   1HB   ASP  47          2HB       ASP  47  -7.254  -3.891  -1.333
  347   2HB   ASP  47          1HB       ASP  47  -5.949  -4.484  -2.382
  348    H    LEU  48           H        LEU  48  -5.218  -7.021  -2.170
  349    HA   LEU  48           HA       LEU  48  -2.582  -7.424  -1.099
  350   1HB   LEU  48          2HB       LEU  48  -3.893  -8.639  -3.573
  351   2HB   LEU  48          1HB       LEU  48  -2.273  -9.021  -2.923
  352    HG   LEU  48           HG       LEU  48  -3.441 -10.780  -2.019
  353   1HD1  LEU  48          1HD1      LEU  48  -3.956 -10.472   0.351
  354   2HD1  LEU  48          2HD1      LEU  48  -4.205  -8.705   0.152
  355   3HD1  LEU  48          3HD1      LEU  48  -2.550  -9.394  -0.103
  356   1HD2  LEU  48          1HD2      LEU  48  -5.667  -9.812  -2.985
  357   2HD2  LEU  48          2HD2      LEU  48  -5.815  -8.919  -1.416
  358   3HD2  LEU  48          3HD2      LEU  48  -5.805 -10.736  -1.392
  359    H    VAL  49           H        VAL  49  -0.973  -6.209  -1.515
  360    HA   VAL  49           HA       VAL  49  -1.163  -4.248  -3.566
  361    HB   VAL  49           HB       VAL  49   1.075  -4.805  -1.597
  362   1HG1  VAL  49          1HG1      VAL  49   1.485  -2.353  -1.899
  363   2HG1  VAL  49          2HG1      VAL  49   0.199  -2.288  -3.166
  364   3HG1  VAL  49          3HG1      VAL  49   1.719  -3.243  -3.453
  365   1HG2  VAL  49          1HG2      VAL  49  -1.499  -3.100  -1.345
  366   2HG2  VAL  49          2HG2      VAL  49  -0.097  -3.031  -0.218
  367   3HG2  VAL  49          3HG2      VAL  49  -1.057  -4.532  -0.343
  368    H    VAL  50           H        VAL  50  -0.033  -4.168  -5.543
  369    HA   VAL  50           HA       VAL  50   1.514  -6.550  -6.184
  370    HB   VAL  50           HB       VAL  50   0.489  -4.550  -8.217
  371   1HG1  VAL  50          1HG1      VAL  50   2.246  -6.250  -8.868
  372   2HG1  VAL  50          2HG1      VAL  50   0.653  -6.593  -9.637
  373   3HG1  VAL  50          3HG1      VAL  50   1.194  -7.557  -8.213
  374   1HG2  VAL  50          1HG2      VAL  50  -1.503  -5.075  -7.051
  375   2HG2  VAL  50          2HG2      VAL  50  -1.068  -6.838  -6.888
  376   3HG2  VAL  50          3HG2      VAL  50  -1.434  -6.115  -8.513
  377    H    ALA  51           H        ALA  51   1.492  -3.157  -7.242
  378    HA   ALA  51           HA       ALA  51   4.423  -3.205  -7.248
  379   1HB   ALA  51          1HB       ALA  51   4.325  -1.590  -9.137
  380   2HB   ALA  51          2HB       ALA  51   2.525  -1.629  -9.074
  381   3HB   ALA  51          3HB       ALA  51   3.442  -3.102  -9.541
  382    H    ILE  52           H        ILE  52   5.578  -1.571  -6.496
  383    HA   ILE  52           HA       ILE  52   4.172   0.590  -5.134
  384    HB   ILE  52           HB       ILE  52   5.471  -1.424  -3.965
  385   1HG1  ILE  52          2HG1      ILE  52   5.482   1.374  -2.738
  386   2HG1  ILE  52          1HG1      ILE  52   3.964   0.479  -3.066
  387   1HG2  ILE  52          1HG2      ILE  52   7.703  -0.794  -4.840
  388   2HG2  ILE  52          2HG2      ILE  52   7.629  -0.642  -3.046
  389   3HG2  ILE  52          3HG2      ILE  52   7.539   0.838  -4.080
  390   1HD1  ILE  52          1HD1      ILE  52   6.251  -0.573  -1.284
  391   2HD1  ILE  52          2HD1      ILE  52   4.723  -1.442  -1.675
  392   3HD1  ILE  52          3HD1      ILE  52   4.665   0.078  -0.729
  393    H    ASP  53           H        ASP  53   4.381   2.357  -6.143
  394    HA   ASP  53           HA       ASP  53   4.866   3.755  -7.676
  395   1HB   ASP  53          2HB       ASP  53   6.389   4.143  -5.601
  396   2HB   ASP  53          1HB       ASP  53   7.742   3.704  -6.698
  397    H    GLY  54           H        GLY  54   4.790   1.246  -8.783
  398   1HA   GLY  54          2HA       GLY  54   4.963   0.721 -10.990
  399   2HA   GLY  54          1HA       GLY  54   6.484   1.644 -11.132
  400    H    VAL  55           H        VAL  55   7.096   0.004  -8.377
  401    HA   VAL  55           HA       VAL  55   8.407  -2.071  -9.954
  402    HB   VAL  55           HB       VAL  55   9.060  -1.041  -7.182
  403   1HG1  VAL  55          1HG1      VAL  55   9.767  -3.420  -7.535
  404   2HG1  VAL  55          2HG1      VAL  55  11.198  -2.337  -7.616
  405   3HG1  VAL  55          3HG1      VAL  55  10.473  -2.987  -9.132
  406   1HG2  VAL  55          1HG2      VAL  55   9.468   0.711  -8.922
  407   2HG2  VAL  55          2HG2      VAL  55  10.350  -0.489  -9.942
  408   3HG2  VAL  55          3HG2      VAL  55  11.017   0.013  -8.343
  409    H    ASN  56           H        ASN  56   7.791  -4.155  -9.753
  410    HA   ASN  56           HA       ASN  56   5.641  -4.793  -8.094
  411   1HB   ASN  56          2HB       ASN  56   5.812  -7.025  -9.026
  412   2HB   ASN  56          1HB       ASN  56   6.026  -5.736 -10.273
  413   1HD2  ASN  56          1HD2      ASN  56   8.994  -6.190  -8.520
  414   2HD2  ASN  56          2HD2      ASN  56   9.732  -7.137  -9.787
  415    H    THR  57           H        THR  57   5.411  -6.130  -6.248
  416    HA   THR  57           HA       THR  57   7.666  -5.681  -4.516
  417    HB   THR  57           HB       THR  57   5.988  -5.963  -2.718
  418    HG1  THR  57           1HG      THR  57   4.130  -5.948  -4.823
  419   1HG2  THR  57          1HG2      THR  57   4.799  -3.846  -3.201
  420   2HG2  THR  57          2HG2      THR  57   5.263  -3.935  -4.938
  421   3HG2  THR  57          3HG2      THR  57   6.533  -3.718  -3.681
  422    H    ASP  58           H        ASP  58   8.287  -7.853  -6.026
  423    HA   ASP  58           HA       ASP  58   7.282 -10.241  -5.138
  424   1HB   ASP  58          2HB       ASP  58   9.119 -11.297  -6.349
  425   2HB   ASP  58          1HB       ASP  58   8.374  -9.956  -7.287
  426    H    THR  59           H        THR  59  10.347  -8.762  -4.128
  427    HA   THR  59           HA       THR  59  10.353 -10.585  -1.828
  428    HB   THR  59           HB       THR  59  12.208 -10.908  -3.313
  429    HG1  THR  59           1HG      THR  59  12.882  -9.499  -0.989
  430   1HG2  THR  59          1HG2      THR  59  12.746  -7.890  -2.909
  431   2HG2  THR  59          2HG2      THR  59  12.308  -8.724  -4.450
  432   3HG2  THR  59          3HG2      THR  59  13.882  -9.066  -3.678
  433    H    MET  60           H        MET  60   8.982  -7.848  -2.253
  434    HA   MET  60           HA       MET  60  10.090  -6.294  -0.120
  435   1HB   MET  60          2HB       MET  60   7.818  -6.226  -2.085
  436   2HB   MET  60          1HB       MET  60   7.608  -5.241  -0.599
  437   1HG   MET  60          2HG       MET  60   8.424  -3.784  -2.241
  438   2HG   MET  60          1HG       MET  60   9.781  -4.059  -1.116
  439   1HE   MET  60          1HE       MET  60  10.641  -3.437  -5.106
  440   2HE   MET  60          2HE       MET  60  10.116  -2.593  -3.609
  441   3HE   MET  60          3HE       MET  60   8.908  -3.438  -4.639
  442    H    THR  61           H        THR  61   9.727  -6.647   1.967
  443    HA   THR  61           HA       THR  61   7.644  -8.449   2.836
  444    HB   THR  61           HB       THR  61   8.881  -8.339   4.956
  445    HG1  THR  61           1HG      THR  61  10.771  -7.198   4.983
  446   1HG2  THR  61          1HG2      THR  61   9.527  -9.969   3.133
  447   2HG2  THR  61          2HG2      THR  61  10.949  -9.426   4.096
  448   3HG2  THR  61          3HG2      THR  61  10.663  -8.749   2.454
  449    H    HIS  62           H        HIS  62   6.845  -7.612   5.211
  450    HA   HIS  62           HA       HIS  62   5.307  -5.338   5.028
  451   1HB   HIS  62          2HB       HIS  62   4.958  -7.097   6.691
  452   2HB   HIS  62          1HB       HIS  62   6.570  -6.817   7.404
  453    HD1  HIS  62           1HD      HIS  62   6.742  -4.145   8.498
  454    HD2  HIS  62           2HD      HIS  62   3.012  -6.040   8.213
  455    HE1  HIS  62           1HE      HIS  62   5.213  -3.101  10.229
  456    H    LEU  63           H        LEU  63   8.532  -5.712   6.564
  457    HA   LEU  63           HA       LEU  63   8.864  -3.060   7.270
  458   1HB   LEU  63          2HB       LEU  63  10.173  -4.981   8.167
  459   2HB   LEU  63          1HB       LEU  63  10.935  -5.192   6.564
  460    HG   LEU  63           HG       LEU  63  11.873  -2.835   6.763
  461   1HD1  LEU  63          1HD1      LEU  63  10.299  -1.894   8.498
  462   2HD1  LEU  63          2HD1      LEU  63  12.010  -1.821   9.050
  463   3HD1  LEU  63          3HD1      LEU  63  10.915  -3.100   9.698
  464   1HD2  LEU  63          1HD2      LEU  63  13.184  -4.855   7.172
  465   2HD2  LEU  63          2HD2      LEU  63  12.684  -4.871   8.916
  466   3HD2  LEU  63          3HD2      LEU  63  13.701  -3.518   8.269
  467    H    GLU  64           H        GLU  64  10.098  -4.740   4.278
  468    HA   GLU  64           HA       GLU  64  11.281  -2.450   3.356
  469   1HB   GLU  64          2HB       GLU  64  11.208  -5.027   2.416
  470   2HB   GLU  64          1HB       GLU  64  10.243  -4.194   1.157
  471   1HG   GLU  64          2HG       GLU  64  12.129  -2.411   1.099
  472   2HG   GLU  64          1HG       GLU  64  13.040  -3.485   2.215
  473    H    ALA  65           H        ALA  65   7.955  -3.645   2.611
  474    HA   ALA  65           HA       ALA  65   7.340  -1.631   0.820
  475   1HB   ALA  65          1HB       ALA  65   6.265  -3.876   1.169
  476   2HB   ALA  65          2HB       ALA  65   5.041  -2.532   1.112
  477   3HB   ALA  65          3HB       ALA  65   5.527  -3.271   2.692
  478    H    GLN  66           H        GLN  66   6.959  -1.729   4.340
  479    HA   GLN  66           HA       GLN  66   5.628   0.660   4.707
  480   1HB   GLN  66          2HB       GLN  66   6.060  -1.110   6.444
  481   2HB   GLN  66          1HB       GLN  66   7.785  -0.880   6.237
  482   1HG   GLN  66          2HG       GLN  66   7.483   0.087   8.243
  483   2HG   GLN  66          1HG       GLN  66   7.492   1.541   7.212
  484   1HE2  GLN  66          1HE2      GLN  66   4.488   0.220   6.586
  485   2HE2  GLN  66          2HE2      GLN  66   3.581   0.946   7.889
  486    H    ASN  67           H        ASN  67   9.119  -0.015   4.490
  487    HA   ASN  67           HA       ASN  67   9.949   2.649   4.753
  488   1HB   ASN  67          2HB       ASN  67  11.191  -0.010   3.896
  489   2HB   ASN  67          1HB       ASN  67  12.111   1.495   3.565
  490   1HD2  ASN  67          1HD2      ASN  67  11.080  -0.699   6.106
  491   2HD2  ASN  67          2HD2      ASN  67  12.033   0.094   7.339
  492    H    LYS  68           H        LYS  68   9.198   0.754   1.851
  493    HA   LYS  68           HA       LYS  68  10.061   2.635   0.014
  494   1HB   LYS  68          2HB       LYS  68   7.726   0.665  -0.157
  495   2HB   LYS  68          1HB       LYS  68   8.388   1.571  -1.561
  496   1HG   LYS  68          2HG       LYS  68   9.970  -0.483   0.096
  497   2HG   LYS  68          1HG       LYS  68   9.155  -0.785  -1.453
  498   1HD   LYS  68          2HD       LYS  68  10.637   0.840  -2.584
  499   2HD   LYS  68          1HD       LYS  68  11.409   1.286  -1.023
  500   1HE   LYS  68          2HE       LYS  68  12.257  -1.033  -0.703
  501   2HE   LYS  68          1HE       LYS  68  11.415  -1.566  -2.197
  502   1HZ   LYS  68          1HZ       LYS  68  12.769   0.206  -3.373
  503   2HZ   LYS  68          2HZ       LYS  68  13.592  -1.162  -2.799
  504   3HZ   LYS  68          3HZ       LYS  68  13.723   0.321  -1.997
  505    H    ILE  69           H        ILE  69   6.601   2.246   1.129
  506    HA   ILE  69           HA       ILE  69   5.646   4.543   0.156
  507    HB   ILE  69           HB       ILE  69   5.095   2.894   2.621
  508   1HG1  ILE  69          2HG1      ILE  69   3.646   3.444  -0.039
  509   2HG1  ILE  69          1HG1      ILE  69   4.497   1.939   0.330
  510   1HG2  ILE  69          1HG2      ILE  69   4.380   5.137   3.285
  511   2HG2  ILE  69          2HG2      ILE  69   2.900   4.289   2.749
  512   3HG2  ILE  69          3HG2      ILE  69   3.690   5.458   1.646
  513   1HD1  ILE  69          1HD1      ILE  69   2.961   1.476   2.257
  514   2HD1  ILE  69          2HD1      ILE  69   2.177   1.471   0.625
  515   3HD1  ILE  69          3HD1      ILE  69   1.926   2.855   1.732
  516    H    LYS  70           H        LYS  70   7.358   4.291   3.312
  517    HA   LYS  70           HA       LYS  70   6.887   7.040   3.839
  518   1HB   LYS  70          2HB       LYS  70   8.368   4.767   5.131
  519   2HB   LYS  70          1HB       LYS  70   8.781   6.412   5.654
  520   1HG   LYS  70          2HG       LYS  70   7.218   5.409   7.143
  521   2HG   LYS  70          1HG       LYS  70   6.586   6.918   6.432
  522   1HD   LYS  70          2HD       LYS  70   4.856   5.835   5.301
  523   2HD   LYS  70          1HD       LYS  70   5.810   4.350   5.052
  524   1HE   LYS  70          2HE       LYS  70   3.984   3.799   6.520
  525   2HE   LYS  70          1HE       LYS  70   5.540   3.682   7.432
  526   1HZ   LYS  70          1HZ       LYS  70   3.759   6.081   7.538
  527   2HZ   LYS  70          2HZ       LYS  70   5.030   5.700   8.568
  528   3HZ   LYS  70          3HZ       LYS  70   3.617   4.767   8.553
  529    H    SER  71           H        SER  71   8.874   5.939   1.457
  530    HA   SER  71           HA       SER  71  11.068   7.725   2.135
  531   1HB   SER  71          2HB       SER  71  12.270   6.834   0.291
  532   2HB   SER  71          1HB       SER  71  11.567   5.452   1.179
  533    HG   SER  71           HG       SER  71   9.983   5.305  -0.417
  534    H    ALA  72           H        ALA  72   8.174   7.646   0.394
  535    HA   ALA  72           HA       ALA  72   8.979   9.559  -1.624
  536   1HB   ALA  72          1HB       ALA  72   7.793   7.414  -2.167
  537   2HB   ALA  72          2HB       ALA  72   6.797   8.827  -2.675
  538   3HB   ALA  72          3HB       ALA  72   6.419   7.932  -1.145
  539    H    SER  73           H        SER  73   7.350  11.238  -2.280
  540    HA   SER  73           HA       SER  73   5.600  12.180  -0.210
  541   1HB   SER  73          2HB       SER  73   6.556  14.454  -0.053
  542   2HB   SER  73          1HB       SER  73   7.604  13.192   0.670
  543    HG   SER  73           HG       SER  73   8.813  14.622  -0.640
  544    H    TYR  74           H        TYR  74   7.271  13.553  -3.025
  545    HA   TYR  74           HA       TYR  74   5.113  14.925  -4.019
  546   1HB   TYR  74          2HB       TYR  74   7.515  13.701  -5.522
  547   2HB   TYR  74          1HB       TYR  74   6.386  14.911  -6.231
  548    HD1  TYR  74           1HD      TYR  74   6.169  17.125  -5.208
  549    HD2  TYR  74           2HD      TYR  74   9.223  14.409  -4.040
  550    HE1  TYR  74           1HE      TYR  74   7.455  18.983  -4.270
  551    HE2  TYR  74           2HE      TYR  74  10.492  16.253  -3.057
  552    HH   TYR  74           HH       TYR  74   9.205  19.549  -2.979
  553    H    ASN  75           H        ASN  75   6.266  11.706  -5.103
  554    HA   ASN  75           HA       ASN  75   3.462  11.150  -5.700
  555   1HB   ASN  75          2HB       ASN  75   3.949   9.949  -7.778
  556   2HB   ASN  75          1HB       ASN  75   4.320  11.700  -7.863
  557   1HD2  ASN  75          1HD2      ASN  75   5.971   8.500  -7.165
  558   2HD2  ASN  75          2HD2      ASN  75   7.177   8.796  -8.373
  559    H    LEU  76           H        LEU  76   2.710   9.517  -4.723
  560    HA   LEU  76           HA       LEU  76   4.471   7.177  -4.349
  561   1HB   LEU  76          2HB       LEU  76   3.973   8.333  -2.199
  562   2HB   LEU  76          1HB       LEU  76   2.244   8.313  -2.549
  563    HG   LEU  76           HG       LEU  76   2.310   5.760  -2.511
  564   1HD1  LEU  76          1HD1      LEU  76   5.124   6.182  -1.308
  565   2HD1  LEU  76          2HD1      LEU  76   4.856   5.537  -2.982
  566   3HD1  LEU  76          3HD1      LEU  76   4.278   4.617  -1.548
  567   1HD2  LEU  76          1HD2      LEU  76   2.369   5.562  -0.080
  568   2HD2  LEU  76          2HD2      LEU  76   1.670   7.189  -0.484
  569   3HD2  LEU  76          3HD2      LEU  76   3.375   7.044   0.064
  570    H    SER  77           H        SER  77   3.835   6.026  -6.221
  571    HA   SER  77           HA       SER  77   0.962   5.836  -6.673
  572   1HB   SER  77          2HB       SER  77   2.614   6.622  -8.456
  573   2HB   SER  77          1HB       SER  77   3.157   4.922  -8.563
  574    HG   SER  77           HG       SER  77   0.729   6.136  -9.245
  575    H    LEU  78           H        LEU  78  -0.016   4.186  -5.579
  576    HA   LEU  78           HA       LEU  78   1.411   1.612  -5.476
  577   1HB   LEU  78          2HB       LEU  78  -0.904   2.840  -3.958
  578   2HB   LEU  78          1HB       LEU  78  -0.644   1.089  -3.904
  579    HG   LEU  78           HG       LEU  78   0.284   2.626  -1.997
  580   1HD1  LEU  78          1HD1      LEU  78   1.997   0.842  -1.540
  581   2HD1  LEU  78          2HD1      LEU  78   1.798   0.228  -3.228
  582   3HD1  LEU  78          3HD1      LEU  78   0.412   0.164  -2.066
  583   1HD2  LEU  78          1HD2      LEU  78   2.606   3.188  -2.072
  584   2HD2  LEU  78          2HD2      LEU  78   1.765   4.056  -3.414
  585   3HD2  LEU  78          3HD2      LEU  78   2.785   2.607  -3.775
  586    H    THR  79           H        THR  79   0.537  -0.208  -6.267
  587    HA   THR  79           HA       THR  79  -2.111  -0.118  -7.509
  588    HB   THR  79           HB       THR  79   0.218  -1.744  -8.619
  589    HG1  THR  79           1HG      THR  79  -0.111  -0.216 -10.371
  590   1HG2  THR  79          1HG2      THR  79  -2.618  -0.966  -9.589
  591   2HG2  THR  79          2HG2      THR  79  -2.114  -2.603  -9.009
  592   3HG2  THR  79          3HG2      THR  79  -1.422  -1.948 -10.537
  593    H    LEU  80           H        LEU  80  -3.318  -1.423  -6.129
  594    HA   LEU  80           HA       LEU  80  -2.289  -4.069  -5.443
  595   1HB   LEU  80          2HB       LEU  80  -3.430  -3.976  -3.348
  596   2HB   LEU  80          1HB       LEU  80  -2.215  -2.621  -3.456
  597    HG   LEU  80           HG       LEU  80  -5.201  -2.447  -3.829
  598   1HD1  LEU  80          1HD1      LEU  80  -4.354  -3.042  -1.516
  599   2HD1  LEU  80          2HD1      LEU  80  -5.235  -1.429  -1.600
  600   3HD1  LEU  80          3HD1      LEU  80  -3.402  -1.484  -1.520
  601   1HD2  LEU  80          1HD2      LEU  80  -2.803  -0.539  -3.941
  602   2HD2  LEU  80          2HD2      LEU  80  -4.364   0.150  -3.286
  603   3HD2  LEU  80          3HD2      LEU  80  -4.302  -0.539  -4.980
  604    H    GLN  81           H        GLN  81  -4.261  -5.548  -4.990
  605    HA   GLN  81           HA       GLN  81  -6.076  -5.215  -7.159
  606   1HB   GLN  81          2HB       GLN  81  -6.152  -7.256  -4.928
  607   2HB   GLN  81          1HB       GLN  81  -7.086  -7.308  -6.450
  608   1HG   GLN  81          2HG       GLN  81  -4.018  -7.481  -6.293
  609   2HG   GLN  81          1HG       GLN  81  -5.138  -8.869  -6.341
  610   1HE2  GLN  81          1HE2      GLN  81  -3.115  -7.148  -8.258
  611   2HE2  GLN  81          2HE2      GLN  81  -3.881  -7.413  -9.804
  612    H    LYS  82           H        LYS  82  -8.434  -5.355  -6.916
  613    HA   LYS  82           HA       LYS  82  -9.377  -4.803  -4.172
  614   1HB   LYS  82          2HB       LYS  82 -10.329  -3.808  -6.760
  615   2HB   LYS  82          1HB       LYS  82 -11.617  -4.745  -5.962
  616   1HG   LYS  82          2HG       LYS  82 -11.850  -2.420  -5.331
  617   2HG   LYS  82          1HG       LYS  82 -11.391  -3.387  -3.902
  618   1HD   LYS  82          2HD       LYS  82  -8.936  -2.493  -5.146
  619   2HD   LYS  82          1HD       LYS  82 -10.010  -1.085  -5.145
  620   1HE   LYS  82          2HE       LYS  82  -9.460  -2.827  -2.629
  621   2HE   LYS  82          1HE       LYS  82  -8.448  -1.405  -3.087
  622   1HZ   LYS  82          1HZ       LYS  82 -10.172  -0.838  -1.516
  623   2HZ   LYS  82          2HZ       LYS  82 -11.392  -1.300  -2.586
  624   3HZ   LYS  82          3HZ       LYS  82 -10.414  -0.021  -3.005
  625    H    SER  83           H        SER  83 -10.436  -6.327  -3.139
  626    HA   SER  83           HA       SER  83 -12.186  -7.625  -2.903
  627   1HB   SER  83          2HB       SER  83 -13.010  -7.034  -5.150
  628   2HB   SER  83          1HB       SER  83 -12.139  -8.435  -5.830
  629    HG   SER  83           HG       SER  83 -13.562  -9.720  -5.024
  630    H    LYS  84           H        LYS  84  -9.189  -8.863  -4.143
  631    HA   LYS  84           HA       LYS  84  -9.909 -11.583  -3.509
  632   1HB   LYS  84          2HB       LYS  84  -7.285 -10.253  -4.275
  633   2HB   LYS  84          1HB       LYS  84  -7.386 -11.964  -3.763
  634   1HG   LYS  84          2HG       LYS  84  -9.134 -12.322  -5.594
  635   2HG   LYS  84          1HG       LYS  84  -8.654 -10.724  -6.252
  636   1HD   LYS  84          2HD       LYS  84  -6.283 -11.527  -6.455
  637   2HD   LYS  84          1HD       LYS  84  -6.734 -13.045  -5.618
  638   1HE   LYS  84          2HE       LYS  84  -8.327 -13.591  -7.533
  639   2HE   LYS  84          1HE       LYS  84  -7.650 -12.171  -8.431
  640   1HZ   LYS  84          1HZ       LYS  84  -6.655 -14.455  -8.829
  641   2HZ   LYS  84          2HZ       LYS  84  -5.936 -14.328  -7.313
  642   3HZ   LYS  84          3HZ       LYS  84  -5.544 -13.225  -8.533
  643    H    ARG  85           H        ARG  85  -9.009 -12.912  -1.848
  644    HA   ARG  85           HA       ARG  85  -7.159 -11.999  -0.068
  645   1HB   ARG  85          2HB       ARG  85  -8.480 -12.113   2.055
  646   2HB   ARG  85          1HB       ARG  85  -8.812 -10.670   1.061
  647   1HG   ARG  85          2HG       ARG  85 -10.900 -11.719   0.176
  648   2HG   ARG  85          1HG       ARG  85 -10.605 -13.161   1.198
  649   1HD   ARG  85          2HD       ARG  85 -10.765 -11.676   3.280
  650   2HD   ARG  85          1HD       ARG  85 -11.010 -10.258   2.200
  651    HE   ARG  85           HE       ARG  85 -13.155 -11.046   1.590
  652   1HH1  ARG  85          1HH1      ARG  85 -11.550 -13.608   3.531
  653   2HH1  ARG  85          2HH1      ARG  85 -12.943 -14.622   3.548
  654   1HH2  ARG  85          1HH2      ARG  85 -15.039 -12.254   1.929
  655   2HH2  ARG  85          2HH2      ARG  85 -14.970 -13.856   2.603
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1  -5.918  -7.995 -10.825
    2   2H    MET   1          2HT       MET   1  -7.248  -8.961 -11.178
    3   3H    MET   1          3HT       MET   1  -6.990  -8.412  -9.600
    4    HA   MET   1           HA       MET   1  -7.339  -6.618 -11.911
    5   1HB   MET   1          2HB       MET   1  -9.322  -8.204 -11.582
    6   2HB   MET   1          1HB       MET   1  -9.630  -7.397 -10.030
    7   1HG   MET   1          2HG       MET   1  -9.499  -6.042 -12.799
    8   2HG   MET   1          1HG       MET   1 -10.989  -6.678 -12.072
    9   1HE   MET   1          1HE       MET   1 -11.976  -4.367  -9.250
   10   2HE   MET   1          2HE       MET   1 -11.048  -5.889  -9.061
   11   3HE   MET   1          3HE       MET   1 -12.348  -5.775 -10.300
   12    H    ALA   2           H        ALA   2  -6.425  -4.708 -11.328
   13    HA   ALA   2           HA       ALA   2  -6.631  -3.922  -8.506
   14   1HB   ALA   2          1HB       ALA   2  -4.435  -5.021  -8.798
   15   2HB   ALA   2          2HB       ALA   2  -4.188  -3.251  -8.596
   16   3HB   ALA   2          3HB       ALA   2  -4.085  -3.991 -10.239
   17    H    TYR   3           H        TYR   3  -6.072  -1.824  -7.942
   18    HA   TYR   3           HA       TYR   3  -6.743   0.081 -10.064
   19   1HB   TYR   3          2HB       TYR   3  -8.021   1.386  -8.770
   20   2HB   TYR   3          1HB       TYR   3  -8.549  -0.256  -8.261
   21    HD1  TYR   3           1HD      TYR   3  -7.740   2.873  -7.280
   22    HD2  TYR   3           2HD      TYR   3  -7.008  -1.150  -6.093
   23    HE1  TYR   3           1HE      TYR   3  -7.036   3.660  -5.060
   24    HE2  TYR   3           2HE      TYR   3  -6.368  -0.379  -3.888
   25    HH   TYR   3           HH       TYR   3  -5.447   1.362  -2.862
   26    H    SER   4           H        SER   4  -5.523   1.982 -10.169
   27    HA   SER   4           HA       SER   4  -3.131   1.958  -8.495
   28   1HB   SER   4          2HB       SER   4  -1.754   2.731 -10.353
   29   2HB   SER   4          1HB       SER   4  -2.383   1.074 -10.584
   30    HG   SER   4           HG       SER   4  -2.461   2.737 -12.344
   31    H    VAL   5           H        VAL   5  -2.699   3.810  -7.508
   32    HA   VAL   5           HA       VAL   5  -3.728   6.282  -8.596
   33    HB   VAL   5           HB       VAL   5  -5.566   5.783  -7.267
   34   1HG1  VAL   5          1HG1      VAL   5  -5.393   5.175  -4.865
   35   2HG1  VAL   5          2HG1      VAL   5  -3.629   4.866  -5.069
   36   3HG1  VAL   5          3HG1      VAL   5  -4.844   3.879  -6.001
   37   1HG2  VAL   5          1HG2      VAL   5  -5.525   7.446  -5.466
   38   2HG2  VAL   5          2HG2      VAL   5  -4.727   8.105  -6.941
   39   3HG2  VAL   5          3HG2      VAL   5  -3.739   7.561  -5.529
   40    H    THR   6           H        THR   6  -2.459   7.969  -8.269
   41    HA   THR   6           HA       THR   6   0.021   7.501  -6.803
   42    HB   THR   6           HB       THR   6  -0.750   9.821  -8.593
   43    HG1  THR   6           1HG      THR   6   0.977   7.604  -9.011
   44   1HG2  THR   6          1HG2      THR   6   1.010  10.426  -6.854
   45   2HG2  THR   6          2HG2      THR   6   1.710  10.339  -8.487
   46   3HG2  THR   6          3HG2      THR   6   1.970   8.973  -7.344
   47    H    LEU   7           H        LEU   7   0.321   8.419  -4.822
   48    HA   LEU   7           HA       LEU   7  -1.564  10.524  -4.009
   49   1HB   LEU   7          2HB       LEU   7  -1.615   8.251  -2.855
   50   2HB   LEU   7          1HB       LEU   7   0.054   8.555  -2.306
   51    HG   LEU   7           HG       LEU   7  -0.753  10.569  -1.038
   52   1HD1  LEU   7          1HD1      LEU   7  -3.564   9.658  -1.958
   53   2HD1  LEU   7          2HD1      LEU   7  -2.772  11.232  -2.339
   54   3HD1  LEU   7          3HD1      LEU   7  -3.239  10.849  -0.650
   55   1HD2  LEU   7          1HD2      LEU   7  -1.999   9.209   0.721
   56   2HD2  LEU   7          2HD2      LEU   7  -0.556   8.344   0.053
   57   3HD2  LEU   7          3HD2      LEU   7  -2.202   7.901  -0.509
   58    H    THR   8           H        THR   8  -0.781  12.432  -3.162
   59    HA   THR   8           HA       THR   8   2.131  12.705  -3.062
   60    HB   THR   8           HB       THR   8   2.044  14.897  -3.903
   61    HG1  THR   8           1HG      THR   8   0.280  15.943  -3.763
   62   1HG2  THR   8          1HG2      THR   8   1.391  14.445  -6.202
   63   2HG2  THR   8          2HG2      THR   8   0.242  13.149  -5.710
   64   3HG2  THR   8          3HG2      THR   8   2.017  12.900  -5.514
   65    H    GLY   9           H        GLY   9   2.999  14.193  -1.583
   66   1HA   GLY   9          2HA       GLY   9   2.134  15.998  -0.096
   67   2HA   GLY   9          1HA       GLY   9   1.262  14.666   0.725
   68    HA   PRO  10           HA       PRO  10   5.452  14.297   2.489
   69   1HB   PRO  10          2HB       PRO  10   6.211  16.528   3.885
   70   2HB   PRO  10          1HB       PRO  10   6.632  16.186   2.168
   71   1HG   PRO  10          2HG       PRO  10   4.331  17.944   3.255
   72   2HG   PRO  10          1HG       PRO  10   5.534  18.398   1.981
   73   1HD   PRO  10          2HD       PRO  10   2.983  17.380   1.420
   74   2HD   PRO  10          1HD       PRO  10   4.412  17.064   0.337
   75    H    GLY  11           H        GLY  11   4.579  12.912   3.888
   76   1HA   GLY  11          2HA       GLY  11   4.473  13.369   6.445
   77   2HA   GLY  11          1HA       GLY  11   2.798  13.867   5.982
   78    HA   PRO  12           HA       PRO  12   2.788   9.374   6.813
   79   1HB   PRO  12          2HB       PRO  12   0.621  10.409   8.714
   80   2HB   PRO  12          1HB       PRO  12   1.709   8.973   8.918
   81   1HG   PRO  12          2HG       PRO  12   2.266  11.316  10.225
   82   2HG   PRO  12          1HG       PRO  12   3.610  10.423   9.390
   83   1HD   PRO  12          2HD       PRO  12   2.020  12.841   8.347
   84   2HD   PRO  12          1HD       PRO  12   3.818  12.523   8.325
   85    H    TRP  13           H        TRP  13   1.477   8.048   5.592
   86    HA   TRP  13           HA       TRP  13  -0.683   9.273   4.213
   87   1HB   TRP  13          2HB       TRP  13   0.258   6.343   4.052
   88   2HB   TRP  13          1HB       TRP  13  -0.847   7.072   2.982
   89    HD1  TRP  13           HD       TRP  13   2.606   6.290   3.438
   90    HE1  TRP  13           1HE      TRP  13   4.146   7.468   1.694
   91    HE3  TRP  13           3HE      TRP  13  -0.406  10.173   2.247
   92    HZ2  TRP  13           2HZ      TRP  13   4.081   9.800   0.170
   93    HZ3  TRP  13           3HZ      TRP  13   0.417  11.890   0.717
   94    HH2  TRP  13           HH       TRP  13   2.625  11.688  -0.336
   95    H    GLY  14           H        GLY  14  -0.545   6.704   6.715
   96   1HA   GLY  14          2HA       GLY  14  -2.024   6.580   8.398
   97   2HA   GLY  14          1HA       GLY  14  -3.189   7.619   7.505
   98    H    PHE  15           H        PHE  15  -1.553   4.518   6.993
   99    HA   PHE  15           HA       PHE  15  -4.130   3.130   7.021
  100   1HB   PHE  15          2HB       PHE  15  -3.505   1.857   4.964
  101   2HB   PHE  15          1HB       PHE  15  -3.425   3.606   4.642
  102    HD1  PHE  15           1HD      PHE  15  -1.207   4.731   4.640
  103    HD2  PHE  15           2HD      PHE  15  -1.543   0.500   4.881
  104    HE1  PHE  15           1HE      PHE  15   1.217   4.498   4.243
  105    HE2  PHE  15           2HE      PHE  15   0.760   0.275   4.164
  106    HZ   PHE  15           HZ       PHE  15   2.206   2.248   4.048
  107    H    ARG  16           H        ARG  16  -3.977   0.778   7.233
  108    HA   ARG  16           HA       ARG  16  -2.168   0.361   9.461
  109   1HB   ARG  16          2HB       ARG  16  -4.904  -0.769   8.694
  110   2HB   ARG  16          1HB       ARG  16  -3.851  -1.633   9.848
  111   1HG   ARG  16          2HG       ARG  16  -5.400  -0.481  11.105
  112   2HG   ARG  16          1HG       ARG  16  -3.822   0.334  11.350
  113   1HD   ARG  16          2HD       ARG  16  -4.641   2.233   9.859
  114   2HD   ARG  16          1HD       ARG  16  -6.219   1.358   9.662
  115    HE   ARG  16           HE       ARG  16  -5.070   1.985  12.401
  116   1HH1  ARG  16          1HH1      ARG  16  -7.980   2.360  10.270
  117   2HH1  ARG  16          2HH1      ARG  16  -8.989   2.468  11.692
  118   1HH2  ARG  16          1HH2      ARG  16  -6.483   2.326  14.071
  119   2HH2  ARG  16          2HH2      ARG  16  -8.188   2.591  13.698
  120    H    LEU  17           H        LEU  17  -0.612  -1.281   9.314
  121    HA   LEU  17           HA       LEU  17  -0.626  -2.606   6.723
  122   1HB   LEU  17          2HB       LEU  17   1.673  -1.891   8.588
  123   2HB   LEU  17          1HB       LEU  17   1.842  -2.916   7.125
  124    HG   LEU  17           HG       LEU  17   0.515  -0.920   5.954
  125   1HD1  LEU  17          1HD1      LEU  17   1.367   1.307   6.846
  126   2HD1  LEU  17          2HD1      LEU  17   1.942   0.430   8.331
  127   3HD1  LEU  17          3HD1      LEU  17   0.182   0.494   7.915
  128   1HD2  LEU  17          1HD2      LEU  17   2.680  -1.795   5.220
  129   2HD2  LEU  17          2HD2      LEU  17   3.525  -0.953   6.580
  130   3HD2  LEU  17          3HD2      LEU  17   2.729   0.008   5.263
  131    H    GLN  18           H        GLN  18  -0.555  -4.803   6.407
  132    HA   GLN  18           HA       GLN  18  -0.087  -6.518   8.707
  133   1HB   GLN  18          2HB       GLN  18  -2.649  -6.284   7.067
  134   2HB   GLN  18          1HB       GLN  18  -2.251  -7.789   7.923
  135   1HG   GLN  18          2HG       GLN  18  -2.584  -5.066   9.368
  136   2HG   GLN  18          1HG       GLN  18  -3.848  -6.325   9.147
  137   1HE2  GLN  18          1HE2      GLN  18  -0.843  -5.576  10.916
  138   2HE2  GLN  18          2HE2      GLN  18  -0.972  -6.964  11.975
  139    H    GLY  19           H        GLY  19   0.170  -8.752   8.163
  140   1HA   GLY  19          2HA       GLY  19   0.976 -10.401   6.976
  141   2HA   GLY  19          1HA       GLY  19   0.251  -9.622   5.531
  142    H    GLY  20           H        GLY  20   1.855 -10.210   4.100
  143   1HA   GLY  20          2HA       GLY  20   3.581  -9.309   2.952
  144   2HA   GLY  20          1HA       GLY  20   4.445  -8.901   4.478
  145    H    LYS  21           H        LYS  21   5.684 -10.150   2.248
  146    HA   LYS  21           HA       LYS  21   5.936 -12.720   2.182
  147   1HB   LYS  21          2HB       LYS  21   7.130 -10.705   0.972
  148   2HB   LYS  21          1HB       LYS  21   8.390 -10.890   2.212
  149   1HG   LYS  21          2HG       LYS  21   9.144 -12.149   0.321
  150   2HG   LYS  21          1HG       LYS  21   8.532 -13.378   1.464
  151   1HD   LYS  21          2HD       LYS  21   6.222 -12.876   0.101
  152   2HD   LYS  21          1HD       LYS  21   7.367 -12.375  -1.171
  153   1HE   LYS  21          2HE       LYS  21   8.513 -14.634  -1.050
  154   2HE   LYS  21          1HE       LYS  21   7.355 -15.131   0.240
  155   1HZ   LYS  21          1HZ       LYS  21   6.723 -14.463  -2.592
  156   2HZ   LYS  21          2HZ       LYS  21   5.554 -14.693  -1.395
  157   3HZ   LYS  21          3HZ       LYS  21   6.606 -15.958  -1.812
  158    H    ASP  22           H        ASP  22   7.302 -10.820   4.788
  159    HA   ASP  22           HA       ASP  22   8.992 -12.645   5.950
  160   1HB   ASP  22          2HB       ASP  22   8.801 -10.167   6.307
  161   2HB   ASP  22          1HB       ASP  22   7.223 -10.418   7.128
  162    H    PHE  23           H        PHE  23   5.451 -12.469   6.075
  163    HA   PHE  23           HA       PHE  23   5.322 -14.621   8.028
  164   1HB   PHE  23          2HB       PHE  23   3.314 -12.705   6.699
  165   2HB   PHE  23          1HB       PHE  23   2.782 -14.133   7.644
  166    HD1  PHE  23           1HD      PHE  23   3.342 -14.362   9.994
  167    HD2  PHE  23           2HD      PHE  23   4.157 -10.784   7.848
  168    HE1  PHE  23           1HE      PHE  23   3.485 -13.130  12.107
  169    HE2  PHE  23           2HE      PHE  23   4.291  -9.552   9.956
  170    HZ   PHE  23           HZ       PHE  23   3.954 -10.723  12.092
  171    H    ASN  24           H        ASN  24   5.787 -14.410   4.753
  172    HA   ASN  24           HA       ASN  24   5.346 -15.487   2.997
  173   1HB   ASN  24          2HB       ASN  24   5.947 -17.509   4.498
  174   2HB   ASN  24          1HB       ASN  24   4.188 -17.883   4.489
  175   1HD2  ASN  24          1HD2      ASN  24   7.000 -17.182   2.323
  176   2HD2  ASN  24          2HD2      ASN  24   6.404 -18.065   0.946
  177    H    MET  25           H        MET  25   3.528 -13.605   3.819
  178    HA   MET  25           HA       MET  25   0.960 -14.603   2.875
  179   1HB   MET  25          2HB       MET  25   1.990 -12.755   4.911
  180   2HB   MET  25          1HB       MET  25   0.831 -11.903   3.889
  181   1HG   MET  25          2HG       MET  25  -0.297 -12.800   5.824
  182   2HG   MET  25          1HG       MET  25  -0.881 -13.695   4.392
  183   1HE   MET  25          1HE       MET  25  -1.431 -14.385   7.292
  184   2HE   MET  25          2HE       MET  25  -1.251 -16.170   7.300
  185   3HE   MET  25          3HE       MET  25  -2.011 -15.351   5.894
  186    HA   PRO  26           HA       PRO  26   1.493 -11.597  -0.473
  187   1HB   PRO  26          2HB       PRO  26  -1.125 -10.404  -0.502
  188   2HB   PRO  26          1HB       PRO  26  -0.604 -11.867  -1.372
  189   1HG   PRO  26          2HG       PRO  26  -2.426 -11.720   0.939
  190   2HG   PRO  26          1HG       PRO  26  -2.018 -13.101  -0.135
  191   1HD   PRO  26          2HD       PRO  26  -0.871 -12.140   2.506
  192   2HD   PRO  26          1HD       PRO  26  -0.811 -13.853   1.943
  193    H    LEU  27           H        LEU  27   1.611  -9.123  -0.693
  194    HA   LEU  27           HA       LEU  27   2.186  -8.072   1.926
  195   1HB   LEU  27          2HB       LEU  27   3.237  -7.829  -0.653
  196   2HB   LEU  27          1HB       LEU  27   2.482  -6.245  -0.396
  197    HG   LEU  27           HG       LEU  27   4.469  -7.720   1.434
  198   1HD1  LEU  27          1HD1      LEU  27   4.858  -5.265  -0.399
  199   2HD1  LEU  27          2HD1      LEU  27   5.497  -6.930  -0.678
  200   3HD1  LEU  27          3HD1      LEU  27   6.111  -5.948   0.707
  201   1HD2  LEU  27          1HD2      LEU  27   4.695  -5.579   2.731
  202   2HD2  LEU  27          2HD2      LEU  27   3.009  -6.197   2.832
  203   3HD2  LEU  27          3HD2      LEU  27   3.417  -4.826   1.725
  204    H    THR  28           H        THR  28   0.429  -7.499   3.074
  205    HA   THR  28           HA       THR  28  -1.847  -6.523   1.496
  206    HB   THR  28           HB       THR  28  -3.331  -7.451   2.742
  207    HG1  THR  28           1HG      THR  28  -1.426  -7.531   4.836
  208   1HG2  THR  28          1HG2      THR  28  -1.014  -9.366   3.387
  209   2HG2  THR  28          2HG2      THR  28  -1.477  -8.985   1.688
  210   3HG2  THR  28          3HG2      THR  28  -2.688  -9.735   2.815
  211    H    ILE  29           H        ILE  29  -3.313  -5.048   2.379
  212    HA   ILE  29           HA       ILE  29  -2.303  -3.384   4.604
  213    HB   ILE  29           HB       ILE  29  -3.792  -2.400   2.182
  214   1HG1  ILE  29          2HG1      ILE  29  -0.948  -2.164   3.267
  215   2HG1  ILE  29          1HG1      ILE  29  -1.457  -2.791   1.677
  216   1HG2  ILE  29          1HG2      ILE  29  -2.945  -1.110   4.875
  217   2HG2  ILE  29          2HG2      ILE  29  -4.643  -1.309   4.262
  218   3HG2  ILE  29          3HG2      ILE  29  -3.540  -0.167   3.483
  219   1HD1  ILE  29          1HD1      ILE  29  -2.188  -0.533   0.950
  220   2HD1  ILE  29          2HD1      ILE  29  -0.454  -0.551   1.464
  221   3HD1  ILE  29          3HD1      ILE  29  -1.687   0.147   2.557
  222    H    SER  30           H        SER  30  -3.888  -2.826   6.113
  223    HA   SER  30           HA       SER  30  -6.147  -4.668   6.218
  224   1HB   SER  30          2HB       SER  30  -4.954  -4.807   8.185
  225   2HB   SER  30          1HB       SER  30  -4.497  -3.088   8.167
  226    HG   SER  30           HG       SER  30  -7.049  -4.134   8.878
  227    H    ARG  31           H        ARG  31  -5.982  -1.226   7.350
  228    HA   ARG  31           HA       ARG  31  -7.850  -0.524   5.293
  229   1HB   ARG  31          2HB       ARG  31  -9.085  -1.684   7.303
  230   2HB   ARG  31          1HB       ARG  31  -8.752  -0.193   8.201
  231   1HG   ARG  31          2HG       ARG  31  -9.896   0.350   5.517
  232   2HG   ARG  31          1HG       ARG  31 -10.906  -0.832   6.380
  233   1HD   ARG  31          2HD       ARG  31 -11.489   0.665   8.142
  234   2HD   ARG  31          1HD       ARG  31 -10.062   1.736   7.819
  235    HE   ARG  31           HE       ARG  31 -11.920   1.470   5.515
  236   1HH1  ARG  31          1HH1      ARG  31 -11.714   3.273   8.568
  237   2HH1  ARG  31          2HH1      ARG  31 -12.151   4.757   7.846
  238   1HH2  ARG  31          1HH2      ARG  31 -12.162   3.576   4.557
  239   2HH2  ARG  31          2HH2      ARG  31 -12.424   4.922   5.558
  240    H    ILE  32           H        ILE  32  -8.582   1.849   5.721
  241    HA   ILE  32           HA       ILE  32  -6.308   3.500   5.996
  242    HB   ILE  32           HB       ILE  32  -9.249   3.734   5.457
  243   1HG1  ILE  32          2HG1      ILE  32  -8.633   4.870   3.450
  244   2HG1  ILE  32          1HG1      ILE  32  -6.917   4.953   3.852
  245   1HG2  ILE  32          1HG2      ILE  32  -7.372   6.127   5.851
  246   2HG2  ILE  32          2HG2      ILE  32  -8.860   5.751   6.852
  247   3HG2  ILE  32          3HG2      ILE  32  -9.014   6.184   5.128
  248   1HD1  ILE  32          1HD1      ILE  32  -6.715   2.481   3.536
  249   2HD1  ILE  32          2HD1      ILE  32  -7.425   3.292   2.088
  250   3HD1  ILE  32          3HD1      ILE  32  -8.506   2.374   3.204
  251    H    THR  33           H        THR  33  -5.867   5.064   7.625
  252    HA   THR  33           HA       THR  33  -7.076   4.684  10.177
  253    HB   THR  33           HB       THR  33  -5.178   6.856   9.274
  254    HG1  THR  33           1HG      THR  33  -3.783   5.587  10.587
  255   1HG2  THR  33          1HG2      THR  33  -4.886   7.208  11.741
  256   2HG2  THR  33          2HG2      THR  33  -6.089   5.914  12.082
  257   3HG2  THR  33          3HG2      THR  33  -6.617   7.456  11.349
  258    HA   PRO  34           HA       PRO  34 -10.542   7.083   9.268
  259   1HB   PRO  34          2HB       PRO  34  -9.591   8.294  11.956
  260   2HB   PRO  34          1HB       PRO  34 -11.319   8.245  11.432
  261   1HG   PRO  34          2HG       PRO  34 -10.313   6.177  12.920
  262   2HG   PRO  34          1HG       PRO  34 -11.270   5.763  11.428
  263   1HD   PRO  34          2HD       PRO  34  -8.290   5.601  11.850
  264   2HD   PRO  34          1HD       PRO  34  -9.335   4.746  10.635
  265    H    GLY  35           H        GLY  35  -8.482   9.788  10.610
  266   1HA   GLY  35          2HA       GLY  35  -9.934  11.389   8.602
  267   2HA   GLY  35          1HA       GLY  35  -9.306  11.897  10.191
  268    H    SER  36           H        SER  36  -7.483  10.075   7.768
  269    HA   SER  36           HA       SER  36  -5.803  12.474   7.399
  270   1HB   SER  36          2HB       SER  36  -4.911   9.623   7.958
  271   2HB   SER  36          1HB       SER  36  -3.796  10.914   7.382
  272    HG   SER  36           HG       SER  36  -3.792  10.734   9.627
  273    H    LYS  37           H        LYS  37  -4.002  11.546   5.632
  274    HA   LYS  37           HA       LYS  37  -5.149  12.211   3.355
  275   1HB   LYS  37          2HB       LYS  37  -2.651  11.963   4.213
  276   2HB   LYS  37          1HB       LYS  37  -2.698  10.406   3.376
  277   1HG   LYS  37          2HG       LYS  37  -2.158  11.505   1.471
  278   2HG   LYS  37          1HG       LYS  37  -3.753  12.287   1.474
  279   1HD   LYS  37          2HD       LYS  37  -1.212  13.312   2.884
  280   2HD   LYS  37          1HD       LYS  37  -1.821  13.885   1.300
  281   1HE   LYS  37          2HE       LYS  37  -3.885  14.793   2.373
  282   2HE   LYS  37          1HE       LYS  37  -3.351  14.169   3.979
  283   1HZ   LYS  37          1HZ       LYS  37  -1.411  15.584   3.850
  284   2HZ   LYS  37          2HZ       LYS  37  -2.823  16.466   3.735
  285   3HZ   LYS  37          3HZ       LYS  37  -1.884  16.218   2.358
  286    H    ALA  38           H        ALA  38  -4.555   8.834   4.287
  287    HA   ALA  38           HA       ALA  38  -5.401   7.624   1.891
  288   1HB   ALA  38          1HB       ALA  38  -5.323   6.401   4.654
  289   2HB   ALA  38          2HB       ALA  38  -3.864   6.684   3.633
  290   3HB   ALA  38          3HB       ALA  38  -5.158   5.603   3.042
  291    H    ALA  39           H        ALA  39  -7.294   8.958   4.516
  292    HA   ALA  39           HA       ALA  39  -9.664   7.661   3.535
  293   1HB   ALA  39          1HB       ALA  39  -9.375   8.230   5.980
  294   2HB   ALA  39          2HB       ALA  39 -10.801   9.071   5.282
  295   3HB   ALA  39          3HB       ALA  39  -9.261   9.963   5.560
  296    H    GLN  40           H        GLN  40  -8.253  10.909   3.490
  297    HA   GLN  40           HA       GLN  40 -10.446  12.201   2.423
  298   1HB   GLN  40          2HB       GLN  40  -7.901  12.801   3.468
  299   2HB   GLN  40          1HB       GLN  40  -7.845  13.535   1.871
  300   1HG   GLN  40          2HG       GLN  40 -10.167  14.017   3.872
  301   2HG   GLN  40          1HG       GLN  40  -8.650  14.966   3.862
  302   1HE2  GLN  40          1HE2      GLN  40 -11.741  14.491   2.206
  303   2HE2  GLN  40          2HE2      GLN  40 -11.512  15.807   1.083
  304    H    SER  41           H        SER  41  -7.684  10.783   0.759
  305    HA   SER  41           HA       SER  41  -8.442  12.126  -1.695
  306   1HB   SER  41          2HB       SER  41  -6.100  12.111  -0.810
  307   2HB   SER  41          1HB       SER  41  -6.019  10.361  -1.149
  308    HG   SER  41           HG       SER  41  -6.274  12.542  -2.954
  309    H    GLN  42           H        GLN  42  -7.216  10.011  -3.389
  310    HA   GLN  42           HA       GLN  42  -9.735   8.685  -3.892
  311   1HB   GLN  42          2HB       GLN  42  -7.159   8.868  -5.543
  312   2HB   GLN  42          1HB       GLN  42  -8.736   8.210  -6.092
  313   1HG   GLN  42          2HG       GLN  42  -9.767  10.488  -5.573
  314   2HG   GLN  42          1HG       GLN  42  -8.112  11.145  -5.319
  315   1HE2  GLN  42          1HE2      GLN  42  -6.529  10.658  -7.321
  316   2HE2  GLN  42          2HE2      GLN  42  -7.289  11.039  -8.834
  317    H    LEU  43           H        LEU  43  -7.380   7.961  -1.935
  318    HA   LEU  43           HA       LEU  43  -6.437   5.469  -2.796
  319   1HB   LEU  43          2HB       LEU  43  -5.790   7.449  -0.910
  320   2HB   LEU  43          1HB       LEU  43  -6.317   6.122   0.135
  321    HG   LEU  43           HG       LEU  43  -4.670   4.619  -1.244
  322   1HD1  LEU  43          1HD1      LEU  43  -3.678   7.412  -2.120
  323   2HD1  LEU  43          2HD1      LEU  43  -4.361   6.157  -3.207
  324   3HD1  LEU  43          3HD1      LEU  43  -2.799   5.859  -2.368
  325   1HD2  LEU  43          1HD2      LEU  43  -2.691   5.599   0.105
  326   2HD2  LEU  43          2HD2      LEU  43  -4.166   5.283   1.075
  327   3HD2  LEU  43          3HD2      LEU  43  -3.767   6.959   0.571
  328    H    SER  44           H        SER  44  -6.769   3.409  -2.110
  329    HA   SER  44           HA       SER  44  -8.558   2.894   0.097
  330   1HB   SER  44          2HB       SER  44  -9.958   2.916  -2.024
  331   2HB   SER  44          1HB       SER  44  -8.987   1.549  -2.632
  332    HG   SER  44           HG       SER  44 -11.096   1.388  -1.259
  333    H    GLN  45           H        GLN  45  -5.728   2.763   0.237
  334    HA   GLN  45           HA       GLN  45  -4.681   0.336  -0.004
  335   1HB   GLN  45          2HB       GLN  45  -4.623   2.540   2.119
  336   2HB   GLN  45          1HB       GLN  45  -3.505   1.147   2.153
  337   1HG   GLN  45          2HG       GLN  45  -2.714   1.669  -0.134
  338   2HG   GLN  45          1HG       GLN  45  -3.659   3.190  -0.127
  339   1HE2  GLN  45          2HE2      GLN  45  -0.755   2.071   0.205
  340   2HE2  GLN  45          1HE2      GLN  45   0.031   3.351   1.169
  341    H    GLY  46           H        GLY  46  -5.776  -1.528   0.355
  342   1HA   GLY  46          2HA       GLY  46  -5.876  -2.507   2.935
  343   2HA   GLY  46          1HA       GLY  46  -7.512  -1.909   2.543
  344    H    ASP  47           H        ASP  47  -4.954  -3.526   0.573
  345    HA   ASP  47           HA       ASP  47  -6.581  -5.845   0.230
  346   1HB   ASP  47          2HB       ASP  47  -7.200  -3.740  -1.420
  347   2HB   ASP  47          1HB       ASP  47  -5.841  -4.370  -2.369
  348    H    LEU  48           H        LEU  48  -5.208  -6.917  -1.976
  349    HA   LEU  48           HA       LEU  48  -2.595  -7.308  -0.817
  350   1HB   LEU  48          2HB       LEU  48  -3.889  -8.631  -3.245
  351   2HB   LEU  48          1HB       LEU  48  -2.305  -9.022  -2.516
  352    HG   LEU  48           HG       LEU  48  -3.581 -10.697  -1.622
  353   1HD1  LEU  48          1HD1      LEU  48  -4.109 -10.331   0.731
  354   2HD1  LEU  48          2HD1      LEU  48  -4.239  -8.551   0.511
  355   3HD1  LEU  48          3HD1      LEU  48  -2.637  -9.365   0.273
  356   1HD2  LEU  48          1HD2      LEU  48  -5.765  -9.689  -2.620
  357   2HD2  LEU  48          2HD2      LEU  48  -5.862  -8.718  -1.081
  358   3HD2  LEU  48          3HD2      LEU  48  -5.948 -10.531  -0.991
  359    H    VAL  49           H        VAL  49  -0.952  -6.054  -1.335
  360    HA   VAL  49           HA       VAL  49  -1.182  -4.254  -3.512
  361    HB   VAL  49           HB       VAL  49   1.019  -4.679  -1.468
  362   1HG1  VAL  49          1HG1      VAL  49   1.495  -2.272  -1.976
  363   2HG1  VAL  49          2HG1      VAL  49   0.285  -2.306  -3.313
  364   3HG1  VAL  49          3HG1      VAL  49   1.790  -3.325  -3.416
  365   1HG2  VAL  49          1HG2      VAL  49  -1.483  -2.846  -1.468
  366   2HG2  VAL  49          2HG2      VAL  49  -0.126  -2.738  -0.314
  367   3HG2  VAL  49          3HG2      VAL  49  -1.160  -4.204  -0.323
  368    H    VAL  50           H        VAL  50  -0.099  -4.332  -5.477
  369    HA   VAL  50           HA       VAL  50   1.360  -6.800  -5.973
  370    HB   VAL  50           HB       VAL  50   0.509  -4.905  -8.166
  371   1HG1  VAL  50          1HG1      VAL  50   2.006  -6.893  -8.579
  372   2HG1  VAL  50          2HG1      VAL  50   0.394  -7.057  -9.364
  373   3HG1  VAL  50          3HG1      VAL  50   0.753  -7.971  -7.852
  374   1HG2  VAL  50          1HG2      VAL  50  -1.561  -5.031  -6.978
  375   2HG2  VAL  50          2HG2      VAL  50  -1.343  -6.801  -6.622
  376   3HG2  VAL  50          3HG2      VAL  50  -1.620  -6.226  -8.309
  377    H    ALA  51           H        ALA  51   1.496  -3.441  -7.130
  378    HA   ALA  51           HA       ALA  51   4.430  -3.554  -7.040
  379   1HB   ALA  51          1HB       ALA  51   4.426  -2.257  -9.182
  380   2HB   ALA  51          2HB       ALA  51   2.624  -2.281  -9.186
  381   3HB   ALA  51          3HB       ALA  51   3.541  -3.814  -9.386
  382    H    ILE  52           H        ILE  52   5.556  -1.784  -6.634
  383    HA   ILE  52           HA       ILE  52   4.139   0.563  -5.595
  384    HB   ILE  52           HB       ILE  52   5.824  -1.354  -4.316
  385   1HG1  ILE  52          2HG1      ILE  52   4.649   1.274  -3.251
  386   2HG1  ILE  52          1HG1      ILE  52   3.715  -0.234  -3.507
  387   1HG2  ILE  52          1HG2      ILE  52   7.776  -0.153  -4.983
  388   2HG2  ILE  52          2HG2      ILE  52   7.504   0.121  -3.241
  389   3HG2  ILE  52          3HG2      ILE  52   7.112   1.436  -4.426
  390   1HD1  ILE  52          1HD1      ILE  52   6.075   0.125  -1.549
  391   2HD1  ILE  52          2HD1      ILE  52   5.272  -1.449  -1.910
  392   3HD1  ILE  52          3HD1      ILE  52   4.338  -0.117  -1.144
  393    H    ASP  53           H        ASP  53   4.672   2.360  -6.711
  394    HA   ASP  53           HA       ASP  53   5.494   3.591  -8.277
  395   1HB   ASP  53          2HB       ASP  53   7.990   2.476  -6.952
  396   2HB   ASP  53          1HB       ASP  53   8.138   3.689  -8.255
  397    H    GLY  54           H        GLY  54   4.975   0.709  -9.047
  398   1HA   GLY  54          2HA       GLY  54   4.688   0.055 -11.244
  399   2HA   GLY  54          1HA       GLY  54   6.219   0.861 -11.704
  400    H    VAL  55           H        VAL  55   7.162  -0.548  -8.942
  401    HA   VAL  55           HA       VAL  55   8.195  -2.826 -10.447
  402    HB   VAL  55           HB       VAL  55   9.152  -1.521  -7.879
  403   1HG1  VAL  55          1HG1      VAL  55   9.832  -3.925  -8.017
  404   2HG1  VAL  55          2HG1      VAL  55  11.242  -2.874  -8.377
  405   3HG1  VAL  55          3HG1      VAL  55  10.371  -3.691  -9.722
  406   1HG2  VAL  55          1HG2      VAL  55   9.436   0.043  -9.793
  407   2HG2  VAL  55          2HG2      VAL  55  10.122  -1.290 -10.802
  408   3HG2  VAL  55          3HG2      VAL  55  11.024  -0.684  -9.373
  409    H    ASN  56           H        ASN  56   7.733  -4.924  -9.773
  410    HA   ASN  56           HA       ASN  56   5.582  -5.162  -7.966
  411   1HB   ASN  56          2HB       ASN  56   6.805  -6.853  -9.906
  412   2HB   ASN  56          1HB       ASN  56   7.019  -7.748  -8.397
  413   1HD2  ASN  56          1HD2      ASN  56   5.262  -8.982  -7.748
  414   2HD2  ASN  56          2HD2      ASN  56   3.608  -8.631  -8.117
  415    H    THR  57           H        THR  57   5.378  -6.058  -5.986
  416    HA   THR  57           HA       THR  57   7.646  -5.593  -4.316
  417    HB   THR  57           HB       THR  57   6.066  -5.773  -2.468
  418    HG1  THR  57           1HG      THR  57   4.058  -5.949  -4.444
  419   1HG2  THR  57          1HG2      THR  57   4.803  -3.729  -3.021
  420   2HG2  THR  57          2HG2      THR  57   5.145  -3.936  -4.779
  421   3HG2  THR  57          3HG2      THR  57   6.487  -3.592  -3.634
  422    H    ASP  58           H        ASP  58   7.342  -8.191  -6.025
  423    HA   ASP  58           HA       ASP  58   6.977 -10.380  -4.639
  424   1HB   ASP  58          2HB       ASP  58   9.356  -9.692  -6.456
  425   2HB   ASP  58          1HB       ASP  58   8.951 -11.374  -5.960
  426    H    THR  59           H        THR  59  10.139  -8.683  -4.422
  427    HA   THR  59           HA       THR  59  10.746 -10.419  -2.168
  428    HB   THR  59           HB       THR  59  12.267 -10.133  -4.169
  429    HG1  THR  59           1HG      THR  59  13.516  -9.477  -1.756
  430   1HG2  THR  59          1HG2      THR  59  13.011  -7.475  -2.750
  431   2HG2  THR  59          2HG2      THR  59  12.164  -7.612  -4.337
  432   3HG2  THR  59          3HG2      THR  59  13.840  -8.230  -4.150
  433    H    MET  60           H        MET  60   9.023  -7.758  -2.194
  434    HA   MET  60           HA       MET  60  10.472  -6.319  -0.146
  435   1HB   MET  60          2HB       MET  60   8.088  -5.948  -1.977
  436   2HB   MET  60          1HB       MET  60   8.283  -4.864  -0.547
  437   1HG   MET  60          2HG       MET  60   9.193  -3.661  -2.337
  438   2HG   MET  60          1HG       MET  60  10.626  -4.302  -1.485
  439   1HE   MET  60          1HE       MET  60  11.465  -3.987  -5.373
  440   2HE   MET  60          2HE       MET  60  11.936  -3.476  -3.722
  441   3HE   MET  60          3HE       MET  60  10.341  -2.977  -4.412
  442    H    THR  61           H        THR  61   9.749  -6.191   1.958
  443    HA   THR  61           HA       THR  61   7.793  -8.211   2.730
  444    HB   THR  61           HB       THR  61   8.946  -8.047   4.940
  445    HG1  THR  61           1HG      THR  61  10.889  -6.930   4.919
  446   1HG2  THR  61          1HG2      THR  61   9.649  -9.761   3.308
  447   2HG2  THR  61          2HG2      THR  61  11.081  -9.099   4.163
  448   3HG2  THR  61          3HG2      THR  61  10.729  -8.587   2.472
  449    H    HIS  62           H        HIS  62   6.941  -7.555   5.085
  450    HA   HIS  62           HA       HIS  62   5.227  -5.433   5.067
  451   1HB   HIS  62          2HB       HIS  62   5.181  -7.348   6.656
  452   2HB   HIS  62          1HB       HIS  62   6.741  -6.841   7.338
  453    HD1  HIS  62           1HD      HIS  62   3.081  -6.138   7.570
  454    HD2  HIS  62           2HD      HIS  62   6.663  -4.635   9.134
  455    HE1  HIS  62           1HE      HIS  62   2.493  -4.587   9.535
  456    H    LEU  63           H        LEU  63   8.472  -5.539   6.607
  457    HA   LEU  63           HA       LEU  63   8.571  -2.843   7.302
  458   1HB   LEU  63          2HB       LEU  63  10.025  -4.616   8.263
  459   2HB   LEU  63          1HB       LEU  63  10.785  -4.854   6.662
  460    HG   LEU  63           HG       LEU  63  11.613  -2.464   6.739
  461   1HD1  LEU  63          1HD1      LEU  63  10.003  -1.456   8.359
  462   2HD1  LEU  63          2HD1      LEU  63  11.687  -1.305   8.967
  463   3HD1  LEU  63          3HD1      LEU  63  10.602  -2.561   9.661
  464   1HD2  LEU  63          1HD2      LEU  63  13.023  -4.394   7.301
  465   2HD2  LEU  63          2HD2      LEU  63  12.488  -4.307   9.032
  466   3HD2  LEU  63          3HD2      LEU  63  13.454  -2.956   8.310
  467    H    GLU  64           H        GLU  64   9.915  -4.518   4.347
  468    HA   GLU  64           HA       GLU  64  11.032  -2.181   3.455
  469   1HB   GLU  64          2HB       GLU  64  11.130  -4.779   2.615
  470   2HB   GLU  64          1HB       GLU  64  10.164  -4.077   1.281
  471   1HG   GLU  64          2HG       GLU  64  11.949  -2.200   1.145
  472   2HG   GLU  64          1HG       GLU  64  12.828  -3.040   2.474
  473    H    ALA  65           H        ALA  65   7.798  -3.491   2.608
  474    HA   ALA  65           HA       ALA  65   7.223  -1.486   0.748
  475   1HB   ALA  65          1HB       ALA  65   6.156  -3.724   0.958
  476   2HB   ALA  65          2HB       ALA  65   4.913  -2.400   0.932
  477   3HB   ALA  65          3HB       ALA  65   5.371  -3.210   2.490
  478    H    GLN  66           H        GLN  66   6.687  -1.643   4.252
  479    HA   GLN  66           HA       GLN  66   5.302   0.710   4.608
  480   1HB   GLN  66          2HB       GLN  66   5.717  -1.043   6.348
  481   2HB   GLN  66          1HB       GLN  66   7.452  -0.758   6.228
  482   1HG   GLN  66          2HG       GLN  66   6.975   0.236   8.209
  483   2HG   GLN  66          1HG       GLN  66   6.996   1.678   7.159
  484   1HE2  GLN  66          1HE2      GLN  66   4.704   2.275   6.263
  485   2HE2  GLN  66          2HE2      GLN  66   3.347   2.013   7.365
  486    H    ASN  67           H        ASN  67   8.817   0.122   4.627
  487    HA   ASN  67           HA       ASN  67   9.622   2.740   4.965
  488   1HB   ASN  67          2HB       ASN  67  10.946   0.238   3.780
  489   2HB   ASN  67          1HB       ASN  67  11.851   1.778   3.946
  490   1HD2  ASN  67          1HD2      ASN  67  13.056  -0.071   5.278
  491   2HD2  ASN  67          2HD2      ASN  67  12.686  -0.034   6.984
  492    H    LYS  68           H        LYS  68   9.159   0.927   1.938
  493    HA   LYS  68           HA       LYS  68  10.054   2.891   0.223
  494   1HB   LYS  68          2HB       LYS  68   7.962   0.721  -0.214
  495   2HB   LYS  68          1HB       LYS  68   8.741   1.657  -1.527
  496   1HG   LYS  68          2HG       LYS  68  10.725   0.386   0.297
  497   2HG   LYS  68          1HG       LYS  68   9.577  -0.782  -0.405
  498   1HD   LYS  68          2HD       LYS  68  10.098   0.118  -2.698
  499   2HD   LYS  68          1HD       LYS  68  11.373   1.156  -1.999
  500   1HE   LYS  68          2HE       LYS  68  11.229  -1.923  -1.664
  501   2HE   LYS  68          1HE       LYS  68  12.165  -1.115  -2.978
  502   1HZ   LYS  68          1HZ       LYS  68  13.651  -0.227  -1.436
  503   2HZ   LYS  68          2HZ       LYS  68  13.334  -1.809  -0.878
  504   3HZ   LYS  68          3HZ       LYS  68  12.678  -0.472  -0.105
  505    H    ILE  69           H        ILE  69   6.564   2.203   1.090
  506    HA   ILE  69           HA       ILE  69   5.410   4.340   0.037
  507    HB   ILE  69           HB       ILE  69   4.989   2.681   2.506
  508   1HG1  ILE  69          2HG1      ILE  69   3.565   3.207  -0.170
  509   2HG1  ILE  69          1HG1      ILE  69   4.311   1.665   0.276
  510   1HG2  ILE  69          1HG2      ILE  69   4.159   4.978   3.116
  511   2HG2  ILE  69          2HG2      ILE  69   2.814   3.846   2.881
  512   3HG2  ILE  69          3HG2      ILE  69   3.211   5.010   1.573
  513   1HD1  ILE  69          1HD1      ILE  69   2.701   1.270   2.102
  514   2HD1  ILE  69          2HD1      ILE  69   1.992   1.308   0.443
  515   3HD1  ILE  69          3HD1      ILE  69   1.750   2.702   1.541
  516    H    LYS  70           H        LYS  70   7.079   4.440   3.237
  517    HA   LYS  70           HA       LYS  70   6.307   7.109   3.641
  518   1HB   LYS  70          2HB       LYS  70   8.008   5.060   4.992
  519   2HB   LYS  70          1HB       LYS  70   8.438   6.753   5.344
  520   1HG   LYS  70          2HG       LYS  70   6.970   6.086   7.034
  521   2HG   LYS  70          1HG       LYS  70   6.120   7.280   6.007
  522   1HD   LYS  70          2HD       LYS  70   4.987   5.317   4.826
  523   2HD   LYS  70          1HD       LYS  70   5.725   4.226   6.039
  524   1HE   LYS  70          2HE       LYS  70   3.605   6.437   6.439
  525   2HE   LYS  70          1HE       LYS  70   3.428   4.658   6.704
  526   1HZ   LYS  70          1HZ       LYS  70   4.930   6.651   8.306
  527   2HZ   LYS  70          2HZ       LYS  70   5.194   4.999   8.532
  528   3HZ   LYS  70          3HZ       LYS  70   3.679   5.691   8.808
  529    H    SER  71           H        SER  71   8.602   6.054   1.427
  530    HA   SER  71           HA       SER  71  10.499   8.156   2.078
  531   1HB   SER  71          2HB       SER  71  11.988   7.185   0.495
  532   2HB   SER  71          1HB       SER  71  11.332   5.878   1.516
  533    HG   SER  71           HG       SER  71   9.867   5.424  -0.234
  534    H    ALA  72           H        ALA  72   7.819   7.639   0.126
  535    HA   ALA  72           HA       ALA  72   8.615   9.396  -2.038
  536   1HB   ALA  72          1HB       ALA  72   7.597   7.149  -2.441
  537   2HB   ALA  72          2HB       ALA  72   6.471   8.421  -3.039
  538   3HB   ALA  72          3HB       ALA  72   6.188   7.610  -1.437
  539    H    SER  73           H        SER  73   7.290  11.188  -2.728
  540    HA   SER  73           HA       SER  73   5.262  12.137  -0.955
  541   1HB   SER  73          2HB       SER  73   6.384  14.228  -0.217
  542   2HB   SER  73          1HB       SER  73   7.056  12.742   0.502
  543    HG   SER  73           HG       SER  73   8.777  13.823  -0.115
  544    H    TYR  74           H        TYR  74   7.358  12.811  -3.758
  545    HA   TYR  74           HA       TYR  74   5.476  14.782  -4.695
  546   1HB   TYR  74          2HB       TYR  74   8.078  14.746  -5.025
  547   2HB   TYR  74          1HB       TYR  74   7.782  13.504  -6.275
  548    HD1  TYR  74           1HD      TYR  74   6.180  14.128  -8.172
  549    HD2  TYR  74           2HD      TYR  74   7.793  16.973  -5.465
  550    HE1  TYR  74           1HE      TYR  74   5.653  15.911  -9.746
  551    HE2  TYR  74           2HE      TYR  74   7.309  18.769  -7.052
  552    HH   TYR  74           HH       TYR  74   6.736  19.229  -9.212
  553    H    ASN  75           H        ASN  75   6.424  11.397  -5.262
  554    HA   ASN  75           HA       ASN  75   3.742  10.916  -6.251
  555   1HB   ASN  75          2HB       ASN  75   5.056  11.398  -8.267
  556   2HB   ASN  75          1HB       ASN  75   6.319  10.199  -7.767
  557   1HD2  ASN  75          1HD2      ASN  75   5.311   7.845  -7.465
  558   2HD2  ASN  75          2HD2      ASN  75   4.124   7.383  -8.664
  559    H    LEU  76           H        LEU  76   3.012   9.245  -5.327
  560    HA   LEU  76           HA       LEU  76   4.732   6.939  -4.685
  561   1HB   LEU  76          2HB       LEU  76   4.169   8.072  -2.517
  562   2HB   LEU  76          1HB       LEU  76   2.454   8.069  -2.962
  563    HG   LEU  76           HG       LEU  76   2.409   5.558  -2.857
  564   1HD1  LEU  76          1HD1      LEU  76   5.257   5.770  -1.706
  565   2HD1  LEU  76          2HD1      LEU  76   4.898   5.112  -3.363
  566   3HD1  LEU  76          3HD1      LEU  76   4.264   4.298  -1.879
  567   1HD2  LEU  76          1HD2      LEU  76   2.558   5.373  -0.416
  568   2HD2  LEU  76          2HD2      LEU  76   1.879   6.993  -0.835
  569   3HD2  LEU  76          3HD2      LEU  76   3.604   6.824  -0.322
  570    H    SER  77           H        SER  77   4.066   5.535  -6.323
  571    HA   SER  77           HA       SER  77   1.192   5.596  -6.975
  572   1HB   SER  77          2HB       SER  77   3.565   4.637  -8.618
  573   2HB   SER  77          1HB       SER  77   1.840   4.354  -9.056
  574    HG   SER  77           HG       SER  77   2.634   6.165 -10.056
  575    H    LEU  78           H        LEU  78   0.035   4.102  -5.909
  576    HA   LEU  78           HA       LEU  78   1.309   1.517  -5.384
  577   1HB   LEU  78          2HB       LEU  78  -1.338   2.509  -4.284
  578   2HB   LEU  78          1HB       LEU  78  -0.365   1.123  -3.742
  579    HG   LEU  78           HG       LEU  78  -0.119   2.721  -2.066
  580   1HD1  LEU  78          1HD1      LEU  78   2.195   3.283  -1.925
  581   2HD1  LEU  78          2HD1      LEU  78   2.421   3.203  -3.709
  582   3HD1  LEU  78          3HD1      LEU  78   2.069   1.697  -2.770
  583   1HD2  LEU  78          1HD2      LEU  78   0.262   5.030  -2.176
  584   2HD2  LEU  78          2HD2      LEU  78  -1.117   4.643  -3.266
  585   3HD2  LEU  78          3HD2      LEU  78   0.508   5.014  -3.961
  586    H    THR  79           H        THR  79   0.552  -0.340  -6.318
  587    HA   THR  79           HA       THR  79  -2.033  -0.276  -7.675
  588    HB   THR  79           HB       THR  79   0.394  -1.896  -8.563
  589    HG1  THR  79           1HG      THR  79   0.740   0.217  -9.142
  590   1HG2  THR  79          1HG2      THR  79  -2.417  -1.356  -9.714
  591   2HG2  THR  79          2HG2      THR  79  -1.811  -2.923  -9.045
  592   3HG2  THR  79          3HG2      THR  79  -1.098  -2.260 -10.561
  593    H    LEU  80           H        LEU  80  -3.260  -1.395  -6.114
  594    HA   LEU  80           HA       LEU  80  -2.369  -4.069  -5.341
  595   1HB   LEU  80          2HB       LEU  80  -3.347  -3.815  -3.214
  596   2HB   LEU  80          1HB       LEU  80  -2.101  -2.525  -3.452
  597    HG   LEU  80           HG       LEU  80  -5.077  -2.176  -3.796
  598   1HD1  LEU  80          1HD1      LEU  80  -4.385  -2.814  -1.466
  599   2HD1  LEU  80          2HD1      LEU  80  -5.139  -1.146  -1.593
  600   3HD1  LEU  80          3HD1      LEU  80  -3.319  -1.337  -1.418
  601   1HD2  LEU  80          1HD2      LEU  80  -2.550  -0.467  -3.897
  602   2HD2  LEU  80          2HD2      LEU  80  -4.034   0.362  -3.222
  603   3HD2  LEU  80          3HD2      LEU  80  -4.039  -0.326  -4.925
  604    H    GLN  81           H        GLN  81  -4.448  -5.413  -4.746
  605    HA   GLN  81           HA       GLN  81  -6.149  -4.950  -6.956
  606   1HB   GLN  81          2HB       GLN  81  -6.257  -7.196  -4.968
  607   2HB   GLN  81          1HB       GLN  81  -7.182  -7.027  -6.510
  608   1HG   GLN  81          2HG       GLN  81  -4.885  -6.693  -7.684
  609   2HG   GLN  81          1HG       GLN  81  -4.153  -7.356  -6.187
  610   1HE2  GLN  81          1HE2      GLN  81  -3.640  -9.489  -6.616
  611   2HE2  GLN  81          2HE2      GLN  81  -4.558 -10.549  -7.667
  612    H    LYS  82           H        LYS  82  -8.471  -5.196  -6.968
  613    HA   LYS  82           HA       LYS  82  -9.771  -4.207  -4.541
  614   1HB   LYS  82          2HB       LYS  82  -9.858  -3.264  -7.247
  615   2HB   LYS  82          1HB       LYS  82 -11.422  -4.062  -6.998
  616   1HG   LYS  82          2HG       LYS  82 -11.456  -1.635  -6.535
  617   2HG   LYS  82          1HG       LYS  82 -11.952  -2.580  -5.109
  618   1HD   LYS  82          2HD       LYS  82  -9.034  -2.088  -5.269
  619   2HD   LYS  82          1HD       LYS  82  -9.951  -0.556  -5.212
  620   1HE   LYS  82          2HE       LYS  82 -10.757  -0.883  -3.026
  621   2HE   LYS  82          1HE       LYS  82 -10.806  -2.673  -3.224
  622   1HZ   LYS  82          1HZ       LYS  82  -8.299  -2.538  -3.262
  623   2HZ   LYS  82          2HZ       LYS  82  -9.144  -2.398  -1.816
  624   3HZ   LYS  82          3HZ       LYS  82  -8.486  -1.000  -2.508
  625    H    SER  83           H        SER  83 -10.296  -5.910  -3.369
  626    HA   SER  83           HA       SER  83 -12.682  -7.123  -4.447
  627   1HB   SER  83          2HB       SER  83 -10.732  -8.809  -4.744
  628   2HB   SER  83          1HB       SER  83 -10.663  -8.881  -2.955
  629    HG   SER  83           HG       SER  83 -11.942 -10.507  -3.886
  630    H    LYS  84           H        LYS  84 -13.617  -8.475  -2.398
  631    HA   LYS  84           HA       LYS  84 -12.907  -7.096   0.079
  632   1HB   LYS  84          2HB       LYS  84 -15.736  -8.008  -0.648
  633   2HB   LYS  84          1HB       LYS  84 -15.176  -7.472   0.963
  634   1HG   LYS  84          2HG       LYS  84 -15.975  -5.474   0.373
  635   2HG   LYS  84          1HG       LYS  84 -14.412  -5.287  -0.470
  636   1HD   LYS  84          2HD       LYS  84 -15.574  -6.164  -2.604
  637   2HD   LYS  84          1HD       LYS  84 -17.078  -6.319  -1.647
  638   1HE   LYS  84          2HE       LYS  84 -17.326  -4.284  -2.877
  639   2HE   LYS  84          1HE       LYS  84 -16.975  -3.790  -1.174
  640   1HZ   LYS  84          1HZ       LYS  84 -15.723  -2.541  -2.789
  641   2HZ   LYS  84          2HZ       LYS  84 -15.017  -3.940  -3.416
  642   3HZ   LYS  84          3HZ       LYS  84 -14.641  -3.440  -1.848
  643    H    ARG  85           H        ARG  85 -12.498  -8.431   1.741
  644    HA   ARG  85           HA       ARG  85 -13.405 -11.168   1.626
  645   1HB   ARG  85          2HB       ARG  85 -10.484 -10.359   2.025
  646   2HB   ARG  85          1HB       ARG  85 -11.175 -11.879   2.675
  647   1HG   ARG  85          2HG       ARG  85 -11.922 -12.453   0.278
  648   2HG   ARG  85          1HG       ARG  85 -10.967 -11.051  -0.271
  649   1HD   ARG  85          2HD       ARG  85  -9.698 -13.120  -0.581
  650   2HD   ARG  85          1HD       ARG  85  -8.869 -12.130   0.693
  651    HE   ARG  85           HE       ARG  85 -10.636 -13.774   2.144
  652   1HH1  ARG  85          1HH1      ARG  85  -8.027 -14.509  -0.200
  653   2HH1  ARG  85          2HH1      ARG  85  -7.893 -16.148   0.329
  654   1HH2  ARG  85          1HH2      ARG  85 -10.342 -15.792   2.891
  655   2HH2  ARG  85          2HH2      ARG  85  -9.234 -16.912   2.160
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  -9.379  -8.365 -11.156
    2   2H    MET   1          2HT       MET   1 -10.172  -6.966 -10.579
    3   3H    MET   1          3HT       MET   1  -9.056  -7.780  -9.623
    4    HA   MET   1           HA       MET   1  -7.302  -7.365 -11.171
    5   1HB   MET   1          2HB       MET   1  -7.493  -5.822 -12.991
    6   2HB   MET   1          1HB       MET   1  -8.780  -7.028 -13.170
    7   1HG   MET   1          2HG       MET   1 -10.424  -5.334 -12.196
    8   2HG   MET   1          1HG       MET   1  -9.085  -4.164 -12.076
    9   1HE   MET   1          1HE       MET   1 -11.290  -5.670 -15.852
   10   2HE   MET   1          2HE       MET   1 -11.858  -5.717 -14.152
   11   3HE   MET   1          3HE       MET   1 -10.529  -6.800 -14.687
   12    H    ALA   2           H        ALA   2  -6.005  -5.146 -11.215
   13    HA   ALA   2           HA       ALA   2  -6.600  -3.989  -8.616
   14   1HB   ALA   2          1HB       ALA   2  -4.431  -5.049  -8.851
   15   2HB   ALA   2          2HB       ALA   2  -4.207  -3.272  -8.694
   16   3HB   ALA   2          3HB       ALA   2  -4.050  -4.049 -10.314
   17    H    TYR   3           H        TYR   3  -6.148  -1.854  -8.123
   18    HA   TYR   3           HA       TYR   3  -6.832  -0.007 -10.290
   19   1HB   TYR   3          2HB       TYR   3  -8.103   1.350  -8.983
   20   2HB   TYR   3          1HB       TYR   3  -8.727  -0.287  -8.647
   21    HD1  TYR   3           1HD      TYR   3  -7.626   2.719  -7.430
   22    HD2  TYR   3           2HD      TYR   3  -7.589  -1.397  -6.360
   23    HE1  TYR   3           1HE      TYR   3  -7.423   3.335  -5.049
   24    HE2  TYR   3           2HE      TYR   3  -7.466  -0.797  -4.016
   25    HH   TYR   3           HH       TYR   3  -7.338   0.895  -2.500
   26    H    SER   4           H        SER   4  -5.748   1.981 -10.315
   27    HA   SER   4           HA       SER   4  -3.249   1.959  -8.782
   28   1HB   SER   4          2HB       SER   4  -2.302   3.287 -10.684
   29   2HB   SER   4          1HB       SER   4  -2.771   1.614 -11.118
   30    HG   SER   4           HG       SER   4  -3.660   2.774 -12.676
   31    H    VAL   5           H        VAL   5  -2.686   3.801  -7.680
   32    HA   VAL   5           HA       VAL   5  -3.988   6.252  -8.300
   33    HB   VAL   5           HB       VAL   5  -5.721   5.631  -6.942
   34   1HG1  VAL   5          1HG1      VAL   5  -5.448   4.608  -4.688
   35   2HG1  VAL   5          2HG1      VAL   5  -3.692   4.348  -5.041
   36   3HG1  VAL   5          3HG1      VAL   5  -4.970   3.549  -6.052
   37   1HG2  VAL   5          1HG2      VAL   5  -5.603   7.114  -5.008
   38   2HG2  VAL   5          2HG2      VAL   5  -4.712   7.885  -6.377
   39   3HG2  VAL   5          3HG2      VAL   5  -3.807   7.110  -5.027
   40    H    THR   6           H        THR   6  -2.787   7.950  -7.937
   41    HA   THR   6           HA       THR   6  -0.243   7.523  -6.534
   42    HB   THR   6           HB       THR   6  -1.058   9.468  -8.701
   43    HG1  THR   6           1HG      THR   6  -0.488   7.252  -9.261
   44   1HG2  THR   6          1HG2      THR   6   0.582  10.593  -7.156
   45   2HG2  THR   6          2HG2      THR   6   1.457  10.062  -8.633
   46   3HG2  THR   6          3HG2      THR   6   1.596   9.094  -7.132
   47    H    LEU   7           H        LEU   7   0.019   8.512  -4.644
   48    HA   LEU   7           HA       LEU   7  -1.965  10.510  -3.831
   49   1HB   LEU   7          2HB       LEU   7  -1.887   8.233  -2.714
   50   2HB   LEU   7          1HB       LEU   7  -0.215   8.583  -2.214
   51    HG   LEU   7           HG       LEU   7  -1.119  10.596  -0.896
   52   1HD1  LEU   7          1HD1      LEU   7  -3.568  10.564  -0.329
   53   2HD1  LEU   7          2HD1      LEU   7  -3.834   9.278  -1.556
   54   3HD1  LEU   7          3HD1      LEU   7  -3.307  10.927  -2.074
   55   1HD2  LEU   7          1HD2      LEU   7  -2.057   9.093   0.935
   56   2HD2  LEU   7          2HD2      LEU   7  -0.513   8.494   0.205
   57   3HD2  LEU   7          3HD2      LEU   7  -2.075   7.738  -0.269
   58    H    THR   8           H        THR   8  -1.277  12.462  -2.934
   59    HA   THR   8           HA       THR   8   1.611  12.822  -2.669
   60    HB   THR   8           HB       THR   8   0.676  13.861  -4.764
   61    HG1  THR   8           1HG      THR   8   2.498  14.662  -4.115
   62   1HG2  THR   8          1HG2      THR   8  -0.589  15.867  -2.775
   63   2HG2  THR   8          2HG2      THR   8  -1.515  14.667  -3.757
   64   3HG2  THR   8          3HG2      THR   8  -0.553  15.955  -4.569
   65    H    GLY   9           H        GLY   9   2.239  14.370  -1.019
   66   1HA   GLY   9          2HA       GLY   9   0.714  15.918   0.469
   67   2HA   GLY   9          1HA       GLY   9   0.396  14.277   1.166
   68    HA   PRO  10           HA       PRO  10   4.084  16.209   2.951
   69   1HB   PRO  10          2HB       PRO  10   3.398  16.180   5.656
   70   2HB   PRO  10          1HB       PRO  10   2.903  17.457   4.492
   71   1HG   PRO  10          2HG       PRO  10   1.247  15.024   5.372
   72   2HG   PRO  10          1HG       PRO  10   0.742  16.765   5.286
   73   1HD   PRO  10          2HD       PRO  10   0.184  15.007   3.238
   74   2HD   PRO  10          1HD       PRO  10   0.678  16.728   2.883
   75    H    GLY  11           H        GLY  11   2.457  13.404   4.484
   76   1HA   GLY  11          2HA       GLY  11   4.634  11.728   4.237
   77   2HA   GLY  11          1HA       GLY  11   4.851  12.627   5.772
   78    HA   PRO  12           HA       PRO  12   2.469   9.565   7.579
   79   1HB   PRO  12          2HB       PRO  12   0.723  10.681   9.389
   80   2HB   PRO  12          1HB       PRO  12   2.515  10.779   9.530
   81   1HG   PRO  12          2HG       PRO  12   0.657  12.901   8.310
   82   2HG   PRO  12          1HG       PRO  12   1.916  13.130   9.599
   83   1HD   PRO  12          2HD       PRO  12   2.499  13.618   6.952
   84   2HD   PRO  12          1HD       PRO  12   3.717  12.775   8.014
   85    H    TRP  13           H        TRP  13   1.552   8.836   5.574
   86    HA   TRP  13           HA       TRP  13  -0.712   9.664   4.457
   87   1HB   TRP  13          2HB       TRP  13   0.306   6.766   4.391
   88   2HB   TRP  13          1HB       TRP  13  -0.712   7.504   3.190
   89    HD1  TRP  13           HD       TRP  13   2.814   6.793   3.929
   90    HE1  TRP  13           1HE      TRP  13   4.378   8.069   2.291
   91    HE3  TRP  13           3HE      TRP  13  -0.447  10.334   2.309
   92    HZ2  TRP  13           2HZ      TRP  13   4.216  10.271   0.609
   93    HZ3  TRP  13           3HZ      TRP  13   0.332  12.022   0.756
   94    HH2  TRP  13           HH       TRP  13   2.653  12.025  -0.069
   95    H    GLY  14           H        GLY  14  -0.696   6.856   6.706
   96   1HA   GLY  14          2HA       GLY  14  -2.213   6.906   8.403
   97   2HA   GLY  14          1HA       GLY  14  -3.483   7.566   7.322
   98    H    PHE  15           H        PHE  15  -1.293   4.767   7.006
   99    HA   PHE  15           HA       PHE  15  -3.638   3.006   6.937
  100   1HB   PHE  15          2HB       PHE  15  -2.708   1.900   4.912
  101   2HB   PHE  15          1HB       PHE  15  -2.904   3.636   4.596
  102    HD1  PHE  15           1HD      PHE  15  -0.900   5.083   4.719
  103    HD2  PHE  15           2HD      PHE  15  -0.563   0.867   5.072
  104    HE1  PHE  15           1HE      PHE  15   1.588   5.261   4.828
  105    HE2  PHE  15           2HE      PHE  15   1.856   1.036   4.875
  106    HZ   PHE  15           HZ       PHE  15   2.943   3.232   4.921
  107    H    ARG  16           H        ARG  16  -3.258   0.742   7.084
  108    HA   ARG  16           HA       ARG  16  -1.245   0.358   9.148
  109   1HB   ARG  16          2HB       ARG  16  -4.212  -0.248   9.043
  110   2HB   ARG  16          1HB       ARG  16  -3.180  -1.385   9.970
  111   1HG   ARG  16          2HG       ARG  16  -3.139   1.640  10.402
  112   2HG   ARG  16          1HG       ARG  16  -4.230   0.529  11.296
  113   1HD   ARG  16          2HD       ARG  16  -2.430  -0.579  12.434
  114   2HD   ARG  16          1HD       ARG  16  -1.227  -0.040  11.193
  115    HE   ARG  16           HE       ARG  16  -2.415   2.214  12.685
  116   1HH1  ARG  16          1HH1      ARG  16   0.242  -0.247  12.603
  117   2HH1  ARG  16          2HH1      ARG  16   1.230   0.753  13.647
  118   1HH2  ARG  16          1HH2      ARG  16  -0.873   3.406  14.096
  119   2HH2  ARG  16          2HH2      ARG  16   0.680   2.641  14.372
  120    H    LEU  17           H        LEU  17  -0.029  -1.554   9.121
  121    HA   LEU  17           HA       LEU  17  -0.350  -2.929   6.564
  122   1HB   LEU  17          2HB       LEU  17   2.166  -2.510   8.241
  123   2HB   LEU  17          1HB       LEU  17   2.039  -3.411   6.700
  124    HG   LEU  17           HG       LEU  17   1.069  -1.178   5.712
  125   1HD1  LEU  17          1HD1      LEU  17   2.306   0.816   6.977
  126   2HD1  LEU  17          2HD1      LEU  17   2.297  -0.324   8.386
  127   3HD1  LEU  17          3HD1      LEU  17   0.745   0.199   7.614
  128   1HD2  LEU  17          1HD2      LEU  17   3.165  -2.207   4.996
  129   2HD2  LEU  17          2HD2      LEU  17   4.027  -1.600   6.456
  130   3HD2  LEU  17          3HD2      LEU  17   3.414  -0.436   5.200
  131    H    GLN  18           H        GLN  18  -0.979  -5.039   6.623
  132    HA   GLN  18           HA       GLN  18  -0.072  -6.667   8.861
  133   1HB   GLN  18          2HB       GLN  18  -2.968  -6.356   7.973
  134   2HB   GLN  18          1HB       GLN  18  -2.349  -7.770   8.905
  135   1HG   GLN  18          2HG       GLN  18  -1.433  -5.965  10.587
  136   2HG   GLN  18          1HG       GLN  18  -2.545  -4.825   9.776
  137   1HE2  GLN  18          1HE2      GLN  18  -4.805  -6.692   9.360
  138   2HE2  GLN  18          2HE2      GLN  18  -5.309  -7.259  10.931
  139    H    GLY  19           H        GLY  19   0.862  -8.447   8.234
  140   1HA   GLY  19          2HA       GLY  19   1.157 -10.288   6.971
  141   2HA   GLY  19          1HA       GLY  19   0.263  -9.563   5.598
  142    H    GLY  20           H        GLY  20   2.783 -10.948   5.442
  143   1HA   GLY  20          2HA       GLY  20   4.044  -9.181   3.737
  144   2HA   GLY  20          1HA       GLY  20   4.948  -9.233   5.302
  145    H    LYS  21           H        LYS  21   5.917 -10.073   2.710
  146    HA   LYS  21           HA       LYS  21   5.538 -12.578   2.049
  147   1HB   LYS  21          2HB       LYS  21   6.850 -10.544   0.977
  148   2HB   LYS  21          1HB       LYS  21   8.280 -11.343   1.683
  149   1HG   LYS  21          2HG       LYS  21   8.141 -12.204  -0.527
  150   2HG   LYS  21          1HG       LYS  21   7.422 -13.499   0.469
  151   1HD   LYS  21          2HD       LYS  21   5.170 -12.048  -0.037
  152   2HD   LYS  21          1HD       LYS  21   6.097 -11.542  -1.466
  153   1HE   LYS  21          2HE       LYS  21   5.423 -14.446  -0.638
  154   2HE   LYS  21          1HE       LYS  21   4.592 -13.512  -1.937
  155   1HZ   LYS  21          1HZ       LYS  21   7.500 -14.193  -1.958
  156   2HZ   LYS  21          2HZ       LYS  21   6.580 -13.569  -3.247
  157   3HZ   LYS  21          3HZ       LYS  21   6.291 -15.113  -2.667
  158    H    ASP  22           H        ASP  22   7.722 -11.737   4.686
  159    HA   ASP  22           HA       ASP  22   9.160 -14.123   4.575
  160   1HB   ASP  22          2HB       ASP  22   9.708 -11.838   5.677
  161   2HB   ASP  22          1HB       ASP  22   8.725 -12.389   7.071
  162    H    PHE  23           H        PHE  23   5.956 -13.483   5.758
  163    HA   PHE  23           HA       PHE  23   5.875 -16.145   7.000
  164   1HB   PHE  23          2HB       PHE  23   4.401 -13.500   7.454
  165   2HB   PHE  23          1HB       PHE  23   3.635 -15.054   7.925
  166    HD1  PHE  23           1HD      PHE  23   4.383 -16.322   9.724
  167    HD2  PHE  23           2HD      PHE  23   6.545 -12.857   8.560
  168    HE1  PHE  23           1HE      PHE  23   5.645 -16.411  11.817
  169    HE2  PHE  23           2HE      PHE  23   7.818 -12.951  10.647
  170    HZ   PHE  23           HZ       PHE  23   7.365 -14.717  12.288
  171    H    ASN  24           H        ASN  24   5.823 -15.362   4.118
  172    HA   ASN  24           HA       ASN  24   4.996 -16.075   2.329
  173   1HB   ASN  24          2HB       ASN  24   4.995 -18.181   3.878
  174   2HB   ASN  24          1HB       ASN  24   3.220 -18.108   3.726
  175   1HD2  ASN  24          1HD2      ASN  24   2.491 -17.973   1.267
  176   2HD2  ASN  24          2HD2      ASN  24   3.342 -19.058   0.197
  177    H    MET  25           H        MET  25   3.429 -13.894   3.752
  178    HA   MET  25           HA       MET  25   0.879 -14.243   2.392
  179   1HB   MET  25          2HB       MET  25   1.103 -13.844   4.856
  180   2HB   MET  25          1HB       MET  25   1.824 -12.218   4.484
  181   1HG   MET  25          2HG       MET  25  -0.272 -11.428   3.649
  182   2HG   MET  25          1HG       MET  25  -0.968 -13.090   3.602
  183   1HE   MET  25          1HE       MET  25  -3.185 -11.191   6.127
  184   2HE   MET  25          2HE       MET  25  -3.086 -12.145   4.612
  185   3HE   MET  25          3HE       MET  25  -2.340 -10.512   4.698
  186    HA   PRO  26           HA       PRO  26   2.509 -11.013  -0.265
  187   1HB   PRO  26          2HB       PRO  26   0.121  -9.733  -1.081
  188   2HB   PRO  26          1HB       PRO  26   0.825 -11.196  -1.830
  189   1HG   PRO  26          2HG       PRO  26  -1.601 -11.009  -0.135
  190   2HG   PRO  26          1HG       PRO  26  -1.061 -12.352  -1.186
  191   1HD   PRO  26          2HD       PRO  26  -0.787 -11.739   1.674
  192   2HD   PRO  26          1HD       PRO  26  -0.421 -13.391   1.039
  193    H    LEU  27           H        LEU  27   2.758  -8.595  -0.371
  194    HA   LEU  27           HA       LEU  27   2.468  -7.200   1.996
  195   1HB   LEU  27          2HB       LEU  27   3.846  -6.915  -0.215
  196   2HB   LEU  27          1HB       LEU  27   2.422  -6.062  -0.864
  197    HG   LEU  27           HG       LEU  27   4.151  -5.432   1.560
  198   1HD1  LEU  27          1HD1      LEU  27   3.750  -3.875  -1.090
  199   2HD1  LEU  27          2HD1      LEU  27   5.127  -4.982  -0.730
  200   3HD1  LEU  27          3HD1      LEU  27   4.934  -3.452   0.193
  201   1HD2  LEU  27          1HD2      LEU  27   2.931  -3.196   1.760
  202   2HD2  LEU  27          2HD2      LEU  27   1.873  -4.587   2.131
  203   3HD2  LEU  27          3HD2      LEU  27   1.742  -3.771   0.529
  204    H    THR  28           H        THR  28   0.434  -7.216   2.912
  205    HA   THR  28           HA       THR  28  -1.624  -5.905   1.281
  206    HB   THR  28           HB       THR  28  -3.316  -7.113   1.830
  207    HG1  THR  28           1HG      THR  28  -1.915  -7.802   4.198
  208   1HG2  THR  28          1HG2      THR  28  -1.190  -9.281   2.190
  209   2HG2  THR  28          2HG2      THR  28  -1.577  -8.481   0.616
  210   3HG2  THR  28          3HG2      THR  28  -2.856  -9.417   1.504
  211    H    ILE  29           H        ILE  29  -3.138  -4.649   2.269
  212    HA   ILE  29           HA       ILE  29  -2.063  -3.289   4.676
  213    HB   ILE  29           HB       ILE  29  -3.497  -2.173   2.283
  214   1HG1  ILE  29          2HG1      ILE  29  -0.943  -2.915   2.026
  215   2HG1  ILE  29          1HG1      ILE  29  -1.634  -1.479   1.283
  216   1HG2  ILE  29          1HG2      ILE  29  -2.264  -0.814   4.798
  217   2HG2  ILE  29          2HG2      ILE  29  -4.014  -0.916   4.374
  218   3HG2  ILE  29          3HG2      ILE  29  -2.920   0.055   3.365
  219   1HD1  ILE  29          1HD1      ILE  29  -0.675  -0.010   3.034
  220   2HD1  ILE  29          2HD1      ILE  29   0.601  -1.062   2.336
  221   3HD1  ILE  29          3HD1      ILE  29  -0.096  -1.457   3.952
  222    H    SER  30           H        SER  30  -3.655  -2.457   6.115
  223    HA   SER  30           HA       SER  30  -6.031  -4.128   6.156
  224   1HB   SER  30          2HB       SER  30  -4.469  -4.398   7.958
  225   2HB   SER  30          1HB       SER  30  -4.515  -2.679   8.371
  226    HG   SER  30           HG       SER  30  -6.467  -4.692   8.623
  227    H    ARG  31           H        ARG  31  -5.736  -0.882   7.737
  228    HA   ARG  31           HA       ARG  31  -8.309  -0.292   6.473
  229   1HB   ARG  31          2HB       ARG  31  -8.318  -1.752   8.667
  230   2HB   ARG  31          1HB       ARG  31  -7.967  -0.233   9.505
  231   1HG   ARG  31          2HG       ARG  31 -10.419  -0.814   7.697
  232   2HG   ARG  31          1HG       ARG  31 -10.329  -1.013   9.470
  233   1HD   ARG  31          2HD       ARG  31  -9.781   1.521   9.613
  234   2HD   ARG  31          1HD       ARG  31 -10.346   1.649   7.910
  235    HE   ARG  31           HE       ARG  31 -11.951   0.761  10.309
  236   1HH1  ARG  31          1HH1      ARG  31 -12.021   0.954   6.754
  237   2HH1  ARG  31          2HH1      ARG  31 -13.762   0.870   6.745
  238   1HH2  ARG  31          1HH2      ARG  31 -14.227   1.084  10.185
  239   2HH2  ARG  31          2HH2      ARG  31 -14.952   1.265   8.634
  240    H    ILE  32           H        ILE  32  -8.697   1.891   6.200
  241    HA   ILE  32           HA       ILE  32  -6.469   3.596   6.569
  242    HB   ILE  32           HB       ILE  32  -9.260   4.007   5.531
  243   1HG1  ILE  32          2HG1      ILE  32  -8.198   4.613   3.452
  244   2HG1  ILE  32          1HG1      ILE  32  -6.567   4.453   4.069
  245   1HG2  ILE  32          1HG2      ILE  32  -6.976   6.028   5.896
  246   2HG2  ILE  32          2HG2      ILE  32  -8.665   6.190   6.555
  247   3HG2  ILE  32          3HG2      ILE  32  -8.373   6.285   4.786
  248   1HD1  ILE  32          1HD1      ILE  32  -7.017   1.899   4.300
  249   2HD1  ILE  32          2HD1      ILE  32  -7.135   2.556   2.651
  250   3HD1  ILE  32          3HD1      ILE  32  -8.658   2.218   3.563
  251    H    THR  33           H        THR  33  -6.128   5.267   7.973
  252    HA   THR  33           HA       THR  33  -7.559   5.260  10.405
  253    HB   THR  33           HB       THR  33  -5.491   7.185   9.279
  254    HG1  THR  33           1HG      THR  33  -4.132   6.044  10.526
  255   1HG2  THR  33          1HG2      THR  33  -5.135   7.872  11.638
  256   2HG2  THR  33          2HG2      THR  33  -6.419   6.739  12.201
  257   3HG2  THR  33          3HG2      THR  33  -6.851   8.187  11.235
  258    HA   PRO  34           HA       PRO  34 -11.155   7.626   9.576
  259   1HB   PRO  34          2HB       PRO  34  -9.397   9.375  11.368
  260   2HB   PRO  34          1HB       PRO  34 -11.208   9.486  11.270
  261   1HG   PRO  34          2HG       PRO  34 -10.097   7.773  13.072
  262   2HG   PRO  34          1HG       PRO  34 -11.440   7.153  12.015
  263   1HD   PRO  34          2HD       PRO  34  -8.520   6.547  11.899
  264   2HD   PRO  34          1HD       PRO  34  -9.887   5.587  11.204
  265    H    GLY  35           H        GLY  35  -9.689  10.731   9.752
  266   1HA   GLY  35          2HA       GLY  35 -10.608  11.081   6.987
  267   2HA   GLY  35          1HA       GLY  35 -10.503  12.295   8.299
  268    H    SER  36           H        SER  36  -7.920  10.074   7.639
  269    HA   SER  36           HA       SER  36  -6.161  12.324   7.198
  270   1HB   SER  36          2HB       SER  36  -5.711  10.407   8.818
  271   2HB   SER  36          1HB       SER  36  -5.367   9.384   7.387
  272    HG   SER  36           HG       SER  36  -3.523  10.418   8.321
  273    H    LYS  37           H        LYS  37  -4.178  11.425   5.640
  274    HA   LYS  37           HA       LYS  37  -5.215  12.136   3.177
  275   1HB   LYS  37          2HB       LYS  37  -2.804  12.341   4.329
  276   2HB   LYS  37          1HB       LYS  37  -2.476  10.862   3.402
  277   1HG   LYS  37          2HG       LYS  37  -1.734  12.680   2.053
  278   2HG   LYS  37          1HG       LYS  37  -3.292  12.214   1.305
  279   1HD   LYS  37          2HD       LYS  37  -4.429  14.094   2.516
  280   2HD   LYS  37          1HD       LYS  37  -2.903  14.452   3.383
  281   1HE   LYS  37          2HE       LYS  37  -1.802  15.112   1.230
  282   2HE   LYS  37          1HE       LYS  37  -3.333  14.756   0.337
  283   1HZ   LYS  37          1HZ       LYS  37  -3.067  16.748   2.552
  284   2HZ   LYS  37          2HZ       LYS  37  -4.437  16.448   1.631
  285   3HZ   LYS  37          3HZ       LYS  37  -3.070  17.105   0.899
  286    H    ALA  38           H        ALA  38  -4.244   9.046   4.413
  287    HA   ALA  38           HA       ALA  38  -4.666   7.186   2.486
  288   1HB   ALA  38          1HB       ALA  38  -5.354   7.237   5.433
  289   2HB   ALA  38          2HB       ALA  38  -3.776   6.811   4.670
  290   3HB   ALA  38          3HB       ALA  38  -5.182   5.750   4.402
  291    H    ALA  39           H        ALA  39  -7.278   9.110   3.984
  292    HA   ALA  39           HA       ALA  39  -9.199   7.411   2.597
  293   1HB   ALA  39          1HB       ALA  39  -9.628   8.013   5.007
  294   2HB   ALA  39          2HB       ALA  39 -10.873   8.745   3.939
  295   3HB   ALA  39          3HB       ALA  39  -9.525   9.747   4.594
  296    H    GLN  40           H        GLN  40  -7.797  10.618   2.597
  297    HA   GLN  40           HA       GLN  40  -9.757  12.117   1.577
  298   1HB   GLN  40          2HB       GLN  40  -6.723  12.274   1.421
  299   2HB   GLN  40          1HB       GLN  40  -7.679  13.557   0.666
  300   1HG   GLN  40          2HG       GLN  40  -7.808  12.778   3.643
  301   2HG   GLN  40          1HG       GLN  40  -6.983  14.210   2.943
  302   1HE2  GLN  40          1HE2      GLN  40  -9.556  13.563   4.740
  303   2HE2  GLN  40          2HE2      GLN  40 -10.756  14.627   4.038
  304    H    SER  41           H        SER  41  -7.449  10.393  -0.473
  305    HA   SER  41           HA       SER  41  -8.500  11.875  -2.780
  306   1HB   SER  41          2HB       SER  41  -6.110  11.928  -2.344
  307   2HB   SER  41          1HB       SER  41  -6.008  10.143  -2.489
  308    HG   SER  41           HG       SER  41  -5.492  11.491  -4.419
  309    H    GLN  42           H        GLN  42  -7.488   9.521  -4.475
  310    HA   GLN  42           HA       GLN  42  -9.951   7.969  -4.377
  311   1HB   GLN  42          2HB       GLN  42  -7.546   7.887  -6.276
  312   2HB   GLN  42          1HB       GLN  42  -9.019   6.887  -6.448
  313   1HG   GLN  42          2HG       GLN  42  -8.876   9.956  -6.622
  314   2HG   GLN  42          1HG       GLN  42  -9.113   8.800  -7.977
  315   1HE2  GLN  42          1HE2      GLN  42 -10.821  11.001  -6.367
  316   2HE2  GLN  42          2HE2      GLN  42 -12.376  10.208  -6.304
  317    H    LEU  43           H        LEU  43  -7.359   7.916  -2.546
  318    HA   LEU  43           HA       LEU  43  -6.471   5.239  -2.771
  319   1HB   LEU  43          2HB       LEU  43  -5.270   7.392  -1.791
  320   2HB   LEU  43          1HB       LEU  43  -6.133   6.980  -0.291
  321    HG   LEU  43           HG       LEU  43  -5.078   4.523  -0.873
  322   1HD1  LEU  43          1HD1      LEU  43  -3.036   6.479  -2.093
  323   2HD1  LEU  43          2HD1      LEU  43  -4.094   5.383  -3.042
  324   3HD1  LEU  43          3HD1      LEU  43  -2.868   4.690  -1.907
  325   1HD2  LEU  43          1HD2      LEU  43  -2.995   5.242   0.549
  326   2HD2  LEU  43          2HD2      LEU  43  -4.617   5.484   1.268
  327   3HD2  LEU  43          3HD2      LEU  43  -3.735   6.883   0.559
  328    H    SER  44           H        SER  44  -7.381   3.425  -1.981
  329    HA   SER  44           HA       SER  44  -8.252   3.638   0.793
  330   1HB   SER  44          2HB       SER  44  -9.566   1.842  -1.333
  331   2HB   SER  44          1HB       SER  44  -9.757   1.631   0.441
  332    HG   SER  44           HG       SER  44 -10.480   3.908  -1.084
  333    H    GLN  45           H        GLN  45  -5.727   3.367   0.822
  334    HA   GLN  45           HA       GLN  45  -4.645   1.005  -0.168
  335   1HB   GLN  45          2HB       GLN  45  -3.446   3.091   0.085
  336   2HB   GLN  45          1HB       GLN  45  -3.940   3.228   1.824
  337   1HG   GLN  45          2HG       GLN  45  -2.401   1.764   2.582
  338   2HG   GLN  45          1HG       GLN  45  -2.495   0.793   1.077
  339   1HE2  GLN  45          2HE2      GLN  45  -1.292   4.068   2.205
  340   2HE2  GLN  45          1HE2      GLN  45   0.308   3.891   1.511
  341    H    GLY  46           H        GLY  46  -5.452  -0.843   0.520
  342   1HA   GLY  46          2HA       GLY  46  -5.462  -1.787   3.172
  343   2HA   GLY  46          1HA       GLY  46  -7.028  -1.035   2.756
  344    H    ASP  47           H        ASP  47  -4.859  -2.795   0.524
  345    HA   ASP  47           HA       ASP  47  -6.547  -5.113   0.597
  346   1HB   ASP  47          2HB       ASP  47  -7.372  -3.240  -1.156
  347   2HB   ASP  47          1HB       ASP  47  -6.033  -3.834  -2.163
  348    H    LEU  48           H        LEU  48  -5.363  -6.400  -1.684
  349    HA   LEU  48           HA       LEU  48  -2.736  -6.870  -0.716
  350   1HB   LEU  48          2HB       LEU  48  -4.775  -8.404  -1.268
  351   2HB   LEU  48          1HB       LEU  48  -4.450  -8.057  -2.980
  352    HG   LEU  48           HG       LEU  48  -2.522  -9.445  -0.973
  353   1HD1  LEU  48          1HD1      LEU  48  -4.124 -10.621  -3.308
  354   2HD1  LEU  48          2HD1      LEU  48  -4.598 -10.681  -1.566
  355   3HD1  LEU  48          3HD1      LEU  48  -3.072 -11.492  -2.089
  356   1HD2  LEU  48          1HD2      LEU  48  -1.244  -9.915  -3.198
  357   2HD2  LEU  48          2HD2      LEU  48  -1.198  -8.238  -2.497
  358   3HD2  LEU  48          3HD2      LEU  48  -2.291  -8.578  -3.892
  359    H    VAL  49           H        VAL  49  -1.062  -5.623  -1.486
  360    HA   VAL  49           HA       VAL  49  -1.508  -3.877  -3.644
  361    HB   VAL  49           HB       VAL  49   0.929  -4.355  -1.903
  362   1HG1  VAL  49          1HG1      VAL  49   1.375  -1.963  -2.437
  363   2HG1  VAL  49          2HG1      VAL  49  -0.094  -1.895  -3.474
  364   3HG1  VAL  49          3HG1      VAL  49   1.321  -2.919  -3.963
  365   1HG2  VAL  49          1HG2      VAL  49  -1.558  -2.582  -1.449
  366   2HG2  VAL  49          2HG2      VAL  49  -0.025  -2.491  -0.512
  367   3HG2  VAL  49          3HG2      VAL  49  -1.025  -3.965  -0.418
  368    H    VAL  50           H        VAL  50  -0.643  -4.093  -5.731
  369    HA   VAL  50           HA       VAL  50   0.699  -6.585  -6.316
  370    HB   VAL  50           HB       VAL  50   0.022  -4.502  -8.404
  371   1HG1  VAL  50          1HG1      VAL  50   1.404  -6.541  -8.983
  372   2HG1  VAL  50          2HG1      VAL  50  -0.220  -6.563  -9.764
  373   3HG1  VAL  50          3HG1      VAL  50   0.090  -7.591  -8.322
  374   1HG2  VAL  50          1HG2      VAL  50  -2.047  -4.567  -7.281
  375   2HG2  VAL  50          2HG2      VAL  50  -1.944  -6.358  -6.958
  376   3HG2  VAL  50          3HG2      VAL  50  -2.188  -5.730  -8.639
  377    H    ALA  51           H        ALA  51   1.122  -3.112  -6.960
  378    HA   ALA  51           HA       ALA  51   4.003  -3.444  -6.878
  379   1HB   ALA  51          1HB       ALA  51   4.290  -2.109  -9.014
  380   2HB   ALA  51          2HB       ALA  51   2.507  -2.129  -9.235
  381   3HB   ALA  51          3HB       ALA  51   3.441  -3.666  -9.313
  382    H    ILE  52           H        ILE  52   5.183  -1.657  -6.398
  383    HA   ILE  52           HA       ILE  52   3.724   0.807  -5.817
  384    HB   ILE  52           HB       ILE  52   4.041  -0.588  -3.841
  385   1HG1  ILE  52          2HG1      ILE  52   5.709   2.008  -3.689
  386   2HG1  ILE  52          1HG1      ILE  52   3.942   2.035  -3.975
  387   1HG2  ILE  52          1HG2      ILE  52   6.283  -1.577  -4.454
  388   2HG2  ILE  52          2HG2      ILE  52   6.243  -0.868  -2.800
  389   3HG2  ILE  52          3HG2      ILE  52   7.040   0.036  -4.138
  390   1HD1  ILE  52          1HD1      ILE  52   5.252   0.675  -1.525
  391   2HD1  ILE  52          2HD1      ILE  52   3.505   0.885  -1.824
  392   3HD1  ILE  52          3HD1      ILE  52   4.545   2.335  -1.539
  393    H    ASP  53           H        ASP  53   4.743   2.578  -6.455
  394    HA   ASP  53           HA       ASP  53   5.921   3.754  -7.853
  395   1HB   ASP  53          2HB       ASP  53   7.425   3.405  -5.764
  396   2HB   ASP  53          1HB       ASP  53   8.440   2.370  -6.819
  397    H    GLY  54           H        GLY  54   5.155   0.991  -8.744
  398   1HA   GLY  54          2HA       GLY  54   5.116   0.155 -10.867
  399   2HA   GLY  54          1HA       GLY  54   6.702   0.907 -11.220
  400    H    VAL  55           H        VAL  55   6.731  -0.728  -8.172
  401    HA   VAL  55           HA       VAL  55   8.139  -2.926  -9.502
  402    HB   VAL  55           HB       VAL  55   8.737  -1.686  -6.803
  403   1HG1  VAL  55          1HG1      VAL  55   9.475  -4.079  -7.161
  404   2HG1  VAL  55          2HG1      VAL  55  10.886  -2.961  -7.170
  405   3HG1  VAL  55          3HG1      VAL  55  10.241  -3.610  -8.721
  406   1HG2  VAL  55          1HG2      VAL  55   9.165   0.081  -8.433
  407   2HG2  VAL  55          2HG2      VAL  55   9.940  -1.081  -9.575
  408   3HG2  VAL  55          3HG2      VAL  55  10.735  -0.675  -8.011
  409    H    ASN  56           H        ASN  56   7.431  -4.957  -9.027
  410    HA   ASN  56           HA       ASN  56   5.155  -5.066  -7.378
  411   1HB   ASN  56          2HB       ASN  56   4.549  -6.961  -8.394
  412   2HB   ASN  56          1HB       ASN  56   5.564  -6.170  -9.646
  413   1HD2  ASN  56          1HD2      ASN  56   7.733  -7.116 -10.061
  414   2HD2  ASN  56          2HD2      ASN  56   8.054  -8.768  -9.565
  415    H    THR  57           H        THR  57   4.579  -6.533  -5.729
  416    HA   THR  57           HA       THR  57   6.372  -6.203  -3.666
  417    HB   THR  57           HB       THR  57   4.398  -6.975  -2.335
  418    HG1  THR  57           1HG      THR  57   2.503  -6.976  -3.888
  419   1HG2  THR  57          1HG2      THR  57   3.049  -4.999  -2.971
  420   2HG2  THR  57          2HG2      THR  57   3.841  -4.899  -4.584
  421   3HG2  THR  57          3HG2      THR  57   4.806  -4.597  -3.103
  422    H    ASP  58           H        ASP  58   6.453  -8.812  -5.650
  423    HA   ASP  58           HA       ASP  58   6.165 -10.928  -3.970
  424   1HB   ASP  58          2HB       ASP  58   6.325 -10.883  -6.500
  425   2HB   ASP  58          1HB       ASP  58   8.107 -10.759  -6.349
  426    H    THR  59           H        THR  59   8.923  -8.800  -3.975
  427    HA   THR  59           HA       THR  59   9.965 -10.503  -1.830
  428    HB   THR  59           HB       THR  59  11.358 -10.852  -3.803
  429    HG1  THR  59           1HG      THR  59  12.825  -9.258  -2.069
  430   1HG2  THR  59          1HG2      THR  59  11.926  -7.811  -3.634
  431   2HG2  THR  59          2HG2      THR  59  11.080  -8.676  -4.965
  432   3HG2  THR  59          3HG2      THR  59  12.810  -9.006  -4.646
  433    H    MET  60           H        MET  60   8.069  -8.298  -1.742
  434    HA   MET  60           HA       MET  60   9.659  -6.436  -0.159
  435   1HB   MET  60          2HB       MET  60   6.980  -6.373  -1.572
  436   2HB   MET  60          1HB       MET  60   7.419  -5.148  -0.316
  437   1HG   MET  60          2HG       MET  60   9.494  -4.602  -1.658
  438   2HG   MET  60          1HG       MET  60   8.973  -5.767  -2.904
  439   1HE   MET  60          1HE       MET  60   8.947  -4.341  -4.882
  440   2HE   MET  60          2HE       MET  60   9.828  -3.216  -3.795
  441   3HE   MET  60          3HE       MET  60   8.514  -2.599  -4.856
  442    H    THR  61           H        THR  61   9.863  -6.980   1.873
  443    HA   THR  61           HA       THR  61   7.875  -8.518   3.259
  444    HB   THR  61           HB       THR  61   9.490  -8.525   5.084
  445    HG1  THR  61           1HG      THR  61  11.429  -7.503   4.810
  446   1HG2  THR  61          1HG2      THR  61   9.774 -10.122   3.126
  447   2HG2  THR  61          2HG2      THR  61  11.327  -9.688   3.918
  448   3HG2  THR  61          3HG2      THR  61  10.888  -8.925   2.351
  449    H    HIS  62           H        HIS  62   7.585  -7.639   5.685
  450    HA   HIS  62           HA       HIS  62   6.191  -5.305   5.736
  451   1HB   HIS  62          2HB       HIS  62   6.111  -7.037   7.480
  452   2HB   HIS  62          1HB       HIS  62   7.803  -6.688   7.933
  453    HD1  HIS  62           1HD      HIS  62   7.018  -6.249  10.334
  454    HD2  HIS  62           2HD      HIS  62   5.361  -3.552   7.590
  455    HE1  HIS  62           1HE      HIS  62   5.967  -4.340  11.663
  456    H    LEU  63           H        LEU  63   9.639  -5.642   6.710
  457    HA   LEU  63           HA       LEU  63  10.109  -2.969   7.234
  458   1HB   LEU  63          2HB       LEU  63  11.612  -4.866   7.845
  459   2HB   LEU  63          1HB       LEU  63  11.964  -5.134   6.117
  460    HG   LEU  63           HG       LEU  63  12.945  -2.780   6.023
  461   1HD1  LEU  63          1HD1      LEU  63  11.847  -1.770   8.049
  462   2HD1  LEU  63          2HD1      LEU  63  13.642  -1.734   8.201
  463   3HD1  LEU  63          3HD1      LEU  63  12.687  -2.969   9.099
  464   1HD2  LEU  63          1HD2      LEU  63  14.310  -4.802   6.147
  465   2HD2  LEU  63          2HD2      LEU  63  14.195  -4.805   7.956
  466   3HD2  LEU  63          3HD2      LEU  63  15.072  -3.467   7.100
  467    H    GLU  64           H        GLU  64  10.559  -4.757   4.208
  468    HA   GLU  64           HA       GLU  64  11.654  -2.678   2.723
  469   1HB   GLU  64          2HB       GLU  64  10.651  -5.372   2.341
  470   2HB   GLU  64          1HB       GLU  64  10.080  -4.426   0.974
  471   1HG   GLU  64          2HG       GLU  64  13.007  -4.706   1.967
  472   2HG   GLU  64          1HG       GLU  64  12.277  -5.639   0.624
  473    H    ALA  65           H        ALA  65   8.247  -3.802   2.859
  474    HA   ALA  65           HA       ALA  65   7.114  -2.009   1.155
  475   1HB   ALA  65          1HB       ALA  65   6.165  -4.103   2.044
  476   2HB   ALA  65          2HB       ALA  65   5.024  -2.713   2.316
  477   3HB   ALA  65          3HB       ALA  65   6.018  -3.381   3.685
  478    H    GLN  66           H        GLN  66   7.495  -1.672   4.688
  479    HA   GLN  66           HA       GLN  66   6.375   0.827   5.030
  480   1HB   GLN  66          2HB       GLN  66   8.683  -0.771   6.220
  481   2HB   GLN  66          1HB       GLN  66   8.393   0.863   6.867
  482   1HG   GLN  66          2HG       GLN  66   6.109  -1.209   6.741
  483   2HG   GLN  66          1HG       GLN  66   7.357  -1.286   8.020
  484   1HE2  GLN  66          1HE2      GLN  66   4.369   0.191   7.197
  485   2HE2  GLN  66          2HE2      GLN  66   4.356   1.339   8.503
  486    H    ASN  67           H        ASN  67   9.714  -0.013   4.159
  487    HA   ASN  67           HA       ASN  67  10.550   2.677   3.800
  488   1HB   ASN  67          2HB       ASN  67  11.701  -0.121   3.362
  489   2HB   ASN  67          1HB       ASN  67  12.584   1.293   2.716
  490   1HD2  ASN  67          1HD2      ASN  67  11.607  -0.349   5.705
  491   2HD2  ASN  67          2HD2      ASN  67  12.558   0.696   6.751
  492    H    LYS  68           H        LYS  68   8.590   0.802   1.766
  493    HA   LYS  68           HA       LYS  68   9.515   2.136  -0.631
  494   1HB   LYS  68          2HB       LYS  68   6.946   0.557  -0.143
  495   2HB   LYS  68          1HB       LYS  68   7.551   1.148  -1.721
  496   1HG   LYS  68          2HG       LYS  68   8.723  -1.088   0.028
  497   2HG   LYS  68          1HG       LYS  68   7.762  -1.236  -1.444
  498   1HD   LYS  68          2HD       LYS  68   9.856  -1.705  -2.172
  499   2HD   LYS  68          1HD       LYS  68   9.708   0.005  -2.688
  500   1HE   LYS  68          2HE       LYS  68  11.209   0.723  -0.882
  501   2HE   LYS  68          1HE       LYS  68  11.008  -0.868  -0.021
  502   1HZ   LYS  68          1HZ       LYS  68  12.227  -0.748  -2.722
  503   2HZ   LYS  68          2HZ       LYS  68  12.242  -1.962  -1.536
  504   3HZ   LYS  68          3HZ       LYS  68  13.139  -0.573  -1.290
  505    H    ILE  69           H        ILE  69   6.412   2.166   1.263
  506    HA   ILE  69           HA       ILE  69   5.467   4.476   0.248
  507    HB   ILE  69           HB       ILE  69   5.121   3.083   2.910
  508   1HG1  ILE  69          2HG1      ILE  69   3.286   3.294   0.455
  509   2HG1  ILE  69          1HG1      ILE  69   4.371   1.937   0.643
  510   1HG2  ILE  69          1HG2      ILE  69   4.398   5.364   3.344
  511   2HG2  ILE  69          2HG2      ILE  69   2.890   4.486   2.880
  512   3HG2  ILE  69          3HG2      ILE  69   3.717   5.536   1.686
  513   1HD1  ILE  69          1HD1      ILE  69   3.369   1.440   2.946
  514   2HD1  ILE  69          2HD1      ILE  69   2.422   1.033   1.475
  515   3HD1  ILE  69          3HD1      ILE  69   1.984   2.502   2.413
  516    H    LYS  70           H        LYS  70   7.523   4.226   3.198
  517    HA   LYS  70           HA       LYS  70   7.042   6.940   3.791
  518   1HB   LYS  70          2HB       LYS  70   8.511   4.632   4.958
  519   2HB   LYS  70          1HB       LYS  70   9.185   6.201   5.395
  520   1HG   LYS  70          2HG       LYS  70   7.584   5.326   7.040
  521   2HG   LYS  70          1HG       LYS  70   7.266   6.978   6.442
  522   1HD   LYS  70          2HD       LYS  70   5.393   6.205   5.062
  523   2HD   LYS  70          1HD       LYS  70   5.767   4.493   5.405
  524   1HE   LYS  70          2HE       LYS  70   3.775   5.492   6.684
  525   2HE   LYS  70          1HE       LYS  70   5.021   4.688   7.714
  526   1HZ   LYS  70          1HZ       LYS  70   5.218   7.598   7.209
  527   2HZ   LYS  70          2HZ       LYS  70   5.779   6.646   8.488
  528   3HZ   LYS  70          3HZ       LYS  70   4.147   7.000   8.383
  529    H    SER  71           H        SER  71   8.953   6.075   1.241
  530    HA   SER  71           HA       SER  71  10.897   8.168   1.904
  531   1HB   SER  71          2HB       SER  71  12.245   7.391   0.053
  532   2HB   SER  71          1HB       SER  71  11.932   6.076   1.228
  533    HG   SER  71           HG       SER  71  11.629   5.272  -0.779
  534    H    ALA  72           H        ALA  72   7.938   7.759   0.426
  535    HA   ALA  72           HA       ALA  72   8.469   9.646  -1.731
  536   1HB   ALA  72          1HB       ALA  72   7.337   7.455  -2.175
  537   2HB   ALA  72          2HB       ALA  72   6.263   8.848  -2.582
  538   3HB   ALA  72          3HB       ALA  72   6.036   7.913  -1.039
  539    H    SER  73           H        SER  73   7.045  11.441  -2.107
  540    HA   SER  73           HA       SER  73   5.239  12.208  -0.002
  541   1HB   SER  73          2HB       SER  73   6.260  14.469   0.354
  542   2HB   SER  73          1HB       SER  73   7.158  13.107   1.076
  543    HG   SER  73           HG       SER  73   8.711  13.297  -0.343
  544    H    TYR  74           H        TYR  74   6.996  13.439  -2.849
  545    HA   TYR  74           HA       TYR  74   4.873  15.039  -3.730
  546   1HB   TYR  74          2HB       TYR  74   7.295  15.328  -4.348
  547   2HB   TYR  74          1HB       TYR  74   7.219  13.799  -5.285
  548    HD1  TYR  74           1HD      TYR  74   5.216  16.982  -4.987
  549    HD2  TYR  74           2HD      TYR  74   7.080  14.125  -7.523
  550    HE1  TYR  74           1HE      TYR  74   4.596  18.312  -6.942
  551    HE2  TYR  74           2HE      TYR  74   6.444  15.437  -9.481
  552    HH   TYR  74           HH       TYR  74   5.260  17.210 -10.239
  553    H    ASN  75           H        ASN  75   5.889  11.705  -4.653
  554    HA   ASN  75           HA       ASN  75   3.105  11.220  -5.028
  555   1HB   ASN  75          2HB       ASN  75   3.383  10.097  -7.313
  556   2HB   ASN  75          1HB       ASN  75   3.239  11.887  -7.224
  557   1HD2  ASN  75          1HD2      ASN  75   5.942   9.461  -6.992
  558   2HD2  ASN  75          2HD2      ASN  75   6.686  10.032  -8.484
  559    H    LEU  76           H        LEU  76   2.597   9.592  -3.939
  560    HA   LEU  76           HA       LEU  76   4.302   7.220  -3.893
  561   1HB   LEU  76          2HB       LEU  76   3.532   8.183  -1.726
  562   2HB   LEU  76          1HB       LEU  76   1.849   8.119  -2.275
  563    HG   LEU  76           HG       LEU  76   1.981   5.587  -2.361
  564   1HD1  LEU  76          1HD1      LEU  76   4.783   6.017  -1.148
  565   2HD1  LEU  76          2HD1      LEU  76   4.445   5.314  -2.779
  566   3HD1  LEU  76          3HD1      LEU  76   3.913   4.441  -1.301
  567   1HD2  LEU  76          1HD2      LEU  76   2.014   5.264   0.107
  568   2HD2  LEU  76          2HD2      LEU  76   1.124   6.771  -0.347
  569   3HD2  LEU  76          3HD2      LEU  76   2.797   6.875   0.310
  570    H    SER  77           H        SER  77   3.857   6.005  -5.716
  571    HA   SER  77           HA       SER  77   1.094   5.955  -6.687
  572   1HB   SER  77          2HB       SER  77   3.678   5.105  -8.054
  573   2HB   SER  77          1HB       SER  77   2.046   5.159  -8.816
  574    HG   SER  77           HG       SER  77   2.072   7.341  -8.659
  575    H    LEU  78           H        LEU  78  -0.100   4.329  -5.883
  576    HA   LEU  78           HA       LEU  78   1.177   1.736  -5.469
  577   1HB   LEU  78          2HB       LEU  78  -1.555   2.644  -4.457
  578   2HB   LEU  78          1HB       LEU  78  -0.596   1.214  -3.972
  579    HG   LEU  78           HG       LEU  78  -0.521   2.682  -2.158
  580   1HD1  LEU  78          1HD1      LEU  78   1.807   3.189  -1.796
  581   2HD1  LEU  78          2HD1      LEU  78   2.146   3.247  -3.567
  582   3HD1  LEU  78          3HD1      LEU  78   1.701   1.683  -2.783
  583   1HD2  LEU  78          1HD2      LEU  78  -0.169   4.980  -2.053
  584   2HD2  LEU  78          2HD2      LEU  78  -1.342   4.734  -3.410
  585   3HD2  LEU  78          3HD2      LEU  78   0.379   5.090  -3.772
  586    H    THR  79           H        THR  79   0.385  -0.112  -6.491
  587    HA   THR  79           HA       THR  79  -2.263   0.104  -7.707
  588    HB   THR  79           HB       THR  79   0.103  -1.491  -8.774
  589    HG1  THR  79           1HG      THR  79  -0.303  -0.104 -10.574
  590   1HG2  THR  79          1HG2      THR  79  -2.829  -1.134  -9.682
  591   2HG2  THR  79          2HG2      THR  79  -2.050  -2.663  -9.100
  592   3HG2  THR  79          3HG2      THR  79  -1.541  -1.941 -10.669
  593    H    LEU  80           H        LEU  80  -3.556  -1.115  -6.348
  594    HA   LEU  80           HA       LEU  80  -2.593  -3.708  -5.421
  595   1HB   LEU  80          2HB       LEU  80  -3.682  -3.404  -3.339
  596   2HB   LEU  80          1HB       LEU  80  -2.480  -2.083  -3.575
  597    HG   LEU  80           HG       LEU  80  -5.469  -1.947  -4.009
  598   1HD1  LEU  80          1HD1      LEU  80  -4.661  -2.286  -1.636
  599   2HD1  LEU  80          2HD1      LEU  80  -5.598  -0.726  -1.893
  600   3HD1  LEU  80          3HD1      LEU  80  -3.765  -0.708  -1.766
  601   1HD2  LEU  80          1HD2      LEU  80  -3.105  -0.052  -4.275
  602   2HD2  LEU  80          2HD2      LEU  80  -4.677   0.718  -3.705
  603   3HD2  LEU  80          3HD2      LEU  80  -4.589  -0.119  -5.321
  604    H    GLN  81           H        GLN  81  -4.444  -5.142  -4.855
  605    HA   GLN  81           HA       GLN  81  -6.135  -5.139  -7.142
  606   1HB   GLN  81          2HB       GLN  81  -5.979  -7.138  -4.874
  607   2HB   GLN  81          1HB       GLN  81  -6.883  -7.306  -6.416
  608   1HG   GLN  81          2HG       GLN  81  -4.598  -6.920  -7.618
  609   2HG   GLN  81          1HG       GLN  81  -3.850  -7.305  -6.025
  610   1HE2  GLN  81          1HE2      GLN  81  -3.500  -9.521  -5.693
  611   2HE2  GLN  81          2HE2      GLN  81  -4.344 -10.787  -6.554
  612    H    LYS  82           H        LYS  82  -8.491  -5.605  -7.124
  613    HA   LYS  82           HA       LYS  82  -9.753  -5.060  -4.554
  614   1HB   LYS  82          2HB       LYS  82 -10.903  -5.429  -7.265
  615   2HB   LYS  82          1HB       LYS  82 -11.820  -6.115  -5.909
  616   1HG   LYS  82          2HG       LYS  82 -12.649  -3.910  -6.227
  617   2HG   LYS  82          1HG       LYS  82 -11.865  -4.082  -4.640
  618   1HD   LYS  82          2HD       LYS  82 -11.308  -1.886  -5.636
  619   2HD   LYS  82          1HD       LYS  82  -9.849  -2.902  -5.414
  620   1HE   LYS  82          2HE       LYS  82  -9.704  -1.797  -7.593
  621   2HE   LYS  82          1HE       LYS  82  -9.874  -3.602  -7.754
  622   1HZ   LYS  82          1HZ       LYS  82 -12.227  -3.279  -8.280
  623   2HZ   LYS  82          2HZ       LYS  82 -11.398  -2.245  -9.290
  624   3HZ   LYS  82          3HZ       LYS  82 -12.139  -1.647  -7.913
  625    H    SER  83           H        SER  83  -8.593  -6.852  -3.375
  626    HA   SER  83           HA       SER  83 -10.000  -9.351  -3.853
  627   1HB   SER  83          2HB       SER  83  -6.965  -9.147  -3.511
  628   2HB   SER  83          1HB       SER  83  -7.927 -10.665  -3.333
  629    HG   SER  83           HG       SER  83  -7.343 -10.700  -5.399
  630    H    LYS  84           H        LYS  84 -11.124  -7.972  -2.214
  631    HA   LYS  84           HA       LYS  84  -9.908  -7.184   0.087
  632   1HB   LYS  84          2HB       LYS  84 -12.869  -7.777  -0.416
  633   2HB   LYS  84          1HB       LYS  84 -12.206  -6.828   0.943
  634   1HG   LYS  84          2HG       LYS  84 -11.172  -5.277  -0.949
  635   2HG   LYS  84          1HG       LYS  84 -12.299  -6.143  -2.028
  636   1HD   LYS  84          2HD       LYS  84 -13.653  -4.402  -1.426
  637   2HD   LYS  84          1HD       LYS  84 -14.112  -5.550  -0.143
  638   1HE   LYS  84          2HE       LYS  84 -12.202  -3.121   0.029
  639   2HE   LYS  84          1HE       LYS  84 -13.827  -3.286   0.790
  640   1HZ   LYS  84          1HZ       LYS  84 -12.862  -5.097   2.173
  641   2HZ   LYS  84          2HZ       LYS  84 -12.127  -3.587   2.392
  642   3HZ   LYS  84          3HZ       LYS  84 -11.345  -4.766   1.506
  643    H    ARG  85           H        ARG  85  -8.853  -8.591   1.430
  644    HA   ARG  85           HA       ARG  85 -10.674 -10.227   3.031
  645   1HB   ARG  85          2HB       ARG  85  -7.770 -10.967   2.445
  646   2HB   ARG  85          1HB       ARG  85  -8.964 -11.866   3.434
  647   1HG   ARG  85          2HG       ARG  85 -10.343 -11.983   1.154
  648   2HG   ARG  85          1HG       ARG  85  -8.801 -11.504   0.405
  649   1HD   ARG  85          2HD       ARG  85  -8.799 -13.884   0.253
  650   2HD   ARG  85          1HD       ARG  85  -7.732 -13.566   1.675
  651    HE   ARG  85           HE       ARG  85 -10.711 -14.212   1.850
  652   1HH1  ARG  85          1HH1      ARG  85  -7.508 -14.562   3.500
  653   2HH1  ARG  85          2HH1      ARG  85  -8.311 -15.026   4.958
  654   1HH2  ARG  85          1HH2      ARG  85 -11.569 -14.745   3.691
  655   2HH2  ARG  85          2HH2      ARG  85 -10.620 -14.890   5.143
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1  -8.622  -7.655  -9.406
    2   2H    MET   1          2HT       MET   1  -8.800  -8.518 -10.845
    3   3H    MET   1          3HT       MET   1  -9.708  -7.142 -10.542
    4    HA   MET   1           HA       MET   1  -6.843  -7.318 -11.178
    5   1HB   MET   1          2HB       MET   1  -9.145  -5.654 -12.358
    6   2HB   MET   1          1HB       MET   1  -7.451  -5.587 -12.902
    7   1HG   MET   1          2HG       MET   1  -7.566  -8.047 -13.490
    8   2HG   MET   1          1HG       MET   1  -9.301  -8.028 -13.066
    9   1HE   MET   1          1HE       MET   1  -6.496  -7.202 -15.520
   10   2HE   MET   1          2HE       MET   1  -6.841  -5.510 -15.028
   11   3HE   MET   1          3HE       MET   1  -7.196  -6.048 -16.700
   12    H    ALA   2           H        ALA   2  -5.711  -5.080 -11.333
   13    HA   ALA   2           HA       ALA   2  -6.184  -3.929  -8.688
   14   1HB   ALA   2          1HB       ALA   2  -4.177  -5.268  -8.805
   15   2HB   ALA   2          2HB       ALA   2  -3.724  -3.537  -8.656
   16   3HB   ALA   2          3HB       ALA   2  -3.596  -4.365 -10.262
   17    H    TYR   3           H        TYR   3  -5.985  -1.902  -8.157
   18    HA   TYR   3           HA       TYR   3  -6.268  -0.013 -10.375
   19   1HB   TYR   3          2HB       TYR   3  -7.602   1.380  -9.161
   20   2HB   TYR   3          1HB       TYR   3  -8.265  -0.254  -8.855
   21    HD1  TYR   3           1HD      TYR   3  -7.475   2.747  -7.519
   22    HD2  TYR   3           2HD      TYR   3  -7.065  -1.377  -6.547
   23    HE1  TYR   3           1HE      TYR   3  -7.431   3.309  -5.119
   24    HE2  TYR   3           2HE      TYR   3  -7.120  -0.840  -4.198
   25    HH   TYR   3           HH       TYR   3  -7.174   0.773  -2.646
   26    H    SER   4           H        SER   4  -5.228   2.064 -10.190
   27    HA   SER   4           HA       SER   4  -2.941   2.032  -8.362
   28   1HB   SER   4          2HB       SER   4  -2.915   2.998 -11.269
   29   2HB   SER   4          1HB       SER   4  -1.553   3.127 -10.103
   30    HG   SER   4           HG       SER   4  -1.361   0.933 -10.116
   31    H    VAL   5           H        VAL   5  -2.546   3.994  -7.367
   32    HA   VAL   5           HA       VAL   5  -3.689   6.372  -8.439
   33    HB   VAL   5           HB       VAL   5  -5.630   5.793  -7.305
   34   1HG1  VAL   5          1HG1      VAL   5  -5.655   5.169  -4.880
   35   2HG1  VAL   5          2HG1      VAL   5  -3.870   4.861  -4.996
   36   3HG1  VAL   5          3HG1      VAL   5  -5.031   3.908  -6.008
   37   1HG2  VAL   5          1HG2      VAL   5  -5.866   7.493  -5.579
   38   2HG2  VAL   5          2HG2      VAL   5  -4.836   8.146  -6.899
   39   3HG2  VAL   5          3HG2      VAL   5  -4.087   7.609  -5.348
   40    H    THR   6           H        THR   6  -2.649   8.201  -7.745
   41    HA   THR   6           HA       THR   6  -0.132   7.665  -6.351
   42    HB   THR   6           HB       THR   6  -0.789   9.847  -8.346
   43    HG1  THR   6           1HG      THR   6   0.425   8.719  -9.719
   44   1HG2  THR   6          1HG2      THR   6   1.105  10.410  -6.699
   45   2HG2  THR   6          2HG2      THR   6   1.716  10.140  -8.356
   46   3HG2  THR   6          3HG2      THR   6   1.906   8.851  -7.128
   47    H    LEU   7           H        LEU   7   0.106   8.670  -4.405
   48    HA   LEU   7           HA       LEU   7  -1.606  10.959  -3.768
   49   1HB   LEU   7          2HB       LEU   7  -0.031   8.959  -2.139
   50   2HB   LEU   7          1HB       LEU   7  -0.344  10.575  -1.455
   51    HG   LEU   7           HG       LEU   7  -2.773  10.300  -1.754
   52   1HD1  LEU   7          1HD1      LEU   7  -2.930   8.632  -3.573
   53   2HD1  LEU   7          2HD1      LEU   7  -3.729   8.000  -2.098
   54   3HD1  LEU   7          3HD1      LEU   7  -2.090   7.399  -2.557
   55   1HD2  LEU   7          1HD2      LEU   7  -1.675   9.826   0.407
   56   2HD2  LEU   7          2HD2      LEU   7  -1.382   8.113  -0.079
   57   3HD2  LEU   7          3HD2      LEU   7  -3.071   8.719   0.150
   58    H    THR   8           H        THR   8  -0.747  12.921  -2.974
   59    HA   THR   8           HA       THR   8   2.126  13.219  -3.327
   60    HB   THR   8           HB       THR   8   0.863  14.196  -5.220
   61    HG1  THR   8           1HG      THR   8   2.907  14.835  -4.770
   62   1HG2  THR   8          1HG2      THR   8   0.115  16.379  -3.163
   63   2HG2  THR   8          2HG2      THR   8  -1.049  15.202  -3.895
   64   3HG2  THR   8          3HG2      THR   8  -0.179  16.389  -4.935
   65    H    GLY   9           H        GLY   9   3.215  14.149  -1.924
   66   1HA   GLY   9          2HA       GLY   9   3.603  14.358   0.290
   67   2HA   GLY   9          1HA       GLY   9   3.621  15.938  -0.493
   68    HA   PRO  10           HA       PRO  10   1.585  17.417   2.796
   69   1HB   PRO  10          2HB       PRO  10  -0.693  18.645   1.207
   70   2HB   PRO  10          1HB       PRO  10   0.411  19.433   2.406
   71   1HG   PRO  10          2HG       PRO  10   0.845  19.768  -0.293
   72   2HG   PRO  10          1HG       PRO  10   2.245  19.448   0.813
   73   1HD   PRO  10          2HD       PRO  10   0.771  17.433  -0.975
   74   2HD   PRO  10          1HD       PRO  10   2.551  17.680  -0.704
   75    H    GLY  11           H        GLY  11   0.872  15.895   4.110
   76   1HA   GLY  11          2HA       GLY  11  -1.215  15.443   5.361
   77   2HA   GLY  11          1HA       GLY  11  -1.828  14.794   3.799
   78    HA   PRO  12           HA       PRO  12   1.375  11.785   5.419
   79   1HB   PRO  12          2HB       PRO  12   0.771  10.707   7.880
   80   2HB   PRO  12          1HB       PRO  12   1.657  12.270   7.703
   81   1HG   PRO  12          2HG       PRO  12  -1.363  11.904   8.156
   82   2HG   PRO  12          1HG       PRO  12  -0.210  12.942   9.104
   83   1HD   PRO  12          2HD       PRO  12  -1.735  13.940   6.995
   84   2HD   PRO  12          1HD       PRO  12  -0.040  14.533   7.303
   85    H    TRP  13           H        TRP  13   1.236   9.564   4.983
   86    HA   TRP  13           HA       TRP  13  -1.424   8.515   4.495
   87   1HB   TRP  13          2HB       TRP  13   0.468   6.569   3.710
   88   2HB   TRP  13          1HB       TRP  13  -0.506   7.486   2.688
   89    HD1  TRP  13           HD       TRP  13   2.960   6.872   3.845
   90    HE1  TRP  13           1HE      TRP  13   4.635   8.139   2.298
   91    HE3  TRP  13           3HE      TRP  13  -0.212  10.297   1.883
   92    HZ2  TRP  13           2HZ      TRP  13   4.587  10.368   0.638
   93    HZ3  TRP  13           3HZ      TRP  13   0.682  12.038   0.415
   94    HH2  TRP  13           HH       TRP  13   3.055  12.078  -0.193
   95    H    GLY  14           H        GLY  14  -2.317   7.743   6.311
   96   1HA   GLY  14          2HA       GLY  14  -0.712   6.082   8.110
   97   2HA   GLY  14          1HA       GLY  14  -2.218   7.002   8.463
   98    H    PHE  15           H        PHE  15  -0.977   4.440   6.369
   99    HA   PHE  15           HA       PHE  15  -3.437   2.891   6.685
  100   1HB   PHE  15          2HB       PHE  15  -2.551   1.628   4.659
  101   2HB   PHE  15          1HB       PHE  15  -2.679   3.367   4.365
  102    HD1  PHE  15           1HD      PHE  15  -0.797   4.775   4.271
  103    HD2  PHE  15           2HD      PHE  15  -0.222   0.621   5.018
  104    HE1  PHE  15           1HE      PHE  15   1.659   5.091   4.331
  105    HE2  PHE  15           2HE      PHE  15   2.189   0.936   4.811
  106    HZ   PHE  15           HZ       PHE  15   3.130   3.160   4.596
  107    H    ARG  16           H        ARG  16  -3.389   0.643   7.153
  108    HA   ARG  16           HA       ARG  16  -1.464   0.284   9.298
  109   1HB   ARG  16          2HB       ARG  16  -4.289  -0.771   8.786
  110   2HB   ARG  16          1HB       ARG  16  -3.287  -1.332  10.153
  111   1HG   ARG  16          2HG       ARG  16  -3.321   0.932  11.148
  112   2HG   ARG  16          1HG       ARG  16  -3.953   1.627   9.622
  113   1HD   ARG  16          2HD       ARG  16  -5.727   1.615  11.255
  114   2HD   ARG  16          1HD       ARG  16  -6.132   0.485   9.901
  115    HE   ARG  16           HE       ARG  16  -4.826  -1.111  11.874
  116   1HH1  ARG  16          1HH1      ARG  16  -7.847   0.890  11.863
  117   2HH1  ARG  16          2HH1      ARG  16  -8.393   0.056  13.304
  118   1HH2  ARG  16          1HH2      ARG  16  -5.741  -2.126  13.639
  119   2HH2  ARG  16          2HH2      ARG  16  -7.274  -1.519  14.270
  120    H    LEU  17           H        LEU  17  -0.028  -1.551   9.177
  121    HA   LEU  17           HA       LEU  17  -0.399  -3.062   6.731
  122   1HB   LEU  17          2HB       LEU  17   2.041  -2.692   8.550
  123   2HB   LEU  17          1HB       LEU  17   2.002  -3.693   7.069
  124    HG   LEU  17           HG       LEU  17   3.090  -1.662   6.532
  125   1HD1  LEU  17          1HD1      LEU  17   1.858  -1.038   4.575
  126   2HD1  LEU  17          2HD1      LEU  17   0.272  -1.468   5.351
  127   3HD1  LEU  17          3HD1      LEU  17   1.476  -2.752   4.943
  128   1HD2  LEU  17          1HD2      LEU  17   2.400   0.562   6.913
  129   2HD2  LEU  17          2HD2      LEU  17   2.010  -0.275   8.455
  130   3HD2  LEU  17          3HD2      LEU  17   0.702   0.091   7.277
  131    H    GLN  18           H        GLN  18  -0.759  -5.241   6.658
  132    HA   GLN  18           HA       GLN  18  -0.189  -6.805   9.025
  133   1HB   GLN  18          2HB       GLN  18  -2.981  -6.520   7.807
  134   2HB   GLN  18          1HB       GLN  18  -2.472  -7.881   8.863
  135   1HG   GLN  18          2HG       GLN  18  -1.874  -6.104  10.650
  136   2HG   GLN  18          1HG       GLN  18  -2.712  -4.897   9.636
  137   1HE2  GLN  18          1HE2      GLN  18  -3.199  -8.150  11.163
  138   2HE2  GLN  18          2HE2      GLN  18  -4.856  -7.876  11.597
  139    H    GLY  19           H        GLY  19   0.586  -8.773   8.472
  140   1HA   GLY  19          2HA       GLY  19   1.150 -10.488   7.214
  141   2HA   GLY  19          1HA       GLY  19   0.018  -9.952   5.933
  142    H    GLY  20           H        GLY  20   2.289 -11.139   5.115
  143   1HA   GLY  20          2HA       GLY  20   3.268  -9.505   3.263
  144   2HA   GLY  20          1HA       GLY  20   4.370  -9.255   4.674
  145    H    LYS  21           H        LYS  21   5.514 -10.173   2.472
  146    HA   LYS  21           HA       LYS  21   5.615 -12.889   2.089
  147   1HB   LYS  21          2HB       LYS  21   7.183 -10.500   1.295
  148   2HB   LYS  21          1HB       LYS  21   8.189 -11.973   1.405
  149   1HG   LYS  21          2HG       LYS  21   7.479 -11.919  -0.804
  150   2HG   LYS  21          1HG       LYS  21   6.496 -13.184  -0.015
  151   1HD   LYS  21          2HD       LYS  21   4.699 -11.232   0.295
  152   2HD   LYS  21          1HD       LYS  21   5.711 -10.322  -0.854
  153   1HE   LYS  21          2HE       LYS  21   3.837 -11.392  -2.054
  154   2HE   LYS  21          1HE       LYS  21   5.391 -12.130  -2.595
  155   1HZ   LYS  21          1HZ       LYS  21   4.925 -14.021  -1.129
  156   2HZ   LYS  21          2HZ       LYS  21   3.635 -13.750  -2.141
  157   3HZ   LYS  21          3HZ       LYS  21   3.563 -13.252  -0.514
  158    H    ASP  22           H        ASP  22   6.963 -11.125   4.733
  159    HA   ASP  22           HA       ASP  22   8.901 -13.120   5.413
  160   1HB   ASP  22          2HB       ASP  22   9.604 -11.030   5.927
  161   2HB   ASP  22          1HB       ASP  22   7.976 -10.411   6.274
  162    H    PHE  23           H        PHE  23   5.490 -12.653   5.924
  163    HA   PHE  23           HA       PHE  23   5.390 -15.045   7.592
  164   1HB   PHE  23          2HB       PHE  23   3.608 -12.688   6.978
  165   2HB   PHE  23          1HB       PHE  23   2.752 -14.245   7.134
  166    HD1  PHE  23           1HD      PHE  23   2.585 -15.393   9.159
  167    HD2  PHE  23           2HD      PHE  23   4.836 -11.805   8.925
  168    HE1  PHE  23           1HE      PHE  23   2.507 -15.193  11.597
  169    HE2  PHE  23           2HE      PHE  23   4.742 -11.585  11.364
  170    HZ   PHE  23           HZ       PHE  23   3.571 -13.276  12.708
  171    H    ASN  24           H        ASN  24   5.869 -14.559   4.448
  172    HA   ASN  24           HA       ASN  24   5.497 -15.531   2.609
  173   1HB   ASN  24          2HB       ASN  24   4.301 -17.878   4.145
  174   2HB   ASN  24          1HB       ASN  24   4.869 -17.914   2.439
  175   1HD2  ASN  24          1HD2      ASN  24   7.298 -16.778   2.318
  176   2HD2  ASN  24          2HD2      ASN  24   8.380 -17.623   3.379
  177    H    MET  25           H        MET  25   3.353 -13.844   3.712
  178    HA   MET  25           HA       MET  25   0.997 -14.816   2.366
  179   1HB   MET  25          2HB       MET  25   1.699 -13.171   4.651
  180   2HB   MET  25          1HB       MET  25   0.616 -12.227   3.617
  181   1HG   MET  25          2HG       MET  25  -0.670 -13.443   5.285
  182   2HG   MET  25          1HG       MET  25  -1.045 -14.116   3.685
  183   1HE   MET  25          1HE       MET  25  -2.156 -15.619   5.791
  184   2HE   MET  25          2HE       MET  25  -1.608 -17.309   5.497
  185   3HE   MET  25          3HE       MET  25  -2.007 -16.243   4.115
  186    HA   PRO  26           HA       PRO  26   1.559 -11.649  -0.809
  187   1HB   PRO  26          2HB       PRO  26  -1.071 -10.405  -0.770
  188   2HB   PRO  26          1HB       PRO  26  -0.517 -11.739  -1.806
  189   1HG   PRO  26          2HG       PRO  26  -2.419 -11.861   0.406
  190   2HG   PRO  26          1HG       PRO  26  -1.901 -13.156  -0.716
  191   1HD   PRO  26          2HD       PRO  26  -0.939 -12.302   2.042
  192   2HD   PRO  26          1HD       PRO  26  -0.833 -13.987   1.413
  193    H    LEU  27           H        LEU  27   1.914  -9.188  -0.903
  194    HA   LEU  27           HA       LEU  27   2.206  -8.129   1.680
  195   1HB   LEU  27          2HB       LEU  27   3.466  -7.739  -0.567
  196   2HB   LEU  27          1HB       LEU  27   2.200  -6.548  -0.966
  197    HG   LEU  27           HG       LEU  27   3.610  -6.621   1.721
  198   1HD1  LEU  27          1HD1      LEU  27   4.762  -4.976  -0.610
  199   2HD1  LEU  27          2HD1      LEU  27   5.314  -6.659  -0.263
  200   3HD1  LEU  27          3HD1      LEU  27   5.525  -5.376   0.981
  201   1HD2  LEU  27          1HD2      LEU  27   3.299  -4.102   1.734
  202   2HD2  LEU  27          2HD2      LEU  27   1.730  -4.966   1.582
  203   3HD2  LEU  27          3HD2      LEU  27   2.489  -4.206   0.136
  204    H    THR  28           H        THR  28   0.359  -7.880   2.857
  205    HA   THR  28           HA       THR  28  -1.882  -6.608   1.457
  206    HB   THR  28           HB       THR  28  -3.384  -7.706   2.282
  207    HG1  THR  28           1HG      THR  28  -2.030  -7.886   4.748
  208   1HG2  THR  28          1HG2      THR  28  -1.120  -9.589   3.202
  209   2HG2  THR  28          2HG2      THR  28  -1.523  -9.227   1.475
  210   3HG2  THR  28          3HG2      THR  28  -2.755 -10.023   2.541
  211    H    ILE  29           H        ILE  29  -2.989  -5.028   2.318
  212    HA   ILE  29           HA       ILE  29  -1.860  -3.604   4.672
  213    HB   ILE  29           HB       ILE  29  -2.993  -2.378   2.171
  214   1HG1  ILE  29          2HG1      ILE  29  -0.251  -2.754   3.451
  215   2HG1  ILE  29          1HG1      ILE  29  -0.749  -3.133   1.786
  216   1HG2  ILE  29          1HG2      ILE  29  -2.044  -1.097   4.833
  217   2HG2  ILE  29          2HG2      ILE  29  -3.763  -1.186   4.269
  218   3HG2  ILE  29          3HG2      ILE  29  -2.598  -0.226   3.352
  219   1HD1  ILE  29          1HD1      ILE  29  -0.747  -0.796   1.147
  220   2HD1  ILE  29          2HD1      ILE  29   0.794  -1.159   1.996
  221   3HD1  ILE  29          3HD1      ILE  29  -0.490  -0.253   2.864
  222    H    SER  30           H        SER  30  -3.494  -2.794   6.098
  223    HA   SER  30           HA       SER  30  -5.910  -4.428   5.973
  224   1HB   SER  30          2HB       SER  30  -4.518  -4.685   7.910
  225   2HB   SER  30          1HB       SER  30  -4.574  -2.946   8.283
  226    HG   SER  30           HG       SER  30  -6.053  -4.483   9.372
  227    H    ARG  31           H        ARG  31  -5.579  -1.140   7.469
  228    HA   ARG  31           HA       ARG  31  -7.623  -0.211   5.632
  229   1HB   ARG  31          2HB       ARG  31  -8.736  -1.496   7.488
  230   2HB   ARG  31          1HB       ARG  31  -7.972  -0.407   8.672
  231   1HG   ARG  31          2HG       ARG  31  -9.281   1.506   7.746
  232   2HG   ARG  31          1HG       ARG  31 -10.023   0.430   6.507
  233   1HD   ARG  31          2HD       ARG  31 -11.232  -0.818   8.242
  234   2HD   ARG  31          1HD       ARG  31 -10.217  -0.051   9.537
  235    HE   ARG  31           HE       ARG  31 -11.911   1.695   7.717
  236   1HH1  ARG  31          1HH1      ARG  31 -11.490   0.496  11.072
  237   2HH1  ARG  31          2HH1      ARG  31 -12.201   1.877  11.747
  238   1HH2  ARG  31          1HH2      ARG  31 -12.876   3.433   8.626
  239   2HH2  ARG  31          2HH2      ARG  31 -13.005   3.633  10.336
  240    H    ILE  32           H        ILE  32  -8.113   2.107   6.072
  241    HA   ILE  32           HA       ILE  32  -5.717   3.621   6.553
  242    HB   ILE  32           HB       ILE  32  -8.548   4.146   5.604
  243   1HG1  ILE  32          2HG1      ILE  32  -7.683   4.881   3.548
  244   2HG1  ILE  32          1HG1      ILE  32  -6.001   4.817   4.025
  245   1HG2  ILE  32          1HG2      ILE  32  -6.264   6.148   6.117
  246   2HG2  ILE  32          2HG2      ILE  32  -7.973   6.193   6.770
  247   3HG2  ILE  32          3HG2      ILE  32  -7.674   6.468   5.029
  248   1HD1  ILE  32          1HD1      ILE  32  -6.144   2.259   4.015
  249   2HD1  ILE  32          2HD1      ILE  32  -6.590   3.045   2.462
  250   3HD1  ILE  32          3HD1      ILE  32  -7.899   2.417   3.536
  251    H    THR  33           H        THR  33  -5.416   5.051   8.324
  252    HA   THR  33           HA       THR  33  -7.337   5.082  10.438
  253    HB   THR  33           HB       THR  33  -4.972   6.916   9.931
  254    HG1  THR  33           1HG      THR  33  -3.927   5.699  11.243
  255   1HG2  THR  33          1HG2      THR  33  -5.226   7.443  12.386
  256   2HG2  THR  33          2HG2      THR  33  -6.679   6.372  12.457
  257   3HG2  THR  33          3HG2      THR  33  -6.746   7.894  11.530
  258    HA   PRO  34           HA       PRO  34  -9.433   8.340   8.232
  259   1HB   PRO  34          2HB       PRO  34 -11.147   9.385  10.137
  260   2HB   PRO  34          1HB       PRO  34 -11.245   7.655   9.551
  261   1HG   PRO  34          2HG       PRO  34  -9.717   8.500  12.059
  262   2HG   PRO  34          1HG       PRO  34 -11.142   7.369  11.953
  263   1HD   PRO  34          2HD       PRO  34  -8.628   6.365  11.749
  264   2HD   PRO  34          1HD       PRO  34  -9.868   5.800  10.547
  265    H    GLY  35           H        GLY  35  -9.669  10.668   8.020
  266   1HA   GLY  35          2HA       GLY  35  -8.965  12.757   8.275
  267   2HA   GLY  35          1HA       GLY  35  -7.958  12.276   9.685
  268    H    SER  36           H        SER  36  -6.756  10.133   7.961
  269    HA   SER  36           HA       SER  36  -4.473  11.539   7.129
  270   1HB   SER  36          2HB       SER  36  -4.398   9.249   8.021
  271   2HB   SER  36          1HB       SER  36  -5.490   8.683   6.732
  272    HG   SER  36           HG       SER  36  -2.872   9.702   6.309
  273    H    LYS  37           H        LYS  37  -3.447  11.446   4.972
  274    HA   LYS  37           HA       LYS  37  -5.063  12.293   2.888
  275   1HB   LYS  37          2HB       LYS  37  -2.485  12.540   3.327
  276   2HB   LYS  37          1HB       LYS  37  -2.326  10.939   2.588
  277   1HG   LYS  37          2HG       LYS  37  -1.916  12.523   0.847
  278   2HG   LYS  37          1HG       LYS  37  -3.579  11.951   0.517
  279   1HD   LYS  37          2HD       LYS  37  -3.767  14.164   2.379
  280   2HD   LYS  37          1HD       LYS  37  -2.547  14.650   1.190
  281   1HE   LYS  37          2HE       LYS  37  -5.324  13.570   0.330
  282   2HE   LYS  37          1HE       LYS  37  -5.087  15.279   0.845
  283   1HZ   LYS  37          1HZ       LYS  37  -3.676  13.981  -1.455
  284   2HZ   LYS  37          2HZ       LYS  37  -3.426  15.541  -0.882
  285   3HZ   LYS  37          3HZ       LYS  37  -4.959  15.061  -1.463
  286    H    ALA  38           H        ALA  38  -4.043   9.188   3.944
  287    HA   ALA  38           HA       ALA  38  -4.761   7.475   1.835
  288   1HB   ALA  38          1HB       ALA  38  -4.694   6.959   4.832
  289   2HB   ALA  38          2HB       ALA  38  -3.231   7.086   3.803
  290   3HB   ALA  38          3HB       ALA  38  -4.413   5.796   3.468
  291    H    ALA  39           H        ALA  39  -6.765   9.219   4.166
  292    HA   ALA  39           HA       ALA  39  -9.048   7.598   3.373
  293   1HB   ALA  39          1HB       ALA  39  -8.751   8.174   5.832
  294   2HB   ALA  39          2HB       ALA  39 -10.250   8.894   5.154
  295   3HB   ALA  39          3HB       ALA  39  -8.786   9.914   5.409
  296    H    GLN  40           H        GLN  40  -7.806  10.912   3.309
  297    HA   GLN  40           HA       GLN  40  -9.936  12.298   2.399
  298   1HB   GLN  40          2HB       GLN  40  -6.950  12.553   1.882
  299   2HB   GLN  40          1HB       GLN  40  -8.053  13.803   1.296
  300   1HG   GLN  40          2HG       GLN  40  -7.752  12.988   4.280
  301   2HG   GLN  40          1HG       GLN  40  -6.917  14.354   3.478
  302   1HE2  GLN  40          1HE2      GLN  40 -10.095  13.145   4.630
  303   2HE2  GLN  40          2HE2      GLN  40 -10.808  14.735   4.666
  304    H    SER  41           H        SER  41  -7.520  10.716   0.311
  305    HA   SER  41           HA       SER  41  -8.999  11.722  -2.016
  306   1HB   SER  41          2HB       SER  41  -6.555  12.134  -1.762
  307   2HB   SER  41          1HB       SER  41  -6.272  10.370  -1.928
  308    HG   SER  41           HG       SER  41  -6.988  12.272  -3.837
  309    H    GLN  42           H        GLN  42  -8.230   9.620  -3.831
  310    HA   GLN  42           HA       GLN  42 -10.441   7.900  -3.046
  311   1HB   GLN  42          2HB       GLN  42  -9.091   8.222  -5.745
  312   2HB   GLN  42          1HB       GLN  42 -10.610   7.343  -5.406
  313   1HG   GLN  42          2HG       GLN  42 -10.146  10.388  -5.094
  314   2HG   GLN  42          1HG       GLN  42 -11.073   9.567  -6.385
  315   1HE2  GLN  42          1HE2      GLN  42 -12.952   8.175  -5.597
  316   2HE2  GLN  42          2HE2      GLN  42 -13.873   8.764  -4.227
  317    H    LEU  43           H        LEU  43  -7.908   7.480  -1.773
  318    HA   LEU  43           HA       LEU  43  -6.985   4.933  -2.723
  319   1HB   LEU  43          2HB       LEU  43  -5.635   6.934  -1.687
  320   2HB   LEU  43          1HB       LEU  43  -6.349   6.460  -0.129
  321    HG   LEU  43           HG       LEU  43  -5.331   4.101  -0.599
  322   1HD1  LEU  43          1HD1      LEU  43  -3.938   5.750  -2.788
  323   2HD1  LEU  43          2HD1      LEU  43  -4.934   4.281  -2.982
  324   3HD1  LEU  43          3HD1      LEU  43  -3.321   4.156  -2.190
  325   1HD2  LEU  43          1HD2      LEU  43  -2.977   4.838   0.124
  326   2HD2  LEU  43          2HD2      LEU  43  -4.316   5.441   1.136
  327   3HD2  LEU  43          3HD2      LEU  43  -3.527   6.538  -0.072
  328    H    SER  44           H        SER  44  -7.714   2.979  -1.965
  329    HA   SER  44           HA       SER  44  -8.189   2.976   0.905
  330   1HB   SER  44          2HB       SER  44 -10.408   2.404  -0.175
  331   2HB   SER  44          1HB       SER  44  -9.634   0.970  -0.906
  332    HG   SER  44           HG       SER  44  -9.760   0.053   1.016
  333    H    GLN  45           H        GLN  45  -5.765   2.834   0.798
  334    HA   GLN  45           HA       GLN  45  -4.555   0.613  -0.397
  335   1HB   GLN  45          2HB       GLN  45  -3.459   2.759  -0.110
  336   2HB   GLN  45          1HB       GLN  45  -3.888   2.800   1.660
  337   1HG   GLN  45          2HG       GLN  45  -2.251   1.363   2.284
  338   2HG   GLN  45          1HG       GLN  45  -2.365   0.474   0.719
  339   1HE2  GLN  45          2HE2      GLN  45  -1.326   3.813   1.799
  340   2HE2  GLN  45          1HE2      GLN  45   0.279   3.685   1.096
  341    H    GLY  46           H        GLY  46  -5.225  -1.326   0.291
  342   1HA   GLY  46          2HA       GLY  46  -5.146  -2.302   2.890
  343   2HA   GLY  46          1HA       GLY  46  -6.719  -1.491   2.636
  344    H    ASP  47           H        ASP  47  -4.601  -3.470   0.503
  345    HA   ASP  47           HA       ASP  47  -6.402  -5.645   0.571
  346   1HB   ASP  47          2HB       ASP  47  -7.318  -3.879  -1.227
  347   2HB   ASP  47          1HB       ASP  47  -5.946  -4.407  -2.234
  348    H    LEU  48           H        LEU  48  -5.233  -6.860  -1.893
  349    HA   LEU  48           HA       LEU  48  -2.583  -7.377  -0.884
  350   1HB   LEU  48          2HB       LEU  48  -3.955  -8.452  -3.395
  351   2HB   LEU  48          1HB       LEU  48  -2.356  -8.905  -2.759
  352    HG   LEU  48           HG       LEU  48  -3.568 -10.681  -1.989
  353   1HD1  LEU  48          1HD1      LEU  48  -4.161 -10.543   0.385
  354   2HD1  LEU  48          2HD1      LEU  48  -4.304  -8.749   0.320
  355   3HD1  LEU  48          3HD1      LEU  48  -2.690  -9.534   0.044
  356   1HD2  LEU  48          1HD2      LEU  48  -5.758  -9.645  -2.935
  357   2HD2  LEU  48          2HD2      LEU  48  -5.873  -8.771  -1.340
  358   3HD2  LEU  48          3HD2      LEU  48  -5.965 -10.592  -1.363
  359    H    VAL  49           H        VAL  49  -0.986  -6.050  -1.408
  360    HA   VAL  49           HA       VAL  49  -1.311  -4.128  -3.492
  361    HB   VAL  49           HB       VAL  49   1.013  -4.794  -1.650
  362   1HG1  VAL  49          1HG1      VAL  49   1.700  -2.435  -2.157
  363   2HG1  VAL  49          2HG1      VAL  49   0.415  -2.328  -3.422
  364   3HG1  VAL  49          3HG1      VAL  49   1.798  -3.489  -3.621
  365   1HG2  VAL  49          1HG2      VAL  49  -1.274  -2.722  -1.448
  366   2HG2  VAL  49          2HG2      VAL  49   0.172  -2.799  -0.379
  367   3HG2  VAL  49          3HG2      VAL  49  -1.018  -4.143  -0.359
  368    H    VAL  50           H        VAL  50  -0.296  -4.202  -5.542
  369    HA   VAL  50           HA       VAL  50   1.013  -6.707  -6.244
  370    HB   VAL  50           HB       VAL  50   0.382  -4.494  -8.216
  371   1HG1  VAL  50          1HG1      VAL  50   1.883  -6.437  -8.857
  372   2HG1  VAL  50          2HG1      VAL  50   0.307  -6.465  -9.729
  373   3HG1  VAL  50          3HG1      VAL  50   0.585  -7.579  -8.338
  374   1HG2  VAL  50          1HG2      VAL  50  -1.737  -4.736  -7.188
  375   2HG2  VAL  50          2HG2      VAL  50  -1.563  -6.540  -7.008
  376   3HG2  VAL  50          3HG2      VAL  50  -1.760  -5.794  -8.642
  377    H    ALA  51           H        ALA  51   1.378  -3.202  -6.730
  378    HA   ALA  51           HA       ALA  51   4.278  -3.492  -6.604
  379   1HB   ALA  51          1HB       ALA  51   4.527  -1.985  -8.599
  380   2HB   ALA  51          2HB       ALA  51   2.743  -1.952  -8.788
  381   3HB   ALA  51          3HB       ALA  51   3.647  -3.492  -9.034
  382    H    ILE  52           H        ILE  52   5.450  -1.756  -5.977
  383    HA   ILE  52           HA       ILE  52   3.990   0.574  -4.987
  384    HB   ILE  52           HB       ILE  52   4.727  -1.300  -3.376
  385   1HG1  ILE  52          2HG1      ILE  52   3.664   0.809  -2.696
  386   2HG1  ILE  52          1HG1      ILE  52   4.895   0.247  -1.546
  387   1HG2  ILE  52          1HG2      ILE  52   7.070  -1.485  -4.079
  388   2HG2  ILE  52          2HG2      ILE  52   6.936  -1.015  -2.338
  389   3HG2  ILE  52          3HG2      ILE  52   7.376   0.220  -3.580
  390   1HD1  ILE  52          1HD1      ILE  52   5.221   2.584  -3.546
  391   2HD1  ILE  52          2HD1      ILE  52   6.538   1.954  -2.483
  392   3HD1  ILE  52          3HD1      ILE  52   5.069   2.683  -1.763
  393    H    ASP  53           H        ASP  53   4.809   2.399  -5.796
  394    HA   ASP  53           HA       ASP  53   5.973   3.748  -7.028
  395   1HB   ASP  53          2HB       ASP  53   7.421   3.444  -5.010
  396   2HB   ASP  53          1HB       ASP  53   8.388   2.239  -5.920
  397    H    GLY  54           H        GLY  54   5.149   1.106  -8.181
  398   1HA   GLY  54          2HA       GLY  54   5.092   0.411 -10.292
  399   2HA   GLY  54          1HA       GLY  54   6.604   1.294 -10.672
  400    H    VAL  55           H        VAL  55   6.959  -0.636  -7.811
  401    HA   VAL  55           HA       VAL  55   8.167  -2.710  -9.507
  402    HB   VAL  55           HB       VAL  55   9.154  -1.707  -6.830
  403   1HG1  VAL  55          1HG1      VAL  55   9.582  -4.156  -7.120
  404   2HG1  VAL  55          2HG1      VAL  55  11.100  -3.243  -7.400
  405   3HG1  VAL  55          3HG1      VAL  55  10.161  -3.876  -8.801
  406   1HG2  VAL  55          1HG2      VAL  55   9.631  -0.068  -8.643
  407   2HG2  VAL  55          2HG2      VAL  55  10.209  -1.393  -9.725
  408   3HG2  VAL  55          3HG2      VAL  55  11.130  -0.969  -8.238
  409    H    ASN  56           H        ASN  56   7.618  -4.796  -9.143
  410    HA   ASN  56           HA       ASN  56   5.305  -5.115  -7.579
  411   1HB   ASN  56          2HB       ASN  56   5.119  -7.297  -8.624
  412   2HB   ASN  56          1HB       ASN  56   5.523  -6.021  -9.830
  413   1HD2  ASN  56          1HD2      ASN  56   6.251  -9.140  -8.991
  414   2HD2  ASN  56          2HD2      ASN  56   7.705  -9.247  -9.932
  415    H    THR  57           H        THR  57   4.824  -6.569  -6.008
  416    HA   THR  57           HA       THR  57   6.948  -6.746  -4.079
  417    HB   THR  57           HB       THR  57   5.126  -6.982  -2.446
  418    HG1  THR  57           1HG      THR  57   3.477  -6.434  -4.686
  419   1HG2  THR  57          1HG2      THR  57   4.257  -4.660  -2.751
  420   2HG2  THR  57          2HG2      THR  57   4.822  -4.625  -4.452
  421   3HG2  THR  57          3HG2      THR  57   6.024  -4.718  -3.116
  422    H    ASP  58           H        ASP  58   7.498  -8.624  -5.747
  423    HA   ASP  58           HA       ASP  58   6.481 -11.167  -5.062
  424   1HB   ASP  58          2HB       ASP  58   7.592 -10.431  -7.235
  425   2HB   ASP  58          1HB       ASP  58   9.159 -10.392  -6.367
  426    H    THR  59           H        THR  59   9.438  -9.372  -4.116
  427    HA   THR  59           HA       THR  59   9.798 -11.319  -1.949
  428    HB   THR  59           HB       THR  59  11.477 -11.595  -3.574
  429    HG1  THR  59           1HG      THR  59  13.074 -11.576  -2.269
  430   1HG2  THR  59          1HG2      THR  59  12.129  -8.602  -3.172
  431   2HG2  THR  59          2HG2      THR  59  11.559  -9.407  -4.688
  432   3HG2  THR  59          3HG2      THR  59  13.175  -9.796  -4.022
  433    H    MET  60           H        MET  60   9.584  -7.828  -2.693
  434    HA   MET  60           HA       MET  60  10.237  -6.575  -0.568
  435   1HB   MET  60          2HB       MET  60   8.954  -6.127  -2.828
  436   2HB   MET  60          1HB       MET  60   7.481  -6.441  -1.905
  437   1HG   MET  60          2HG       MET  60   7.724  -4.090  -1.919
  438   2HG   MET  60          1HG       MET  60   8.289  -4.584  -0.283
  439   1HE   MET  60          1HE       MET  60   9.957  -4.566  -3.993
  440   2HE   MET  60          2HE       MET  60  10.807  -2.994  -3.895
  441   3HE   MET  60          3HE       MET  60   9.020  -3.049  -3.758
  442    H    THR  61           H        THR  61   9.888  -6.704   1.609
  443    HA   THR  61           HA       THR  61   7.735  -8.402   2.500
  444    HB   THR  61           HB       THR  61   8.846  -8.507   4.613
  445    HG1  THR  61           1HG      THR  61  10.854  -7.498   4.768
  446   1HG2  THR  61          1HG2      THR  61   9.542  -9.956   2.647
  447   2HG2  THR  61          2HG2      THR  61  10.903  -9.610   3.783
  448   3HG2  THR  61          3HG2      THR  61  10.783  -8.736   2.213
  449    H    HIS  62           H        HIS  62   6.935  -7.820   4.801
  450    HA   HIS  62           HA       HIS  62   5.197  -5.724   4.793
  451   1HB   HIS  62          2HB       HIS  62   5.027  -7.716   6.228
  452   2HB   HIS  62          1HB       HIS  62   6.552  -7.299   7.042
  453    HD1  HIS  62           1HD      HIS  62   2.880  -6.424   7.039
  454    HD2  HIS  62           2HD      HIS  62   6.373  -5.490   9.159
  455    HE1  HIS  62           1HE      HIS  62   2.191  -5.324   9.256
  456    H    LEU  63           H        LEU  63   8.440  -5.866   6.321
  457    HA   LEU  63           HA       LEU  63   8.486  -3.180   7.165
  458   1HB   LEU  63          2HB       LEU  63   9.908  -5.030   8.074
  459   2HB   LEU  63          1HB       LEU  63  10.701  -5.185   6.483
  460    HG   LEU  63           HG       LEU  63  11.529  -2.802   6.711
  461   1HD1  LEU  63          1HD1      LEU  63   9.883  -1.936   8.431
  462   2HD1  LEU  63          2HD1      LEU  63  11.580  -1.798   9.019
  463   3HD1  LEU  63          3HD1      LEU  63  10.528  -3.125   9.627
  464   1HD2  LEU  63          1HD2      LEU  63  12.932  -4.783   7.188
  465   2HD2  LEU  63          2HD2      LEU  63  12.366  -4.786   8.906
  466   3HD2  LEU  63          3HD2      LEU  63  13.355  -3.407   8.277
  467    H    GLU  64           H        GLU  64   9.797  -4.760   4.207
  468    HA   GLU  64           HA       GLU  64  11.160  -2.544   3.336
  469   1HB   GLU  64          2HB       GLU  64  10.734  -5.193   2.508
  470   2HB   GLU  64          1HB       GLU  64  10.145  -4.254   1.107
  471   1HG   GLU  64          2HG       GLU  64  12.346  -3.057   0.990
  472   2HG   GLU  64          1HG       GLU  64  12.902  -3.942   2.458
  473    H    ALA  65           H        ALA  65   7.877  -3.582   2.259
  474    HA   ALA  65           HA       ALA  65   7.584  -1.379   0.543
  475   1HB   ALA  65          1HB       ALA  65   6.380  -3.511   0.308
  476   2HB   ALA  65          2HB       ALA  65   5.186  -2.166   0.470
  477   3HB   ALA  65          3HB       ALA  65   5.548  -3.241   1.883
  478    H    GLN  66           H        GLN  66   6.805  -1.801   3.951
  479    HA   GLN  66           HA       GLN  66   5.326   0.534   4.343
  480   1HB   GLN  66          2HB       GLN  66   5.239  -1.082   6.011
  481   2HB   GLN  66          1HB       GLN  66   6.978  -1.418   5.935
  482   1HG   GLN  66          2HG       GLN  66   7.630   0.373   7.267
  483   2HG   GLN  66          1HG       GLN  66   6.025   1.219   7.168
  484   1HE2  GLN  66          1HE2      GLN  66   4.130  -0.132   8.044
  485   2HE2  GLN  66          2HE2      GLN  66   4.432  -1.147   9.428
  486    H    ASN  67           H        ASN  67   8.816  -0.102   4.399
  487    HA   ASN  67           HA       ASN  67   9.548   2.593   4.815
  488   1HB   ASN  67          2HB       ASN  67  10.921  -0.024   4.086
  489   2HB   ASN  67          1HB       ASN  67  11.833   1.481   3.784
  490   1HD2  ASN  67          1HD2      ASN  67  10.527  -0.629   6.281
  491   2HD2  ASN  67          2HD2      ASN  67  11.235   0.257   7.621
  492    H    LYS  68           H        LYS  68   8.995   0.750   1.791
  493    HA   LYS  68           HA       LYS  68   9.964   2.751   0.147
  494   1HB   LYS  68          2HB       LYS  68   7.716   0.796  -0.482
  495   2HB   LYS  68          1HB       LYS  68   8.643   1.770  -1.666
  496   1HG   LYS  68          2HG       LYS  68   9.769  -0.527   0.032
  497   2HG   LYS  68          1HG       LYS  68   9.328  -0.560  -1.674
  498   1HD   LYS  68          2HD       LYS  68  11.108   0.971  -2.288
  499   2HD   LYS  68          1HD       LYS  68  11.509   1.314  -0.570
  500   1HE   LYS  68          2HE       LYS  68  12.243  -0.977  -0.156
  501   2HE   LYS  68          1HE       LYS  68  11.626  -1.513  -1.771
  502   1HZ   LYS  68          1HZ       LYS  68  13.285  -0.351  -2.872
  503   2HZ   LYS  68          2HZ       LYS  68  14.045  -1.158  -1.603
  504   3HZ   LYS  68          3HZ       LYS  68  13.786   0.517  -1.505
  505    H    ILE  69           H        ILE  69   6.437   2.277   1.067
  506    HA   ILE  69           HA       ILE  69   5.512   4.581   0.113
  507    HB   ILE  69           HB       ILE  69   4.883   3.047   2.638
  508   1HG1  ILE  69          2HG1      ILE  69   3.389   3.421  -0.012
  509   2HG1  ILE  69          1HG1      ILE  69   4.373   2.006   0.289
  510   1HG2  ILE  69          1HG2      ILE  69   4.044   5.213   3.188
  511   2HG2  ILE  69          2HG2      ILE  69   2.629   4.500   2.326
  512   3HG2  ILE  69          3HG2      ILE  69   3.706   5.635   1.469
  513   1HD1  ILE  69          1HD1      ILE  69   3.009   1.344   2.279
  514   2HD1  ILE  69          2HD1      ILE  69   2.119   1.347   0.716
  515   3HD1  ILE  69          3HD1      ILE  69   1.846   2.670   1.896
  516    H    LYS  70           H        LYS  70   7.088   4.285   3.355
  517    HA   LYS  70           HA       LYS  70   6.694   7.019   3.866
  518   1HB   LYS  70          2HB       LYS  70   7.965   4.669   5.183
  519   2HB   LYS  70          1HB       LYS  70   8.666   6.241   5.632
  520   1HG   LYS  70          2HG       LYS  70   7.002   5.775   7.221
  521   2HG   LYS  70          1HG       LYS  70   6.468   7.154   6.210
  522   1HD   LYS  70          2HD       LYS  70   5.056   5.393   4.877
  523   2HD   LYS  70          1HD       LYS  70   5.399   4.269   6.226
  524   1HE   LYS  70          2HE       LYS  70   3.917   6.983   6.317
  525   2HE   LYS  70          1HE       LYS  70   3.204   5.345   6.576
  526   1HZ   LYS  70          1HZ       LYS  70   3.648   6.601   8.645
  527   2HZ   LYS  70          2HZ       LYS  70   5.264   6.644   8.307
  528   3HZ   LYS  70          3HZ       LYS  70   4.536   5.151   8.595
  529    H    SER  71           H        SER  71   8.834   5.802   1.619
  530    HA   SER  71           HA       SER  71  10.882   7.804   2.281
  531   1HB   SER  71          2HB       SER  71  11.004   5.465   0.309
  532   2HB   SER  71          1HB       SER  71  12.332   6.624   0.670
  533    HG   SER  71           HG       SER  71  11.107   4.750   2.383
  534    H    ALA  72           H        ALA  72   8.093   7.503   0.542
  535    HA   ALA  72           HA       ALA  72   8.970   9.187  -1.684
  536   1HB   ALA  72          1HB       ALA  72   7.723   7.060  -2.191
  537   2HB   ALA  72          2HB       ALA  72   6.715   8.483  -2.645
  538   3HB   ALA  72          3HB       ALA  72   6.413   7.593  -1.095
  539    H    SER  73           H        SER  73   7.574  11.038  -2.210
  540    HA   SER  73           HA       SER  73   5.816  11.973  -0.119
  541   1HB   SER  73          2HB       SER  73   6.861  14.208   0.050
  542   2HB   SER  73          1HB       SER  73   7.835  12.898   0.780
  543    HG   SER  73           HG       SER  73   9.059  14.370  -0.550
  544    H    TYR  74           H        TYR  74   7.538  13.407  -2.839
  545    HA   TYR  74           HA       TYR  74   5.481  14.909  -3.771
  546   1HB   TYR  74          2HB       TYR  74   8.166  14.442  -4.335
  547   2HB   TYR  74          1HB       TYR  74   7.434  13.880  -5.858
  548    HD1  TYR  74           1HD      TYR  74   5.083  16.039  -5.777
  549    HD2  TYR  74           2HD      TYR  74   9.309  16.148  -5.275
  550    HE1  TYR  74           1HE      TYR  74   5.121  18.316  -6.610
  551    HE2  TYR  74           2HE      TYR  74   9.357  18.418  -6.164
  552    HH   TYR  74           HH       TYR  74   8.158  20.120  -6.979
  553    H    ASN  75           H        ASN  75   6.443  11.686  -4.850
  554    HA   ASN  75           HA       ASN  75   3.714  11.248  -5.819
  555   1HB   ASN  75          2HB       ASN  75   5.068  11.773  -7.775
  556   2HB   ASN  75          1HB       ASN  75   6.316  10.546  -7.261
  557   1HD2  ASN  75          1HD2      ASN  75   5.237   8.181  -7.015
  558   2HD2  ASN  75          2HD2      ASN  75   4.184   7.757  -8.329
  559    H    LEU  76           H        LEU  76   2.942   9.773  -4.758
  560    HA   LEU  76           HA       LEU  76   4.514   7.347  -4.096
  561   1HB   LEU  76          2HB       LEU  76   3.921   8.435  -1.980
  562   2HB   LEU  76          1HB       LEU  76   2.219   8.535  -2.464
  563    HG   LEU  76           HG       LEU  76   2.117   5.979  -2.506
  564   1HD1  LEU  76          1HD1      LEU  76   4.938   6.164  -1.283
  565   2HD1  LEU  76          2HD1      LEU  76   4.589   5.546  -2.952
  566   3HD1  LEU  76          3HD1      LEU  76   3.954   4.676  -1.517
  567   1HD2  LEU  76          1HD2      LEU  76   2.190   5.648  -0.073
  568   2HD2  LEU  76          2HD2      LEU  76   1.411   7.235  -0.472
  569   3HD2  LEU  76          3HD2      LEU  76   3.107   7.182   0.140
  570    H    SER  77           H        SER  77   4.006   6.160  -5.925
  571    HA   SER  77           HA       SER  77   1.170   5.901  -6.613
  572   1HB   SER  77          2HB       SER  77   3.644   4.942  -8.118
  573   2HB   SER  77          1HB       SER  77   1.948   4.662  -8.632
  574    HG   SER  77           HG       SER  77   1.707   6.943  -8.735
  575    H    LEU  78           H        LEU  78   0.023   4.229  -5.915
  576    HA   LEU  78           HA       LEU  78   1.425   1.774  -5.144
  577   1HB   LEU  78          2HB       LEU  78  -1.354   2.696  -4.254
  578   2HB   LEU  78          1HB       LEU  78  -0.356   1.375  -3.586
  579    HG   LEU  78           HG       LEU  78  -0.367   3.055  -1.981
  580   1HD1  LEU  78          1HD1      LEU  78   1.922   3.705  -1.641
  581   2HD1  LEU  78          2HD1      LEU  78   2.330   3.477  -3.385
  582   3HD1  LEU  78          3HD1      LEU  78   1.868   2.057  -2.367
  583   1HD2  LEU  78          1HD2      LEU  78  -0.026   5.387  -2.166
  584   2HD2  LEU  78          2HD2      LEU  78  -1.294   4.895  -3.347
  585   3HD2  LEU  78          3HD2      LEU  78   0.370   5.278  -3.919
  586    H    THR  79           H        THR  79   0.623  -0.200  -6.013
  587    HA   THR  79           HA       THR  79  -1.883  -0.059  -7.500
  588    HB   THR  79           HB       THR  79   0.598  -1.664  -8.265
  589    HG1  THR  79           1HG      THR  79   0.618  -0.353 -10.038
  590   1HG2  THR  79          1HG2      THR  79  -2.217  -1.326  -9.502
  591   2HG2  THR  79          2HG2      THR  79  -1.506  -2.846  -8.825
  592   3HG2  THR  79          3HG2      THR  79  -0.825  -2.138 -10.333
  593    H    LEU  80           H        LEU  80  -3.275  -1.321  -6.191
  594    HA   LEU  80           HA       LEU  80  -2.356  -3.949  -5.335
  595   1HB   LEU  80          2HB       LEU  80  -3.534  -3.753  -3.292
  596   2HB   LEU  80          1HB       LEU  80  -2.351  -2.393  -3.418
  597    HG   LEU  80           HG       LEU  80  -5.331  -2.330  -3.954
  598   1HD1  LEU  80          1HD1      LEU  80  -4.627  -2.721  -1.581
  599   2HD1  LEU  80          2HD1      LEU  80  -5.523  -1.131  -1.825
  600   3HD1  LEU  80          3HD1      LEU  80  -3.690  -1.151  -1.637
  601   1HD2  LEU  80          1HD2      LEU  80  -3.017  -0.343  -4.038
  602   2HD2  LEU  80          2HD2      LEU  80  -4.660   0.339  -3.561
  603   3HD2  LEU  80          3HD2      LEU  80  -4.423  -0.454  -5.193
  604    H    GLN  81           H        GLN  81  -4.350  -5.396  -4.893
  605    HA   GLN  81           HA       GLN  81  -5.962  -5.234  -7.218
  606   1HB   GLN  81          2HB       GLN  81  -6.159  -7.140  -4.890
  607   2HB   GLN  81          1HB       GLN  81  -6.893  -7.342  -6.519
  608   1HG   GLN  81          2HG       GLN  81  -3.849  -7.226  -6.002
  609   2HG   GLN  81          1HG       GLN  81  -4.819  -8.720  -5.971
  610   1HE2  GLN  81          1HE2      GLN  81  -2.678  -8.440  -7.663
  611   2HE2  GLN  81          2HE2      GLN  81  -3.189  -8.315  -9.314
  612    H    LYS  82           H        LYS  82  -8.271  -5.005  -7.410
  613    HA   LYS  82           HA       LYS  82  -9.620  -3.687  -5.321
  614   1HB   LYS  82          2HB       LYS  82 -10.462  -4.970  -7.960
  615   2HB   LYS  82          1HB       LYS  82 -11.620  -4.142  -6.891
  616   1HG   LYS  82          2HG       LYS  82  -9.159  -2.859  -8.208
  617   2HG   LYS  82          1HG       LYS  82 -10.856  -2.684  -8.746
  618   1HD   LYS  82          2HD       LYS  82  -9.728  -1.821  -6.032
  619   2HD   LYS  82          1HD       LYS  82  -9.988  -0.734  -7.428
  620   1HE   LYS  82          2HE       LYS  82 -12.436  -1.121  -7.401
  621   2HE   LYS  82          1HE       LYS  82 -12.272  -2.264  -6.014
  622   1HZ   LYS  82          1HZ       LYS  82 -11.843  -0.580  -4.571
  623   2HZ   LYS  82          2HZ       LYS  82 -12.937   0.124  -5.584
  624   3HZ   LYS  82          3HZ       LYS  82 -11.327   0.553  -5.744
  625    H    SER  83           H        SER  83  -9.341  -5.049  -3.569
  626    HA   SER  83           HA       SER  83 -10.487  -5.730  -1.949
  627   1HB   SER  83          2HB       SER  83 -12.728  -5.103  -1.723
  628   2HB   SER  83          1HB       SER  83 -11.895  -3.969  -2.817
  629    HG   SER  83           HG       SER  83 -13.826  -4.475  -3.717
  630    H    LYS  84           H        LYS  84 -12.433  -6.987  -0.968
  631    HA   LYS  84           HA       LYS  84 -12.344  -9.723  -1.877
  632   1HB   LYS  84          2HB       LYS  84 -13.561  -8.216   0.435
  633   2HB   LYS  84          1HB       LYS  84 -14.392  -9.701  -0.118
  634   1HG   LYS  84          2HG       LYS  84 -12.877 -10.180   1.746
  635   2HG   LYS  84          1HG       LYS  84 -12.463 -11.081   0.260
  636   1HD   LYS  84          2HD       LYS  84 -10.650  -9.477  -0.233
  637   2HD   LYS  84          1HD       LYS  84 -10.991  -8.567   1.272
  638   1HE   LYS  84          2HE       LYS  84 -10.269 -10.496   2.658
  639   2HE   LYS  84          1HE       LYS  84 -10.251 -11.566   1.206
  640   1HZ   LYS  84          1HZ       LYS  84  -8.592  -9.777   0.349
  641   2HZ   LYS  84          2HZ       LYS  84  -8.063 -11.026   1.344
  642   3HZ   LYS  84          3HZ       LYS  84  -8.310  -9.463   1.960
  643    H    ARG  85           H        ARG  85 -13.153  -9.859  -3.888
  644    HA   ARG  85           HA       ARG  85 -15.940  -9.082  -4.216
  645   1HB   ARG  85          2HB       ARG  85 -14.018  -7.547  -5.225
  646   2HB   ARG  85          1HB       ARG  85 -13.741  -8.886  -6.353
  647   1HG   ARG  85          2HG       ARG  85 -15.054  -7.247  -7.459
  648   2HG   ARG  85          1HG       ARG  85 -16.170  -8.599  -7.162
  649   1HD   ARG  85          2HD       ARG  85 -16.010  -6.266  -5.145
  650   2HD   ARG  85          1HD       ARG  85 -16.818  -6.005  -6.728
  651    HE   ARG  85           HE       ARG  85 -18.347  -7.864  -6.273
  652   1HH1  ARG  85          1HH1      ARG  85 -16.616  -6.987  -3.252
  653   2HH1  ARG  85          2HH1      ARG  85 -18.115  -6.991  -2.356
  654   1HH2  ARG  85          1HH2      ARG  85 -20.219  -7.911  -4.896
  655   2HH2  ARG  85          2HH2      ARG  85 -19.982  -7.624  -3.189
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1  -9.038  -8.201 -12.450
    2   2H    MET   1          2HT       MET   1  -8.836  -8.276 -10.762
    3   3H    MET   1          3HT       MET   1  -7.559  -7.800 -11.734
    4    HA   MET   1           HA       MET   1  -8.726  -5.863 -12.438
    5   1HB   MET   1          2HB       MET   1 -10.857  -5.174 -11.355
    6   2HB   MET   1          1HB       MET   1 -10.965  -6.573 -12.443
    7   1HG   MET   1          2HG       MET   1 -10.983  -8.129 -10.490
    8   2HG   MET   1          1HG       MET   1 -10.947  -6.742  -9.373
    9   1HE   MET   1          1HE       MET   1 -12.730  -4.569 -10.251
   10   2HE   MET   1          2HE       MET   1 -13.020  -5.362  -8.661
   11   3HE   MET   1          3HE       MET   1 -14.391  -5.046  -9.780
   12    H    ALA   2           H        ALA   2  -7.260  -4.470 -11.715
   13    HA   ALA   2           HA       ALA   2  -7.204  -3.936  -8.828
   14   1HB   ALA   2          1HB       ALA   2  -5.211  -5.195  -9.348
   15   2HB   ALA   2          2HB       ALA   2  -4.701  -3.485  -9.195
   16   3HB   ALA   2          3HB       ALA   2  -4.897  -4.211 -10.836
   17    H    TYR   3           H        TYR   3  -5.919  -1.828  -8.428
   18    HA   TYR   3           HA       TYR   3  -6.513   0.119 -10.458
   19   1HB   TYR   3          2HB       TYR   3  -7.642   1.685  -9.257
   20   2HB   TYR   3          1HB       TYR   3  -8.567   0.167  -9.032
   21    HD1  TYR   3           1HD      TYR   3  -8.076   2.945  -7.594
   22    HD2  TYR   3           2HD      TYR   3  -7.036  -1.085  -6.683
   23    HE1  TYR   3           1HE      TYR   3  -8.173   3.460  -5.199
   24    HE2  TYR   3           2HE      TYR   3  -7.152  -0.589  -4.323
   25    HH   TYR   3           HH       TYR   3  -7.469   1.049  -2.727
   26    H    SER   4           H        SER   4  -5.454   2.163 -10.164
   27    HA   SER   4           HA       SER   4  -3.100   1.949  -8.442
   28   1HB   SER   4          2HB       SER   4  -3.107   2.916 -11.353
   29   2HB   SER   4          1HB       SER   4  -1.683   2.917 -10.253
   30    HG   SER   4           HG       SER   4  -1.643   0.729 -10.341
   31    H    VAL   5           H        VAL   5  -2.560   3.882  -7.451
   32    HA   VAL   5           HA       VAL   5  -3.530   6.306  -8.649
   33    HB   VAL   5           HB       VAL   5  -5.384   6.143  -7.375
   34   1HG1  VAL   5          1HG1      VAL   5  -5.446   5.566  -4.970
   35   2HG1  VAL   5          2HG1      VAL   5  -3.750   4.935  -5.118
   36   3HG1  VAL   5          3HG1      VAL   5  -5.103   4.211  -6.095
   37   1HG2  VAL   5          1HG2      VAL   5  -5.240   7.911  -5.733
   38   2HG2  VAL   5          2HG2      VAL   5  -4.135   8.324  -7.089
   39   3HG2  VAL   5          3HG2      VAL   5  -3.468   7.697  -5.533
   40    H    THR   6           H        THR   6  -1.927   7.590  -8.859
   41    HA   THR   6           HA       THR   6   0.358   7.476  -7.149
   42    HB   THR   6           HB       THR   6  -0.312   9.660  -9.136
   43    HG1  THR   6           1HG      THR   6  -0.281   7.664 -10.137
   44   1HG2  THR   6          1HG2      THR   6   1.589  10.137  -7.486
   45   2HG2  THR   6          2HG2      THR   6   2.198   9.882  -9.149
   46   3HG2  THR   6          3HG2      THR   6   2.349   8.564  -7.950
   47    H    LEU   7           H        LEU   7   0.392   8.423  -5.153
   48    HA   LEU   7           HA       LEU   7  -1.440  10.636  -4.618
   49   1HB   LEU   7          2HB       LEU   7  -1.279   8.469  -3.245
   50   2HB   LEU   7          1HB       LEU   7   0.354   8.977  -2.755
   51    HG   LEU   7           HG       LEU   7  -0.622  10.996  -1.633
   52   1HD1  LEU   7          1HD1      LEU   7  -3.143  11.042  -1.255
   53   2HD1  LEU   7          2HD1      LEU   7  -3.327   9.757  -2.500
   54   3HD1  LEU   7          3HD1      LEU   7  -2.700  11.380  -2.969
   55   1HD2  LEU   7          1HD2      LEU   7  -1.715   9.717   0.233
   56   2HD2  LEU   7          2HD2      LEU   7  -0.258   8.856  -0.394
   57   3HD2  LEU   7          3HD2      LEU   7  -1.903   8.290  -0.859
   58    H    THR   8           H        THR   8  -0.579  12.677  -3.744
   59    HA   THR   8           HA       THR   8   2.329  12.828  -3.886
   60    HB   THR   8           HB       THR   8   1.251  13.839  -5.896
   61    HG1  THR   8           1HG      THR   8   3.268  14.310  -5.548
   62   1HG2  THR   8          1HG2      THR   8   0.612  16.106  -3.876
   63   2HG2  THR   8          2HG2      THR   8  -0.596  15.112  -4.791
   64   3HG2  THR   8          3HG2      THR   8   0.533  16.199  -5.665
   65    H    GLY   9           H        GLY   9   3.076  14.894  -2.957
   66   1HA   GLY   9          2HA       GLY   9   3.508  14.282  -0.514
   67   2HA   GLY   9          1HA       GLY   9   3.692  15.936  -1.120
   68    HA   PRO  10           HA       PRO  10   1.570  17.445   1.991
   69   1HB   PRO  10          2HB       PRO  10  -0.800  18.519   0.401
   70   2HB   PRO  10          1HB       PRO  10   0.247  19.402   1.581
   71   1HG   PRO  10          2HG       PRO  10   0.695  19.710  -1.100
   72   2HG   PRO  10          1HG       PRO  10   2.111  19.425   0.004
   73   1HD   PRO  10          2HD       PRO  10   0.640  17.362  -1.742
   74   2HD   PRO  10          1HD       PRO  10   2.425  17.636  -1.522
   75    H    GLY  11           H        GLY  11   0.903  16.062   3.476
   76   1HA   GLY  11          2HA       GLY  11  -0.983  15.618   4.886
   77   2HA   GLY  11          1HA       GLY  11  -1.892  15.125   3.434
   78    HA   PRO  12           HA       PRO  12   1.304  11.845   4.326
   79   1HB   PRO  12          2HB       PRO  12   1.464  10.879   6.906
   80   2HB   PRO  12          1HB       PRO  12   2.283  12.395   6.378
   81   1HG   PRO  12          2HG       PRO  12  -0.458  12.161   7.750
   82   2HG   PRO  12          1HG       PRO  12   0.953  13.187   8.257
   83   1HD   PRO  12          2HD       PRO  12  -1.119  14.160   6.666
   84   2HD   PRO  12          1HD       PRO  12   0.608  14.694   6.406
   85    H    TRP  13           H        TRP  13   1.261   9.459   4.917
   86    HA   TRP  13           HA       TRP  13  -1.465   8.508   4.436
   87   1HB   TRP  13          2HB       TRP  13   0.337   6.533   3.537
   88   2HB   TRP  13          1HB       TRP  13  -0.688   7.475   2.563
   89    HD1  TRP  13           HD       TRP  13   2.781   6.630   3.324
   90    HE1  TRP  13           1HE      TRP  13   4.396   7.895   1.716
   91    HE3  TRP  13           3HE      TRP  13  -0.265  10.451   2.008
   92    HZ2  TRP  13           2HZ      TRP  13   4.376  10.276   0.265
   93    HZ3  TRP  13           3HZ      TRP  13   0.643  12.276   0.662
   94    HH2  TRP  13           HH       TRP  13   2.929  12.192  -0.194
   95    H    GLY  14           H        GLY  14  -2.255   7.696   6.320
   96   1HA   GLY  14          2HA       GLY  14  -0.474   5.993   7.918
   97   2HA   GLY  14          1HA       GLY  14  -1.923   6.901   8.443
   98    H    PHE  15           H        PHE  15  -0.920   4.343   6.210
   99    HA   PHE  15           HA       PHE  15  -3.381   2.853   6.681
  100   1HB   PHE  15          2HB       PHE  15  -2.703   1.669   4.527
  101   2HB   PHE  15          1HB       PHE  15  -2.786   3.420   4.348
  102    HD1  PHE  15           1HD      PHE  15  -0.852   4.783   4.242
  103    HD2  PHE  15           2HD      PHE  15  -0.384   0.550   4.552
  104    HE1  PHE  15           1HE      PHE  15   1.589   5.005   4.023
  105    HE2  PHE  15           2HE      PHE  15   1.961   0.794   4.006
  106    HZ   PHE  15           HZ       PHE  15   2.993   2.987   3.933
  107    H    ARG  16           H        ARG  16  -3.346   0.519   6.999
  108    HA   ARG  16           HA       ARG  16  -1.326   0.092   9.002
  109   1HB   ARG  16          2HB       ARG  16  -3.940   0.155   9.448
  110   2HB   ARG  16          1HB       ARG  16  -3.943  -1.479   8.725
  111   1HG   ARG  16          2HG       ARG  16  -3.883  -1.649  11.105
  112   2HG   ARG  16          1HG       ARG  16  -2.336  -2.270  10.447
  113   1HD   ARG  16          2HD       ARG  16  -1.174  -0.110  11.121
  114   2HD   ARG  16          1HD       ARG  16  -2.763   0.554  11.636
  115    HE   ARG  16           HE       ARG  16  -2.580  -0.753  13.627
  116   1HH1  ARG  16          1HH1      ARG  16   0.022  -1.961  11.421
  117   2HH1  ARG  16          2HH1      ARG  16   0.368  -3.274  12.486
  118   1HH2  ARG  16          1HH2      ARG  16  -1.597  -1.970  15.090
  119   2HH2  ARG  16          2HH2      ARG  16  -0.276  -3.011  14.684
  120    H    LEU  17           H        LEU  17   0.197  -1.498   8.703
  121    HA   LEU  17           HA       LEU  17  -0.212  -3.117   6.343
  122   1HB   LEU  17          2HB       LEU  17   2.263  -2.436   8.033
  123   2HB   LEU  17          1HB       LEU  17   2.295  -3.622   6.684
  124    HG   LEU  17           HG       LEU  17   3.181  -1.533   5.911
  125   1HD1  LEU  17          1HD1      LEU  17   1.904  -1.231   3.918
  126   2HD1  LEU  17          2HD1      LEU  17   0.357  -1.650   4.757
  127   3HD1  LEU  17          3HD1      LEU  17   1.602  -2.921   4.447
  128   1HD2  LEU  17          1HD2      LEU  17   2.223   0.619   6.143
  129   2HD2  LEU  17          2HD2      LEU  17   2.020  -0.151   7.753
  130   3HD2  LEU  17          3HD2      LEU  17   0.615  -0.025   6.632
  131    H    GLN  18           H        GLN  18  -0.615  -5.279   6.413
  132    HA   GLN  18           HA       GLN  18   0.215  -6.736   8.779
  133   1HB   GLN  18          2HB       GLN  18  -2.672  -6.793   7.758
  134   2HB   GLN  18          1HB       GLN  18  -1.947  -7.864   8.994
  135   1HG   GLN  18          2HG       GLN  18  -1.385  -5.607  10.257
  136   2HG   GLN  18          1HG       GLN  18  -2.660  -4.873   9.254
  137   1HE2  GLN  18          1HE2      GLN  18  -4.929  -5.859   9.509
  138   2HE2  GLN  18          2HE2      GLN  18  -5.277  -6.822  10.910
  139    H    GLY  19           H        GLY  19   0.658  -8.952   8.317
  140   1HA   GLY  19          2HA       GLY  19   0.934 -10.727   7.032
  141   2HA   GLY  19          1HA       GLY  19   0.113  -9.911   5.664
  142    H    GLY  20           H        GLY  20   1.587 -10.435   4.056
  143   1HA   GLY  20          2HA       GLY  20   3.221  -9.573   2.806
  144   2HA   GLY  20          1HA       GLY  20   4.160  -9.060   4.258
  145    H    LYS  21           H        LYS  21   5.434 -10.263   2.096
  146    HA   LYS  21           HA       LYS  21   5.563 -12.916   2.038
  147   1HB   LYS  21          2HB       LYS  21   6.715 -10.797   0.757
  148   2HB   LYS  21          1HB       LYS  21   8.143 -11.403   1.636
  149   1HG   LYS  21          2HG       LYS  21   8.150 -12.433  -0.520
  150   2HG   LYS  21          1HG       LYS  21   7.539 -13.719   0.573
  151   1HD   LYS  21          2HD       LYS  21   5.172 -12.961  -0.020
  152   2HD   LYS  21          1HD       LYS  21   5.839 -11.840  -1.217
  153   1HE   LYS  21          2HE       LYS  21   6.558 -14.840  -1.336
  154   2HE   LYS  21          1HE       LYS  21   4.982 -14.246  -1.995
  155   1HZ   LYS  21          1HZ       LYS  21   7.369 -12.756  -2.828
  156   2HZ   LYS  21          2HZ       LYS  21   5.957 -13.186  -3.652
  157   3HZ   LYS  21          3HZ       LYS  21   7.162 -14.301  -3.486
  158    H    ASP  22           H        ASP  22   7.051 -10.917   4.396
  159    HA   ASP  22           HA       ASP  22   8.759 -12.477   5.796
  160   1HB   ASP  22          2HB       ASP  22   8.091 -10.044   5.961
  161   2HB   ASP  22          1HB       ASP  22   6.524 -10.538   6.686
  162    H    PHE  23           H        PHE  23   5.167 -12.559   5.921
  163    HA   PHE  23           HA       PHE  23   5.223 -14.683   7.903
  164   1HB   PHE  23          2HB       PHE  23   3.089 -12.810   6.712
  165   2HB   PHE  23          1HB       PHE  23   2.673 -14.183   7.788
  166    HD1  PHE  23           1HD      PHE  23   3.179 -14.155  10.094
  167    HD2  PHE  23           2HD      PHE  23   4.360 -10.915   7.618
  168    HE1  PHE  23           1HE      PHE  23   3.583 -12.786  12.087
  169    HE2  PHE  23           2HE      PHE  23   4.791  -9.550   9.604
  170    HZ   PHE  23           HZ       PHE  23   4.402 -10.479  11.842
  171    H    ASN  24           H        ASN  24   5.632 -14.661   4.702
  172    HA   ASN  24           HA       ASN  24   5.096 -15.770   2.946
  173   1HB   ASN  24          2HB       ASN  24   4.124 -17.971   4.822
  174   2HB   ASN  24          1HB       ASN  24   4.400 -18.148   3.047
  175   1HD2  ASN  24          1HD2      ASN  24   5.702 -19.875   4.501
  176   2HD2  ASN  24          2HD2      ASN  24   7.404 -19.489   4.602
  177    H    MET  25           H        MET  25   3.545 -13.865   2.980
  178    HA   MET  25           HA       MET  25   0.855 -14.809   2.370
  179   1HB   MET  25          2HB       MET  25   1.963 -12.694   4.228
  180   2HB   MET  25          1HB       MET  25   0.425 -12.309   3.517
  181   1HG   MET  25          2HG       MET  25   1.119 -14.764   5.272
  182   2HG   MET  25          1HG       MET  25   0.247 -13.306   5.801
  183   1HE   MET  25          1HE       MET  25  -1.289 -14.797   6.933
  184   2HE   MET  25          2HE       MET  25  -0.582 -16.313   6.283
  185   3HE   MET  25          3HE       MET  25  -2.357 -16.043   6.203
  186    HA   PRO  26           HA       PRO  26   1.509 -11.677  -0.820
  187   1HB   PRO  26          2HB       PRO  26  -1.103 -10.517  -0.988
  188   2HB   PRO  26          1HB       PRO  26  -0.568 -12.016  -1.781
  189   1HG   PRO  26          2HG       PRO  26  -2.372 -11.721   0.567
  190   2HG   PRO  26          1HG       PRO  26  -2.167 -13.079  -0.580
  191   1HD   PRO  26          2HD       PRO  26  -0.967 -12.430   2.087
  192   2HD   PRO  26          1HD       PRO  26  -0.854 -14.062   1.347
  193    H    LEU  27           H        LEU  27   1.686  -9.169  -0.936
  194    HA   LEU  27           HA       LEU  27   2.049  -8.265   1.771
  195   1HB   LEU  27          2HB       LEU  27   3.287  -7.863  -0.704
  196   2HB   LEU  27          1HB       LEU  27   2.538  -6.293  -0.351
  197    HG   LEU  27           HG       LEU  27   4.342  -7.973   1.510
  198   1HD1  LEU  27          1HD1      LEU  27   5.000  -5.494  -0.196
  199   2HD1  LEU  27          2HD1      LEU  27   5.690  -7.166  -0.334
  200   3HD1  LEU  27          3HD1      LEU  27   6.070  -6.150   1.100
  201   1HD2  LEU  27          1HD2      LEU  27   4.550  -5.925   2.933
  202   2HD2  LEU  27          2HD2      LEU  27   2.823  -6.455   2.861
  203   3HD2  LEU  27          3HD2      LEU  27   3.394  -5.056   1.873
  204    H    THR  28           H        THR  28   0.253  -7.882   2.818
  205    HA   THR  28           HA       THR  28  -1.950  -6.703   1.317
  206    HB   THR  28           HB       THR  28  -3.487  -7.630   2.524
  207    HG1  THR  28           1HG      THR  28  -1.598  -7.809   4.606
  208   1HG2  THR  28          1HG2      THR  28  -1.234  -9.706   2.875
  209   2HG2  THR  28          2HG2      THR  28  -1.702  -9.082   1.253
  210   3HG2  THR  28          3HG2      THR  28  -2.931  -9.935   2.289
  211    H    ILE  29           H        ILE  29  -3.295  -5.125   2.166
  212    HA   ILE  29           HA       ILE  29  -2.201  -3.614   4.470
  213    HB   ILE  29           HB       ILE  29  -3.431  -2.406   2.019
  214   1HG1  ILE  29          2HG1      ILE  29  -0.627  -2.679   3.196
  215   2HG1  ILE  29          1HG1      ILE  29  -1.197  -3.136   1.565
  216   1HG2  ILE  29          1HG2      ILE  29  -2.449  -1.252   4.740
  217   2HG2  ILE  29          2HG2      ILE  29  -4.163  -1.272   4.132
  218   3HG2  ILE  29          3HG2      ILE  29  -2.944  -0.275   3.315
  219   1HD1  ILE  29          1HD1      ILE  29  -1.444  -0.765   0.919
  220   2HD1  ILE  29          2HD1      ILE  29   0.224  -1.094   1.522
  221   3HD1  ILE  29          3HD1      ILE  29  -0.953  -0.242   2.580
  222    H    SER  30           H        SER  30  -3.662  -3.058   5.981
  223    HA   SER  30           HA       SER  30  -6.090  -4.682   5.888
  224   1HB   SER  30          2HB       SER  30  -4.605  -5.117   7.698
  225   2HB   SER  30          1HB       SER  30  -4.563  -3.401   8.183
  226    HG   SER  30           HG       SER  30  -6.880  -5.085   8.208
  227    H    ARG  31           H        ARG  31  -5.653  -1.489   7.562
  228    HA   ARG  31           HA       ARG  31  -7.778  -0.471   5.844
  229   1HB   ARG  31          2HB       ARG  31  -7.902  -0.651   8.893
  230   2HB   ARG  31          1HB       ARG  31  -8.781   0.601   7.988
  231   1HG   ARG  31          2HG       ARG  31 -10.482  -0.836   8.042
  232   2HG   ARG  31          1HG       ARG  31  -9.708  -1.421   6.559
  233   1HD   ARG  31          2HD       ARG  31 -10.248  -3.394   7.753
  234   2HD   ARG  31          1HD       ARG  31  -8.482  -3.183   8.102
  235    HE   ARG  31           HE       ARG  31 -10.161  -1.810  10.088
  236   1HH1  ARG  31          1HH1      ARG  31  -9.068  -5.147   9.263
  237   2HH1  ARG  31          2HH1      ARG  31  -9.650  -5.767  10.763
  238   1HH2  ARG  31          1HH2      ARG  31 -10.957  -2.688  11.888
  239   2HH2  ARG  31          2HH2      ARG  31 -10.905  -4.401  12.193
  240    H    ILE  32           H        ILE  32  -8.087   1.852   6.093
  241    HA   ILE  32           HA       ILE  32  -5.633   3.318   6.518
  242    HB   ILE  32           HB       ILE  32  -8.464   3.874   5.635
  243   1HG1  ILE  32          2HG1      ILE  32  -7.657   4.785   3.668
  244   2HG1  ILE  32          1HG1      ILE  32  -6.001   4.985   4.212
  245   1HG2  ILE  32          1HG2      ILE  32  -6.351   5.988   6.377
  246   2HG2  ILE  32          2HG2      ILE  32  -8.019   5.799   7.104
  247   3HG2  ILE  32          3HG2      ILE  32  -7.834   6.275   5.392
  248   1HD1  ILE  32          1HD1      ILE  32  -5.728   2.423   4.094
  249   2HD1  ILE  32          2HD1      ILE  32  -6.120   3.233   2.537
  250   3HD1  ILE  32          3HD1      ILE  32  -7.416   2.355   3.440
  251    H    THR  33           H        THR  33  -5.209   4.536   8.411
  252    HA   THR  33           HA       THR  33  -7.062   4.319  10.558
  253    HB   THR  33           HB       THR  33  -4.347   5.499  10.193
  254    HG1  THR  33           1HG      THR  33  -4.037   4.177  11.974
  255   1HG2  THR  33          1HG2      THR  33  -4.445   6.305  12.599
  256   2HG2  THR  33          2HG2      THR  33  -6.240   6.124  12.559
  257   3HG2  THR  33          3HG2      THR  33  -5.425   7.302  11.485
  258    HA   PRO  34           HA       PRO  34  -9.335   7.961   9.623
  259   1HB   PRO  34          2HB       PRO  34  -8.845   8.171  12.675
  260   2HB   PRO  34          1HB       PRO  34 -10.311   8.766  11.809
  261   1HG   PRO  34          2HG       PRO  34 -10.373   6.277  12.932
  262   2HG   PRO  34          1HG       PRO  34 -10.910   6.426  11.200
  263   1HD   PRO  34          2HD       PRO  34  -8.207   5.447  12.275
  264   2HD   PRO  34          1HD       PRO  34  -9.146   4.876  10.831
  265    H    GLY  35           H        GLY  35  -9.507  10.243   9.712
  266   1HA   GLY  35          2HA       GLY  35  -8.874  12.313  10.108
  267   2HA   GLY  35          1HA       GLY  35  -7.394  11.735  10.923
  268    H    SER  36           H        SER  36  -6.521  10.227   8.536
  269    HA   SER  36           HA       SER  36  -5.109  12.566   7.553
  270   1HB   SER  36          2HB       SER  36  -4.207  10.295   8.767
  271   2HB   SER  36          1HB       SER  36  -4.033   9.801   7.064
  272    HG   SER  36           HG       SER  36  -2.912  12.024   8.412
  273    H    LYS  37           H        LYS  37  -3.827  11.877   5.353
  274    HA   LYS  37           HA       LYS  37  -5.818  12.458   3.500
  275   1HB   LYS  37          2HB       LYS  37  -3.462  13.287   3.471
  276   2HB   LYS  37          1HB       LYS  37  -2.906  11.665   2.976
  277   1HG   LYS  37          2HG       LYS  37  -4.322  11.874   0.862
  278   2HG   LYS  37          1HG       LYS  37  -4.846  13.495   1.434
  279   1HD   LYS  37          2HD       LYS  37  -2.395  14.137   1.566
  280   2HD   LYS  37          1HD       LYS  37  -1.977  12.613   0.726
  281   1HE   LYS  37          2HE       LYS  37  -3.232  13.366  -1.314
  282   2HE   LYS  37          1HE       LYS  37  -3.877  14.794  -0.402
  283   1HZ   LYS  37          1HZ       LYS  37  -1.015  14.270  -1.103
  284   2HZ   LYS  37          2HZ       LYS  37  -1.557  15.461  -0.033
  285   3HZ   LYS  37          3HZ       LYS  37  -2.025  15.512  -1.653
  286    H    ALA  38           H        ALA  38  -4.195   9.484   4.261
  287    HA   ALA  38           HA       ALA  38  -4.979   7.807   2.168
  288   1HB   ALA  38          1HB       ALA  38  -4.695   7.059   5.093
  289   2HB   ALA  38          2HB       ALA  38  -3.297   7.373   3.991
  290   3HB   ALA  38          3HB       ALA  38  -4.417   6.035   3.631
  291    H    ALA  39           H        ALA  39  -6.973   9.171   4.756
  292    HA   ALA  39           HA       ALA  39  -9.103   7.353   4.080
  293   1HB   ALA  39          1HB       ALA  39  -8.686   8.108   6.468
  294   2HB   ALA  39          2HB       ALA  39 -10.328   8.581   5.893
  295   3HB   ALA  39          3HB       ALA  39  -8.995   9.796   5.974
  296    H    GLN  40           H        GLN  40  -8.491  10.855   3.944
  297    HA   GLN  40           HA       GLN  40 -10.882  11.615   2.876
  298   1HB   GLN  40          2HB       GLN  40  -8.172  12.731   3.370
  299   2HB   GLN  40          1HB       GLN  40  -9.004  13.559   2.052
  300   1HG   GLN  40          2HG       GLN  40  -9.412  14.669   4.221
  301   2HG   GLN  40          1HG       GLN  40 -10.946  14.078   3.488
  302   1HE2  GLN  40          1HE2      GLN  40  -8.433  13.281   5.954
  303   2HE2  GLN  40          2HE2      GLN  40  -9.484  12.310   6.953
  304    H    SER  41           H        SER  41  -8.002  10.674   1.045
  305    HA   SER  41           HA       SER  41  -9.167  11.855  -1.329
  306   1HB   SER  41          2HB       SER  41  -6.810  12.207  -0.629
  307   2HB   SER  41          1HB       SER  41  -6.474  10.481  -0.943
  308    HG   SER  41           HG       SER  41  -7.069  12.574  -2.749
  309    H    GLN  42           H        GLN  42  -7.946  10.013  -3.291
  310    HA   GLN  42           HA       GLN  42 -10.188   8.313  -3.545
  311   1HB   GLN  42          2HB       GLN  42  -9.180   9.729  -5.321
  312   2HB   GLN  42          1HB       GLN  42  -7.585   8.979  -5.051
  313   1HG   GLN  42          2HG       GLN  42  -8.550   8.210  -7.089
  314   2HG   GLN  42          1HG       GLN  42  -8.403   6.804  -5.974
  315   1HE2  GLN  42          1HE2      GLN  42 -10.364   5.950  -5.001
  316   2HE2  GLN  42          2HE2      GLN  42 -11.947   6.273  -5.684
  317    H    LEU  43           H        LEU  43  -7.149   8.134  -2.122
  318    HA   LEU  43           HA       LEU  43  -6.296   5.549  -2.734
  319   1HB   LEU  43          2HB       LEU  43  -5.072   7.638  -1.657
  320   2HB   LEU  43          1HB       LEU  43  -5.760   7.053  -0.122
  321    HG   LEU  43           HG       LEU  43  -4.637   4.721  -0.950
  322   1HD1  LEU  43          1HD1      LEU  43  -2.877   6.866  -2.309
  323   2HD1  LEU  43          2HD1      LEU  43  -3.972   5.754  -3.183
  324   3HD1  LEU  43          3HD1      LEU  43  -2.568   5.096  -2.261
  325   1HD2  LEU  43          1HD2      LEU  43  -2.544   5.427   0.352
  326   2HD2  LEU  43          2HD2      LEU  43  -4.098   5.733   1.185
  327   3HD2  LEU  43          3HD2      LEU  43  -3.225   7.101   0.397
  328    H    SER  44           H        SER  44  -7.131   3.587  -2.094
  329    HA   SER  44           HA       SER  44  -7.570   3.440   0.794
  330   1HB   SER  44          2HB       SER  44  -9.832   3.260  -0.339
  331   2HB   SER  44          1HB       SER  44  -9.241   1.787  -1.161
  332    HG   SER  44           HG       SER  44  -9.773   2.304   1.540
  333    H    GLN  45           H        GLN  45  -5.233   3.048   0.652
  334    HA   GLN  45           HA       GLN  45  -4.288   0.614  -0.384
  335   1HB   GLN  45          2HB       GLN  45  -3.455   2.376   1.978
  336   2HB   GLN  45          1HB       GLN  45  -2.604   0.883   1.525
  337   1HG   GLN  45          2HG       GLN  45  -2.317   1.836  -0.824
  338   2HG   GLN  45          1HG       GLN  45  -2.836   3.428  -0.188
  339   1HE2  GLN  45          2HE2      GLN  45  -0.884   4.628  -0.047
  340   2HE2  GLN  45          1HE2      GLN  45   0.604   3.994   0.655
  341    H    GLY  46           H        GLY  46  -5.297  -1.308   0.017
  342   1HA   GLY  46          2HA       GLY  46  -5.506  -2.392   2.549
  343   2HA   GLY  46          1HA       GLY  46  -7.026  -1.532   2.213
  344    H    ASP  47           H        ASP  47  -4.746  -3.563   0.284
  345    HA   ASP  47           HA       ASP  47  -6.502  -5.720   0.257
  346   1HB   ASP  47          2HB       ASP  47  -7.471  -4.084  -1.595
  347   2HB   ASP  47          1HB       ASP  47  -6.039  -4.527  -2.560
  348    H    LEU  48           H        LEU  48  -5.263  -6.896  -2.198
  349    HA   LEU  48           HA       LEU  48  -2.649  -7.420  -1.116
  350   1HB   LEU  48          2HB       LEU  48  -4.026  -8.500  -3.622
  351   2HB   LEU  48          1HB       LEU  48  -2.427  -8.979  -2.985
  352    HG   LEU  48           HG       LEU  48  -3.719 -10.710  -2.199
  353   1HD1  LEU  48          1HD1      LEU  48  -4.197 -10.545   0.189
  354   2HD1  LEU  48          2HD1      LEU  48  -4.222  -8.746   0.135
  355   3HD1  LEU  48          3HD1      LEU  48  -2.683  -9.632  -0.229
  356   1HD2  LEU  48          1HD2      LEU  48  -5.919  -9.532  -3.001
  357   2HD2  LEU  48          2HD2      LEU  48  -5.933  -8.758  -1.349
  358   3HD2  LEU  48          3HD2      LEU  48  -6.047 -10.564  -1.475
  359    H    VAL  49           H        VAL  49  -1.111  -5.965  -1.515
  360    HA   VAL  49           HA       VAL  49  -1.365  -4.112  -3.665
  361    HB   VAL  49           HB       VAL  49   0.764  -4.613  -1.552
  362   1HG1  VAL  49          1HG1      VAL  49   1.486  -2.275  -2.104
  363   2HG1  VAL  49          2HG1      VAL  49   0.398  -2.284  -3.551
  364   3HG1  VAL  49          3HG1      VAL  49   1.806  -3.423  -3.454
  365   1HG2  VAL  49          1HG2      VAL  49  -1.516  -2.526  -1.762
  366   2HG2  VAL  49          2HG2      VAL  49  -0.249  -2.602  -0.490
  367   3HG2  VAL  49          3HG2      VAL  49  -1.462  -3.921  -0.610
  368    H    VAL  50           H        VAL  50  -0.212  -4.224  -5.629
  369    HA   VAL  50           HA       VAL  50   1.298  -6.678  -6.060
  370    HB   VAL  50           HB       VAL  50   0.587  -4.766  -8.291
  371   1HG1  VAL  50          1HG1      VAL  50   2.145  -6.773  -8.598
  372   2HG1  VAL  50          2HG1      VAL  50   0.588  -6.946  -9.494
  373   3HG1  VAL  50          3HG1      VAL  50   0.819  -7.821  -7.942
  374   1HG2  VAL  50          1HG2      VAL  50  -1.560  -4.951  -7.248
  375   2HG2  VAL  50          2HG2      VAL  50  -1.297  -6.698  -6.833
  376   3HG2  VAL  50          3HG2      VAL  50  -1.514  -6.178  -8.552
  377    H    ALA  51           H        ALA  51   1.491  -3.294  -7.132
  378    HA   ALA  51           HA       ALA  51   4.411  -3.414  -6.871
  379   1HB   ALA  51          1HB       ALA  51   4.541  -1.787  -8.738
  380   2HB   ALA  51          2HB       ALA  51   2.737  -1.758  -8.854
  381   3HB   ALA  51          3HB       ALA  51   3.647  -3.257  -9.252
  382    H    ILE  52           H        ILE  52   5.459  -1.860  -5.844
  383    HA   ILE  52           HA       ILE  52   3.897   0.273  -4.610
  384    HB   ILE  52           HB       ILE  52   5.018  -1.938  -3.420
  385   1HG1  ILE  52          2HG1      ILE  52   4.232   0.738  -2.143
  386   2HG1  ILE  52          1HG1      ILE  52   3.097  -0.513  -2.745
  387   1HG2  ILE  52          1HG2      ILE  52   7.312  -1.045  -3.603
  388   2HG2  ILE  52          2HG2      ILE  52   6.767  -1.139  -1.904
  389   3HG2  ILE  52          3HG2      ILE  52   6.809   0.465  -2.735
  390   1HD1  ILE  52          1HD1      ILE  52   5.099  -0.822  -0.426
  391   2HD1  ILE  52          2HD1      ILE  52   4.172  -2.198  -1.147
  392   3HD1  ILE  52          3HD1      ILE  52   3.304  -0.844  -0.347
  393    H    ASP  53           H        ASP  53   4.464   2.168  -5.298
  394    HA   ASP  53           HA       ASP  53   5.223   3.545  -6.630
  395   1HB   ASP  53          2HB       ASP  53   6.620   3.851  -4.490
  396   2HB   ASP  53          1HB       ASP  53   8.023   3.294  -5.476
  397    H    GLY  54           H        GLY  54   5.074   1.085  -7.836
  398   1HA   GLY  54          2HA       GLY  54   5.289   0.642 -10.050
  399   2HA   GLY  54          1HA       GLY  54   6.770   1.635 -10.140
  400    H    VAL  55           H        VAL  55   7.185  -0.368  -7.462
  401    HA   VAL  55           HA       VAL  55   8.488  -2.365  -9.172
  402    HB   VAL  55           HB       VAL  55   9.267  -1.534  -6.378
  403   1HG1  VAL  55          1HG1      VAL  55   9.893  -3.908  -7.002
  404   2HG1  VAL  55          2HG1      VAL  55  11.349  -2.855  -7.013
  405   3HG1  VAL  55          3HG1      VAL  55  10.562  -3.325  -8.562
  406   1HG2  VAL  55          1HG2      VAL  55   9.678   0.358  -7.917
  407   2HG2  VAL  55          2HG2      VAL  55  10.428  -0.749  -9.129
  408   3HG2  VAL  55          3HG2      VAL  55  11.230  -0.462  -7.542
  409    H    ASN  56           H        ASN  56   7.992  -4.499  -8.901
  410    HA   ASN  56           HA       ASN  56   5.639  -5.043  -7.468
  411   1HB   ASN  56          2HB       ASN  56   5.838  -7.291  -8.437
  412   2HB   ASN  56          1HB       ASN  56   6.060  -5.985  -9.653
  413   1HD2  ASN  56          1HD2      ASN  56   7.222  -8.967  -8.946
  414   2HD2  ASN  56          2HD2      ASN  56   8.815  -8.767  -9.620
  415    H    THR  57           H        THR  57   5.217  -6.235  -5.709
  416    HA   THR  57           HA       THR  57   7.179  -6.272  -3.708
  417    HB   THR  57           HB       THR  57   5.216  -7.007  -2.310
  418    HG1  THR  57           1HG      THR  57   3.726  -6.464  -4.620
  419   1HG2  THR  57          1HG2      THR  57   3.987  -4.865  -2.563
  420   2HG2  THR  57          2HG2      THR  57   4.806  -4.533  -4.128
  421   3HG2  THR  57          3HG2      THR  57   5.762  -4.588  -2.606
  422    H    ASP  58           H        ASP  58   7.979  -8.178  -5.578
  423    HA   ASP  58           HA       ASP  58   7.131 -10.750  -4.880
  424   1HB   ASP  58          2HB       ASP  58   8.316  -9.884  -7.016
  425   2HB   ASP  58          1HB       ASP  58   9.850 -10.045  -6.121
  426    H    THR  59           H        THR  59  10.089  -8.957  -3.901
  427    HA   THR  59           HA       THR  59  10.377 -10.936  -1.757
  428    HB   THR  59           HB       THR  59  12.076 -10.909  -3.619
  429    HG1  THR  59           1HG      THR  59  12.433 -11.780  -1.567
  430   1HG2  THR  59          1HG2      THR  59  13.009  -8.310  -2.219
  431   2HG2  THR  59          2HG2      THR  59  12.359  -8.443  -3.894
  432   3HG2  THR  59          3HG2      THR  59  13.909  -9.238  -3.467
  433    H    MET  60           H        MET  60   9.157  -8.032  -2.076
  434    HA   MET  60           HA       MET  60  10.305  -6.634   0.082
  435   1HB   MET  60          2HB       MET  60   7.783  -6.524  -1.633
  436   2HB   MET  60          1HB       MET  60   8.069  -5.325  -0.314
  437   1HG   MET  60          2HG       MET  60  10.337  -4.838  -1.465
  438   2HG   MET  60          1HG       MET  60   9.755  -5.812  -2.839
  439   1HE   MET  60          1HE       MET  60   9.517  -4.313  -4.788
  440   2HE   MET  60          2HE       MET  60  10.738  -3.557  -3.714
  441   3HE   MET  60          3HE       MET  60   9.505  -2.536  -4.538
  442    H    THR  61           H        THR  61   9.542  -6.332   2.128
  443    HA   THR  61           HA       THR  61   7.733  -8.416   3.111
  444    HB   THR  61           HB       THR  61   8.929  -8.109   5.261
  445    HG1  THR  61           1HG      THR  61  11.035  -6.853   4.140
  446   1HG2  THR  61          1HG2      THR  61   9.670  -9.825   3.576
  447   2HG2  THR  61          2HG2      THR  61  11.068  -9.145   4.476
  448   3HG2  THR  61          3HG2      THR  61  10.734  -8.623   2.783
  449    H    HIS  62           H        HIS  62   6.507  -7.717   5.166
  450    HA   HIS  62           HA       HIS  62   5.042  -5.489   4.898
  451   1HB   HIS  62          2HB       HIS  62   4.065  -6.080   6.824
  452   2HB   HIS  62          1HB       HIS  62   4.998  -7.575   6.549
  453    HD1  HIS  62           1HD      HIS  62   7.044  -8.022   8.356
  454    HD2  HIS  62           2HD      HIS  62   4.588  -4.684   9.073
  455    HE1  HIS  62           1HE      HIS  62   7.435  -7.282  10.711
  456    H    LEU  63           H        LEU  63   8.065  -5.672   6.718
  457    HA   LEU  63           HA       LEU  63   8.200  -2.983   7.455
  458   1HB   LEU  63          2HB       LEU  63   9.631  -4.773   8.415
  459   2HB   LEU  63          1HB       LEU  63  10.433  -4.982   6.831
  460    HG   LEU  63           HG       LEU  63  11.225  -2.570   6.963
  461   1HD1  LEU  63          1HD1      LEU  63   9.539  -1.640   8.570
  462   2HD1  LEU  63          2HD1      LEU  63  11.214  -1.428   9.183
  463   3HD1  LEU  63          3HD1      LEU  63  10.169  -2.730   9.862
  464   1HD2  LEU  63          1HD2      LEU  63  12.673  -4.461   7.509
  465   2HD2  LEU  63          2HD2      LEU  63  12.092  -4.456   9.220
  466   3HD2  LEU  63          3HD2      LEU  63  13.035  -3.049   8.578
  467    H    GLU  64           H        GLU  64   9.618  -4.614   4.518
  468    HA   GLU  64           HA       GLU  64  10.753  -2.307   3.612
  469   1HB   GLU  64          2HB       GLU  64  10.849  -4.873   2.798
  470   2HB   GLU  64          1HB       GLU  64   9.778  -4.265   1.492
  471   1HG   GLU  64          2HG       GLU  64  11.432  -2.396   1.066
  472   2HG   GLU  64          1HG       GLU  64  12.419  -2.987   2.453
  473    H    ALA  65           H        ALA  65   7.519  -3.574   2.790
  474    HA   ALA  65           HA       ALA  65   6.858  -1.682   0.891
  475   1HB   ALA  65          1HB       ALA  65   5.741  -3.839   1.355
  476   2HB   ALA  65          2HB       ALA  65   4.522  -2.495   1.393
  477   3HB   ALA  65          3HB       ALA  65   5.140  -3.217   2.936
  478    H    GLN  66           H        GLN  66   6.397  -1.572   4.396
  479    HA   GLN  66           HA       GLN  66   5.201   0.904   4.647
  480   1HB   GLN  66          2HB       GLN  66   5.368  -0.712   6.488
  481   2HB   GLN  66          1HB       GLN  66   7.099  -0.840   6.254
  482   1HG   GLN  66          2HG       GLN  66   7.014   0.257   8.229
  483   2HG   GLN  66          1HG       GLN  66   7.365   1.600   7.120
  484   1HE2  GLN  66          1HE2      GLN  66   4.121   1.036   6.531
  485   2HE2  GLN  66          2HE2      GLN  66   3.408   1.905   7.861
  486    H    ASN  67           H        ASN  67   8.688   0.114   4.690
  487    HA   ASN  67           HA       ASN  67   9.564   2.761   4.841
  488   1HB   ASN  67          2HB       ASN  67  10.813   0.102   3.959
  489   2HB   ASN  67          1HB       ASN  67  11.781   1.615   3.957
  490   1HD2  ASN  67          1HD2      ASN  67  12.542  -0.525   5.517
  491   2HD2  ASN  67          2HD2      ASN  67  12.311  -0.145   7.199
  492    H    LYS  68           H        LYS  68   8.978   0.744   1.975
  493    HA   LYS  68           HA       LYS  68  10.052   2.474   0.118
  494   1HB   LYS  68          2HB       LYS  68   7.779   0.462  -0.087
  495   2HB   LYS  68          1HB       LYS  68   8.509   1.262  -1.517
  496   1HG   LYS  68          2HG       LYS  68  10.408  -0.159   0.354
  497   2HG   LYS  68          1HG       LYS  68   9.233  -1.164  -0.537
  498   1HD   LYS  68          2HD       LYS  68   9.979  -0.206  -2.688
  499   2HD   LYS  68          1HD       LYS  68  11.214   0.791  -1.863
  500   1HE   LYS  68          2HE       LYS  68  11.075  -2.273  -1.527
  501   2HE   LYS  68          1HE       LYS  68  11.927  -1.524  -2.940
  502   1HZ   LYS  68          1HZ       LYS  68  13.635  -0.879  -1.632
  503   2HZ   LYS  68          2HZ       LYS  68  13.077  -2.102  -0.639
  504   3HZ   LYS  68          3HZ       LYS  68  12.673  -0.495  -0.311
  505    H    ILE  69           H        ILE  69   6.480   2.236   1.007
  506    HA   ILE  69           HA       ILE  69   5.687   4.500  -0.177
  507    HB   ILE  69           HB       ILE  69   4.929   2.970   2.315
  508   1HG1  ILE  69          2HG1      ILE  69   3.450   3.380  -0.320
  509   2HG1  ILE  69          1HG1      ILE  69   4.604   2.072  -0.197
  510   1HG2  ILE  69          1HG2      ILE  69   4.053   5.144   2.804
  511   2HG2  ILE  69          2HG2      ILE  69   2.673   4.337   1.961
  512   3HG2  ILE  69          3HG2      ILE  69   3.691   5.509   1.066
  513   1HD1  ILE  69          1HD1      ILE  69   3.362   1.103   1.807
  514   2HD1  ILE  69          2HD1      ILE  69   2.442   1.095   0.264
  515   3HD1  ILE  69          3HD1      ILE  69   2.061   2.323   1.511
  516    H    LYS  70           H        LYS  70   7.131   4.307   3.134
  517    HA   LYS  70           HA       LYS  70   6.723   7.095   3.493
  518   1HB   LYS  70          2HB       LYS  70   7.770   4.809   5.065
  519   2HB   LYS  70          1HB       LYS  70   8.478   6.377   5.487
  520   1HG   LYS  70          2HG       LYS  70   6.587   5.796   6.896
  521   2HG   LYS  70          1HG       LYS  70   6.378   7.359   6.056
  522   1HD   LYS  70          2HD       LYS  70   4.743   6.430   4.527
  523   2HD   LYS  70          1HD       LYS  70   5.152   4.755   5.011
  524   1HE   LYS  70          2HE       LYS  70   2.957   5.434   5.930
  525   2HE   LYS  70          1HE       LYS  70   4.146   5.060   7.231
  526   1HZ   LYS  70          1HZ       LYS  70   3.548   7.838   6.297
  527   2HZ   LYS  70          2HZ       LYS  70   4.433   7.330   7.663
  528   3HZ   LYS  70          3HZ       LYS  70   2.775   7.090   7.584
  529    H    SER  71           H        SER  71   8.880   5.752   1.426
  530    HA   SER  71           HA       SER  71  10.830   7.898   1.930
  531   1HB   SER  71          2HB       SER  71  11.695   5.533   1.860
  532   2HB   SER  71          1HB       SER  71  11.148   5.418   0.166
  533    HG   SER  71           HG       SER  71  12.475   7.342  -0.160
  534    H    ALA  72           H        ALA  72   8.012   7.564   0.394
  535    HA   ALA  72           HA       ALA  72   8.868   8.823  -2.109
  536   1HB   ALA  72          1HB       ALA  72   7.556   6.623  -2.089
  537   2HB   ALA  72          2HB       ALA  72   6.751   7.944  -3.004
  538   3HB   ALA  72          3HB       ALA  72   6.203   7.523  -1.330
  539    H    SER  73           H        SER  73   7.056  10.420  -2.888
  540    HA   SER  73           HA       SER  73   5.647  11.844  -0.977
  541   1HB   SER  73          2HB       SER  73   6.920  13.994  -0.845
  542   2HB   SER  73          1HB       SER  73   7.655  12.647   0.047
  543    HG   SER  73           HG       SER  73   9.254  13.585  -1.077
  544    H    TYR  74           H        TYR  74   7.670  13.031  -3.692
  545    HA   TYR  74           HA       TYR  74   5.550  14.498  -4.771
  546   1HB   TYR  74          2HB       TYR  74   8.281  13.590  -5.786
  547   2HB   TYR  74          1HB       TYR  74   7.118  14.266  -6.975
  548    HD1  TYR  74           1HD      TYR  74   6.297  16.473  -6.829
  549    HD2  TYR  74           2HD      TYR  74   9.165  15.061  -4.035
  550    HE1  TYR  74           1HE      TYR  74   6.818  18.782  -6.209
  551    HE2  TYR  74           2HE      TYR  74   9.690  17.358  -3.399
  552    HH   TYR  74           HH       TYR  74   9.206  19.545  -3.702
  553    H    ASN  75           H        ASN  75   6.753  11.271  -5.676
  554    HA   ASN  75           HA       ASN  75   4.092  10.737  -6.785
  555   1HB   ASN  75          2HB       ASN  75   5.845  10.832  -8.544
  556   2HB   ASN  75          1HB       ASN  75   6.833   9.618  -7.651
  557   1HD2  ASN  75          1HD2      ASN  75   5.672   7.343  -7.376
  558   2HD2  ASN  75          2HD2      ASN  75   4.877   6.831  -8.810
  559    H    LEU  76           H        LEU  76   3.153   9.071  -5.883
  560    HA   LEU  76           HA       LEU  76   4.727   6.929  -4.756
  561   1HB   LEU  76          2HB       LEU  76   4.189   8.117  -2.669
  562   2HB   LEU  76          1HB       LEU  76   2.494   8.273  -3.125
  563    HG   LEU  76           HG       LEU  76   2.292   5.712  -3.085
  564   1HD1  LEU  76          1HD1      LEU  76   5.024   5.833  -1.676
  565   2HD1  LEU  76          2HD1      LEU  76   4.810   5.237  -3.371
  566   3HD1  LEU  76          3HD1      LEU  76   4.026   4.376  -1.997
  567   1HD2  LEU  76          1HD2      LEU  76   2.235   5.551  -0.623
  568   2HD2  LEU  76          2HD2      LEU  76   1.509   7.104  -1.206
  569   3HD2  LEU  76          3HD2      LEU  76   3.159   7.096  -0.487
  570    H    SER  77           H        SER  77   4.119   5.633  -6.465
  571    HA   SER  77           HA       SER  77   1.227   5.520  -7.061
  572   1HB   SER  77          2HB       SER  77   2.699   6.138  -8.937
  573   2HB   SER  77          1HB       SER  77   3.486   4.523  -8.819
  574    HG   SER  77           HG       SER  77   1.624   4.852 -10.315
  575    H    LEU  78           H        LEU  78   0.186   4.044  -5.893
  576    HA   LEU  78           HA       LEU  78   1.436   1.402  -5.556
  577   1HB   LEU  78          2HB       LEU  78  -1.031   2.764  -4.398
  578   2HB   LEU  78          1HB       LEU  78  -0.806   1.013  -4.252
  579    HG   LEU  78           HG       LEU  78  -0.013   2.881  -2.397
  580   1HD1  LEU  78          1HD1      LEU  78   1.011   0.894  -1.269
  581   2HD1  LEU  78          2HD1      LEU  78   1.023   0.011  -2.843
  582   3HD1  LEU  78          3HD1      LEU  78  -0.542   0.460  -2.064
  583   1HD2  LEU  78          1HD2      LEU  78   2.427   2.710  -2.132
  584   2HD2  LEU  78          2HD2      LEU  78   2.009   3.617  -3.628
  585   3HD2  LEU  78          3HD2      LEU  78   2.589   1.910  -3.737
  586    H    THR  79           H        THR  79   0.486  -0.423  -6.324
  587    HA   THR  79           HA       THR  79  -2.011  -0.221  -7.818
  588    HB   THR  79           HB       THR  79   0.447  -1.827  -8.698
  589    HG1  THR  79           1HG      THR  79   0.621   0.323  -9.307
  590   1HG2  THR  79          1HG2      THR  79  -2.418  -1.513  -9.818
  591   2HG2  THR  79          2HG2      THR  79  -1.683  -3.020  -9.140
  592   3HG2  THR  79          3HG2      THR  79  -1.045  -2.327 -10.679
  593    H    LEU  80           H        LEU  80  -3.355  -1.456  -6.484
  594    HA   LEU  80           HA       LEU  80  -2.441  -4.076  -5.575
  595   1HB   LEU  80          2HB       LEU  80  -3.625  -3.836  -3.545
  596   2HB   LEU  80          1HB       LEU  80  -2.465  -2.450  -3.697
  597    HG   LEU  80           HG       LEU  80  -5.451  -2.469  -4.167
  598   1HD1  LEU  80          1HD1      LEU  80  -4.672  -2.756  -1.812
  599   2HD1  LEU  80          2HD1      LEU  80  -5.551  -1.161  -2.057
  600   3HD1  LEU  80          3HD1      LEU  80  -3.719  -1.203  -1.961
  601   1HD2  LEU  80          1HD2      LEU  80  -3.181  -0.436  -4.394
  602   2HD2  LEU  80          2HD2      LEU  80  -4.833   0.217  -3.918
  603   3HD2  LEU  80          3HD2      LEU  80  -4.602  -0.640  -5.523
  604    H    GLN  81           H        GLN  81  -4.494  -5.468  -5.144
  605    HA   GLN  81           HA       GLN  81  -6.175  -5.180  -7.432
  606   1HB   GLN  81          2HB       GLN  81  -5.718  -7.215  -5.339
  607   2HB   GLN  81          1HB       GLN  81  -7.368  -7.154  -6.005
  608   1HG   GLN  81          2HG       GLN  81  -6.210  -8.792  -7.255
  609   2HG   GLN  81          1HG       GLN  81  -6.556  -7.398  -8.317
  610   1HE2  GLN  81          1HE2      GLN  81  -3.819  -8.240  -6.009
  611   2HE2  GLN  81          2HE2      GLN  81  -2.596  -8.141  -7.231
  612    H    LYS  82           H        LYS  82  -8.476  -5.089  -7.504
  613    HA   LYS  82           HA       LYS  82  -9.439  -3.076  -5.826
  614   1HB   LYS  82          2HB       LYS  82  -9.714  -3.609  -8.400
  615   2HB   LYS  82          1HB       LYS  82 -11.028  -4.698  -7.900
  616   1HG   LYS  82          2HG       LYS  82 -11.778  -2.428  -8.658
  617   2HG   LYS  82          1HG       LYS  82 -12.260  -2.700  -6.965
  618   1HD   LYS  82          2HD       LYS  82  -9.519  -1.624  -7.127
  619   2HD   LYS  82          1HD       LYS  82 -10.598  -0.601  -8.096
  620   1HE   LYS  82          2HE       LYS  82 -10.260   0.178  -5.708
  621   2HE   LYS  82          1HE       LYS  82 -11.997  -0.022  -6.209
  622   1HZ   LYS  82          1HZ       LYS  82 -10.398  -1.718  -4.363
  623   2HZ   LYS  82          2HZ       LYS  82 -11.818  -2.278  -5.079
  624   3HZ   LYS  82          3HZ       LYS  82 -11.822  -0.899  -4.100
  625    H    SER  83           H        SER  83  -9.091  -5.895  -4.810
  626    HA   SER  83           HA       SER  83  -9.841  -7.118  -3.226
  627   1HB   SER  83          2HB       SER  83 -11.303  -6.434  -1.516
  628   2HB   SER  83          1HB       SER  83 -10.416  -5.007  -2.101
  629    HG   SER  83           HG       SER  83 -12.252  -4.630  -3.474
  630    H    LYS  84           H        LYS  84 -12.527  -7.704  -2.316
  631    HA   LYS  84           HA       LYS  84 -13.479  -9.279  -4.608
  632   1HB   LYS  84          2HB       LYS  84 -12.214 -10.467  -2.607
  633   2HB   LYS  84          1HB       LYS  84 -13.736 -10.149  -1.704
  634   1HG   LYS  84          2HG       LYS  84 -15.005 -11.498  -3.382
  635   2HG   LYS  84          1HG       LYS  84 -13.521 -11.655  -4.378
  636   1HD   LYS  84          2HD       LYS  84 -12.382 -12.810  -2.395
  637   2HD   LYS  84          1HD       LYS  84 -13.947 -12.760  -1.536
  638   1HE   LYS  84          2HE       LYS  84 -13.671 -14.993  -2.497
  639   2HE   LYS  84          1HE       LYS  84 -14.975 -14.148  -3.417
  640   1HZ   LYS  84          1HZ       LYS  84 -13.810 -14.504  -5.224
  641   2HZ   LYS  84          2HZ       LYS  84 -12.537 -15.224  -4.340
  642   3HZ   LYS  84          3HZ       LYS  84 -12.503 -13.592  -4.657
  643    H    ARG  85           H        ARG  85 -15.729  -9.189  -4.934
  644    HA   ARG  85           HA       ARG  85 -17.258  -7.768  -2.914
  645   1HB   ARG  85          2HB       ARG  85 -16.453  -6.252  -4.913
  646   2HB   ARG  85          1HB       ARG  85 -17.453  -7.304  -5.941
  647   1HG   ARG  85          2HG       ARG  85 -18.918  -5.523  -5.515
  648   2HG   ARG  85          1HG       ARG  85 -19.409  -6.700  -4.259
  649   1HD   ARG  85          2HD       ARG  85 -17.760  -5.433  -2.666
  650   2HD   ARG  85          1HD       ARG  85 -17.651  -4.155  -3.935
  651    HE   ARG  85           HE       ARG  85 -19.968  -4.830  -2.198
  652   1HH1  ARG  85          1HH1      ARG  85 -19.133  -3.190  -5.325
  653   2HH1  ARG  85          2HH1      ARG  85 -20.479  -2.118  -5.185
  654   1HH2  ARG  85          1HH2      ARG  85 -21.636  -3.223  -2.072
  655   2HH2  ARG  85          2HH2      ARG  85 -21.894  -2.166  -3.396
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1  -9.256  -4.582 -12.603
    2   2H    MET   1          2HT       MET   1  -9.350  -6.097 -13.319
    3   3H    MET   1          3HT       MET   1  -7.848  -5.403 -12.993
    4    HA   MET   1           HA       MET   1  -9.826  -6.317 -10.994
    5   1HB   MET   1          2HB       MET   1  -6.985  -7.280 -11.673
    6   2HB   MET   1          1HB       MET   1  -7.876  -7.762 -10.204
    7   1HG   MET   1          2HG       MET   1  -9.692  -8.758 -11.600
    8   2HG   MET   1          1HG       MET   1  -8.773  -8.335 -13.069
    9   1HE   MET   1          1HE       MET   1  -7.655  -9.843  -9.450
   10   2HE   MET   1          2HE       MET   1  -7.761 -11.575  -9.894
   11   3HE   MET   1          3HE       MET   1  -9.226 -10.543  -9.976
   12    H    ALA   2           H        ALA   2  -6.504  -4.899 -11.309
   13    HA   ALA   2           HA       ALA   2  -6.768  -3.903  -8.597
   14   1HB   ALA   2          1HB       ALA   2  -4.635  -5.042  -9.217
   15   2HB   ALA   2          2HB       ALA   2  -4.361  -3.299  -8.859
   16   3HB   ALA   2          3HB       ALA   2  -4.402  -3.871 -10.569
   17    H    TYR   3           H        TYR   3  -6.573  -1.839  -7.960
   18    HA   TYR   3           HA       TYR   3  -7.030   0.152 -10.071
   19   1HB   TYR   3          2HB       TYR   3  -8.227   1.523  -8.792
   20   2HB   TYR   3          1HB       TYR   3  -8.892  -0.079  -8.327
   21    HD1  TYR   3           1HD      TYR   3  -7.905   2.978  -7.290
   22    HD2  TYR   3           2HD      TYR   3  -7.417  -1.088  -6.142
   23    HE1  TYR   3           1HE      TYR   3  -7.267   3.698  -5.024
   24    HE2  TYR   3           2HE      TYR   3  -6.873  -0.386  -3.877
   25    HH   TYR   3           HH       TYR   3  -6.348   1.337  -2.550
   26    H    SER   4           H        SER   4  -5.786   2.043 -10.037
   27    HA   SER   4           HA       SER   4  -3.358   1.846  -8.392
   28   1HB   SER   4          2HB       SER   4  -2.117   2.969 -10.236
   29   2HB   SER   4          1HB       SER   4  -2.676   1.318 -10.622
   30    HG   SER   4           HG       SER   4  -3.851   3.749 -11.504
   31    H    VAL   5           H        VAL   5  -2.739   3.685  -7.335
   32    HA   VAL   5           HA       VAL   5  -3.691   6.181  -8.336
   33    HB   VAL   5           HB       VAL   5  -5.466   6.090  -6.950
   34   1HG1  VAL   5          1HG1      VAL   5  -5.481   5.280  -4.640
   35   2HG1  VAL   5          2HG1      VAL   5  -3.796   4.635  -4.848
   36   3HG1  VAL   5          3HG1      VAL   5  -5.154   4.001  -5.871
   37   1HG2  VAL   5          1HG2      VAL   5  -5.071   7.672  -5.131
   38   2HG2  VAL   5          2HG2      VAL   5  -4.051   8.150  -6.544
   39   3HG2  VAL   5          3HG2      VAL   5  -3.308   7.326  -5.123
   40    H    THR   6           H        THR   6  -2.267   7.699  -8.159
   41    HA   THR   6           HA       THR   6   0.234   7.068  -6.741
   42    HB   THR   6           HB       THR   6  -0.301   8.958  -9.040
   43    HG1  THR   6           1HG      THR   6  -0.199   6.802  -9.652
   44   1HG2  THR   6          1HG2      THR   6   1.556   9.808  -7.539
   45   2HG2  THR   6          2HG2      THR   6   2.267   9.126  -9.039
   46   3HG2  THR   6          3HG2      THR   6   2.307   8.164  -7.525
   47    H    LEU   7           H        LEU   7   0.492   8.122  -4.882
   48    HA   LEU   7           HA       LEU   7  -1.422  10.195  -4.266
   49   1HB   LEU   7          2HB       LEU   7  -1.096   8.052  -2.963
   50   2HB   LEU   7          1HB       LEU   7   0.513   8.645  -2.481
   51    HG   LEU   7           HG       LEU   7  -0.536  10.552  -1.274
   52   1HD1  LEU   7          1HD1      LEU   7  -3.021  10.528  -0.836
   53   2HD1  LEU   7          2HD1      LEU   7  -3.223   9.242  -2.079
   54   3HD1  LEU   7          3HD1      LEU   7  -2.660  10.885  -2.561
   55   1HD2  LEU   7          1HD2      LEU   7  -1.568   9.111   0.547
   56   2HD2  LEU   7          2HD2      LEU   7  -0.023   8.438  -0.104
   57   3HD2  LEU   7          3HD2      LEU   7  -1.588   7.723  -0.615
   58    H    THR   8           H        THR   8  -0.869  12.094  -3.112
   59    HA   THR   8           HA       THR   8   1.384  13.340  -4.386
   60    HB   THR   8           HB       THR   8   0.077  15.437  -3.728
   61    HG1  THR   8           1HG      THR   8  -1.268  14.602  -2.142
   62   1HG2  THR   8          1HG2      THR   8  -1.580  15.061  -5.529
   63   2HG2  THR   8          2HG2      THR   8  -1.325  13.284  -5.451
   64   3HG2  THR   8          3HG2      THR   8   0.012  14.360  -5.997
   65    H    GLY   9           H        GLY   9   2.855  14.615  -3.405
   66   1HA   GLY   9          2HA       GLY   9   3.962  13.804  -1.203
   67   2HA   GLY   9          1HA       GLY   9   4.183  15.437  -1.880
   68    HA   PRO  10           HA       PRO  10   3.020  16.955   1.880
   69   1HB   PRO  10          2HB       PRO  10   0.886  18.732   1.779
   70   2HB   PRO  10          1HB       PRO  10   2.530  19.010   1.109
   71   1HG   PRO  10          2HG       PRO  10   0.057  17.971  -0.404
   72   2HG   PRO  10          1HG       PRO  10   1.176  19.322  -0.885
   73   1HD   PRO  10          2HD       PRO  10   1.485  16.775  -1.881
   74   2HD   PRO  10          1HD       PRO  10   2.954  17.748  -1.403
   75    H    GLY  11           H        GLY  11   2.579  15.648   3.431
   76   1HA   GLY  11          2HA       GLY  11   0.977  15.448   5.153
   77   2HA   GLY  11          1HA       GLY  11  -0.204  14.852   3.942
   78    HA   PRO  12           HA       PRO  12   2.404  11.215   5.154
   79   1HB   PRO  12          2HB       PRO  12   2.036  10.477   7.774
   80   2HB   PRO  12          1HB       PRO  12   3.229  11.740   7.293
   81   1HG   PRO  12          2HG       PRO  12   0.354  12.208   8.288
   82   2HG   PRO  12          1HG       PRO  12   1.882  12.955   8.913
   83   1HD   PRO  12          2HD       PRO  12   0.270  14.189   6.998
   84   2HD   PRO  12          1HD       PRO  12   2.085  14.357   6.974
   85    H    TRP  13           H        TRP  13   1.671   9.034   5.237
   86    HA   TRP  13           HA       TRP  13  -1.145   8.919   4.595
   87   1HB   TRP  13          2HB       TRP  13   0.517   6.493   4.103
   88   2HB   TRP  13          1HB       TRP  13  -0.619   7.258   3.063
   89    HD1  TRP  13           HD       TRP  13   2.901   6.598   3.731
   90    HE1  TRP  13           1HE      TRP  13   4.462   7.817   2.048
   91    HE3  TRP  13           3HE      TRP  13  -0.290  10.220   2.238
   92    HZ2  TRP  13           2HZ      TRP  13   4.321  10.086   0.412
   93    HZ3  TRP  13           3HZ      TRP  13   0.504  11.944   0.710
   94    HH2  TRP  13           HH       TRP  13   2.777  11.882  -0.208
   95    H    GLY  14           H        GLY  14  -2.639   7.965   5.939
   96   1HA   GLY  14          2HA       GLY  14  -1.582   6.672   8.332
   97   2HA   GLY  14          1HA       GLY  14  -3.152   7.481   8.075
   98    H    PHE  15           H        PHE  15  -1.327   4.631   6.953
   99    HA   PHE  15           HA       PHE  15  -3.816   3.080   7.021
  100   1HB   PHE  15          2HB       PHE  15  -2.920   1.882   5.023
  101   2HB   PHE  15          1HB       PHE  15  -2.888   3.630   4.760
  102    HD1  PHE  15           1HD      PHE  15  -0.852   4.868   4.877
  103    HD2  PHE  15           2HD      PHE  15  -0.766   0.645   5.324
  104    HE1  PHE  15           1HE      PHE  15   1.618   4.904   4.905
  105    HE2  PHE  15           2HE      PHE  15   1.647   0.665   5.071
  106    HZ   PHE  15           HZ       PHE  15   2.864   2.783   5.001
  107    H    ARG  16           H        ARG  16  -3.809   0.884   7.386
  108    HA   ARG  16           HA       ARG  16  -2.024   0.271   9.579
  109   1HB   ARG  16          2HB       ARG  16  -4.872  -0.548   8.845
  110   2HB   ARG  16          1HB       ARG  16  -3.959  -1.492  10.051
  111   1HG   ARG  16          2HG       ARG  16  -4.408   1.544  10.305
  112   2HG   ARG  16          1HG       ARG  16  -5.601   0.339  10.874
  113   1HD   ARG  16          2HD       ARG  16  -3.974  -0.662  12.443
  114   2HD   ARG  16          1HD       ARG  16  -2.676   0.451  11.840
  115    HE   ARG  16           HE       ARG  16  -5.080   1.914  12.751
  116   1HH1  ARG  16          1HH1      ARG  16  -2.126   0.362  14.015
  117   2HH1  ARG  16          2HH1      ARG  16  -1.837   1.663  15.140
  118   1HH2  ARG  16          1HH2      ARG  16  -4.919   3.264  14.398
  119   2HH2  ARG  16          2HH2      ARG  16  -3.641   3.136  15.606
  120    H    LEU  17           H        LEU  17  -0.657  -1.520   9.388
  121    HA   LEU  17           HA       LEU  17  -0.783  -2.779   6.787
  122   1HB   LEU  17          2HB       LEU  17   1.477  -2.533   8.847
  123   2HB   LEU  17          1HB       LEU  17   1.603  -3.393   7.284
  124    HG   LEU  17           HG       LEU  17   0.935  -1.151   6.171
  125   1HD1  LEU  17          1HD1      LEU  17   1.859   0.848   7.587
  126   2HD1  LEU  17          2HD1      LEU  17   1.706  -0.252   9.015
  127   3HD1  LEU  17          3HD1      LEU  17   0.241   0.206   8.047
  128   1HD2  LEU  17          1HD2      LEU  17   3.206  -2.219   6.038
  129   2HD2  LEU  17          2HD2      LEU  17   3.660  -1.430   7.596
  130   3HD2  LEU  17          3HD2      LEU  17   3.288  -0.421   6.137
  131    H    GLN  18           H        GLN  18  -1.140  -5.021   6.551
  132    HA   GLN  18           HA       GLN  18  -0.563  -6.670   8.858
  133   1HB   GLN  18          2HB       GLN  18  -3.313  -6.670   7.537
  134   2HB   GLN  18          1HB       GLN  18  -2.671  -7.959   8.598
  135   1HG   GLN  18          2HG       GLN  18  -2.329  -6.130  10.400
  136   2HG   GLN  18          1HG       GLN  18  -3.393  -5.075   9.433
  137   1HE2  GLN  18          1HE2      GLN  18  -5.715  -5.598   9.464
  138   2HE2  GLN  18          2HE2      GLN  18  -6.323  -6.804  10.555
  139    H    GLY  19           H        GLY  19   0.377  -8.488   8.386
  140   1HA   GLY  19          2HA       GLY  19   0.896 -10.342   7.272
  141   2HA   GLY  19          1HA       GLY  19  -0.044  -9.826   5.842
  142    H    GLY  20           H        GLY  20   2.367 -11.038   5.330
  143   1HA   GLY  20          2HA       GLY  20   3.581  -9.105   3.823
  144   2HA   GLY  20          1HA       GLY  20   4.516  -9.249   5.356
  145    H    LYS  21           H        LYS  21   5.581  -9.639   2.887
  146    HA   LYS  21           HA       LYS  21   5.472 -12.072   1.777
  147   1HB   LYS  21          2HB       LYS  21   6.735  -9.717   1.219
  148   2HB   LYS  21          1HB       LYS  21   8.152 -10.718   1.636
  149   1HG   LYS  21          2HG       LYS  21   7.855 -10.956  -0.719
  150   2HG   LYS  21          1HG       LYS  21   7.190 -12.462  -0.035
  151   1HD   LYS  21          2HD       LYS  21   4.897 -10.895  -0.053
  152   2HD   LYS  21          1HD       LYS  21   5.831 -10.047  -1.304
  153   1HE   LYS  21          2HE       LYS  21   4.383 -11.655  -2.418
  154   2HE   LYS  21          1HE       LYS  21   6.066 -12.298  -2.557
  155   1HZ   LYS  21          1HZ       LYS  21   5.615 -13.846  -0.814
  156   2HZ   LYS  21          2HZ       LYS  21   4.254 -13.908  -1.806
  157   3HZ   LYS  21          3HZ       LYS  21   4.213 -13.073  -0.347
  158    H    ASP  22           H        ASP  22   7.811 -11.228   4.375
  159    HA   ASP  22           HA       ASP  22   9.063 -13.750   3.989
  160   1HB   ASP  22          2HB       ASP  22  10.765 -13.050   5.340
  161   2HB   ASP  22          1HB       ASP  22  10.194 -11.540   4.582
  162    H    PHE  23           H        PHE  23   6.212 -13.063   5.332
  163    HA   PHE  23           HA       PHE  23   6.305 -15.363   7.146
  164   1HB   PHE  23          2HB       PHE  23   4.927 -12.719   7.128
  165   2HB   PHE  23          1HB       PHE  23   3.749 -14.046   7.334
  166    HD1  PHE  23           1HD      PHE  23   3.399 -14.847   9.440
  167    HD2  PHE  23           2HD      PHE  23   7.107 -12.948   8.591
  168    HE1  PHE  23           1HE      PHE  23   4.017 -14.991  11.806
  169    HE2  PHE  23           2HE      PHE  23   7.729 -13.101  10.949
  170    HZ   PHE  23           HZ       PHE  23   6.185 -14.119  12.562
  171    H    ASN  24           H        ASN  24   5.976 -14.912   4.045
  172    HA   ASN  24           HA       ASN  24   5.368 -16.168   2.476
  173   1HB   ASN  24          2HB       ASN  24   5.385 -18.058   4.222
  174   2HB   ASN  24          1HB       ASN  24   3.599 -17.925   4.221
  175   1HD2  ASN  24          1HD2      ASN  24   6.438 -18.276   1.979
  176   2HD2  ASN  24          2HD2      ASN  24   5.617 -19.295   0.836
  177    H    MET  25           H        MET  25   3.604 -13.946   3.753
  178    HA   MET  25           HA       MET  25   1.140 -14.465   2.332
  179   1HB   MET  25          2HB       MET  25   2.020 -13.023   4.670
  180   2HB   MET  25          1HB       MET  25   1.157 -11.871   3.622
  181   1HG   MET  25          2HG       MET  25  -0.863 -13.156   3.708
  182   2HG   MET  25          1HG       MET  25  -0.016 -14.606   4.345
  183   1HE   MET  25          1HE       MET  25  -2.541 -13.883   7.016
  184   2HE   MET  25          2HE       MET  25  -1.739 -15.064   5.936
  185   3HE   MET  25          3HE       MET  25  -2.650 -13.689   5.234
  186    HA   PRO  26           HA       PRO  26   2.395 -11.259  -0.590
  187   1HB   PRO  26          2HB       PRO  26  -0.038  -9.986  -1.142
  188   2HB   PRO  26          1HB       PRO  26   0.473 -11.548  -1.860
  189   1HG   PRO  26          2HG       PRO  26  -1.653 -11.102   0.174
  190   2HG   PRO  26          1HG       PRO  26  -1.329 -12.529  -0.862
  191   1HD   PRO  26          2HD       PRO  26  -0.516 -11.799   1.903
  192   2HD   PRO  26          1HD       PRO  26  -0.432 -13.483   1.262
  193    H    LEU  27           H        LEU  27   2.697  -8.839  -0.714
  194    HA   LEU  27           HA       LEU  27   2.582  -7.416   1.644
  195   1HB   LEU  27          2HB       LEU  27   3.825  -7.141  -0.632
  196   2HB   LEU  27          1HB       LEU  27   2.349  -6.344  -1.235
  197    HG   LEU  27           HG       LEU  27   4.146  -5.607   1.107
  198   1HD1  LEU  27          1HD1      LEU  27   3.652  -4.116  -1.556
  199   2HD1  LEU  27          2HD1      LEU  27   5.091  -5.149  -1.175
  200   3HD1  LEU  27          3HD1      LEU  27   4.809  -3.606  -0.284
  201   1HD2  LEU  27          1HD2      LEU  27   2.881  -3.364   1.214
  202   2HD2  LEU  27          2HD2      LEU  27   1.904  -4.765   1.750
  203   3HD2  LEU  27          3HD2      LEU  27   1.652  -4.067   0.100
  204    H    THR  28           H        THR  28   0.644  -7.219   2.737
  205    HA   THR  28           HA       THR  28  -1.499  -5.999   1.156
  206    HB   THR  28           HB       THR  28  -3.093  -7.294   1.580
  207    HG1  THR  28           1HG      THR  28  -2.044  -7.769   4.185
  208   1HG2  THR  28          1HG2      THR  28  -0.985  -9.270   2.592
  209   2HG2  THR  28          2HG2      THR  28  -1.339  -8.881   0.856
  210   3HG2  THR  28          3HG2      THR  28  -2.617  -9.629   1.894
  211    H    ILE  29           H        ILE  29  -2.974  -4.772   2.113
  212    HA   ILE  29           HA       ILE  29  -2.036  -3.417   4.567
  213    HB   ILE  29           HB       ILE  29  -3.260  -2.057   2.189
  214   1HG1  ILE  29          2HG1      ILE  29  -0.411  -2.328   3.264
  215   2HG1  ILE  29          1HG1      ILE  29  -1.007  -2.677   1.610
  216   1HG2  ILE  29          1HG2      ILE  29  -2.251  -1.106   4.964
  217   2HG2  ILE  29          2HG2      ILE  29  -3.957  -1.038   4.345
  218   3HG2  ILE  29          3HG2      ILE  29  -2.724  -0.004   3.632
  219   1HD1  ILE  29          1HD1      ILE  29  -1.475  -0.223   1.276
  220   2HD1  ILE  29          2HD1      ILE  29   0.269  -0.592   1.586
  221   3HD1  ILE  29          3HD1      ILE  29  -0.747   0.109   2.896
  222    H    SER  30           H        SER  30  -3.826  -2.666   5.916
  223    HA   SER  30           HA       SER  30  -6.163  -4.400   5.565
  224   1HB   SER  30          2HB       SER  30  -4.734  -4.858   7.500
  225   2HB   SER  30          1HB       SER  30  -4.955  -3.189   8.098
  226    HG   SER  30           HG       SER  30  -7.000  -5.136   7.673
  227    H    ARG  31           H        ARG  31  -5.605  -1.204   7.238
  228    HA   ARG  31           HA       ARG  31  -8.121  -0.344   6.032
  229   1HB   ARG  31          2HB       ARG  31  -8.179  -1.497   8.461
  230   2HB   ARG  31          1HB       ARG  31  -7.579   0.087   8.996
  231   1HG   ARG  31          2HG       ARG  31  -9.681   1.074   7.738
  232   2HG   ARG  31          1HG       ARG  31 -10.205  -0.632   7.582
  233   1HD   ARG  31          2HD       ARG  31  -9.973  -0.749  10.199
  234   2HD   ARG  31          1HD       ARG  31  -9.751   1.032  10.142
  235    HE   ARG  31           HE       ARG  31 -12.028   1.293   9.348
  236   1HH1  ARG  31          1HH1      ARG  31 -11.336  -2.200   9.962
  237   2HH1  ARG  31          2HH1      ARG  31 -12.984  -2.633   9.682
  238   1HH2  ARG  31          1HH2      ARG  31 -14.158   0.655   9.215
  239   2HH2  ARG  31          2HH2      ARG  31 -14.612  -0.999   9.432
  240    H    ILE  32           H        ILE  32  -8.519   1.987   6.369
  241    HA   ILE  32           HA       ILE  32  -6.098   3.597   6.558
  242    HB   ILE  32           HB       ILE  32  -8.925   3.950   5.521
  243   1HG1  ILE  32          2HG1      ILE  32  -7.889   4.959   3.565
  244   2HG1  ILE  32          1HG1      ILE  32  -6.255   4.702   4.147
  245   1HG2  ILE  32          1HG2      ILE  32  -6.860   6.149   6.130
  246   2HG2  ILE  32          2HG2      ILE  32  -8.561   6.012   6.798
  247   3HG2  ILE  32          3HG2      ILE  32  -8.311   6.338   5.061
  248   1HD1  ILE  32          1HD1      ILE  32  -6.914   2.105   4.070
  249   2HD1  ILE  32          2HD1      ILE  32  -6.700   3.000   2.527
  250   3HD1  ILE  32          3HD1      ILE  32  -8.371   2.690   3.156
  251    H    THR  33           H        THR  33  -5.961   5.152   8.287
  252    HA   THR  33           HA       THR  33  -7.806   4.853  10.430
  253    HB   THR  33           HB       THR  33  -5.721   7.008  10.080
  254    HG1  THR  33           1HG      THR  33  -4.672   5.813  11.568
  255   1HG2  THR  33          1HG2      THR  33  -6.080   7.246  12.586
  256   2HG2  THR  33          2HG2      THR  33  -7.434   6.055  12.493
  257   3HG2  THR  33          3HG2      THR  33  -7.589   7.653  11.712
  258    HA   PRO  34           HA       PRO  34 -10.701   7.858   8.796
  259   1HB   PRO  34          2HB       PRO  34 -10.727   8.173  11.882
  260   2HB   PRO  34          1HB       PRO  34 -12.134   8.453  10.780
  261   1HG   PRO  34          2HG       PRO  34 -11.866   6.005  11.966
  262   2HG   PRO  34          1HG       PRO  34 -12.138   6.033  10.168
  263   1HD   PRO  34          2HD       PRO  34  -9.507   5.648  11.679
  264   2HD   PRO  34          1HD       PRO  34 -10.063   4.876  10.139
  265    H    GLY  35           H        GLY  35 -10.696   9.913   8.133
  266   1HA   GLY  35          2HA       GLY  35 -10.409  12.101   8.161
  267   2HA   GLY  35          1HA       GLY  35  -9.648  11.990   9.778
  268    H    SER  36           H        SER  36  -7.885   9.963   7.914
  269    HA   SER  36           HA       SER  36  -5.777  11.900   7.781
  270   1HB   SER  36          2HB       SER  36  -4.288  10.026   7.465
  271   2HB   SER  36          1HB       SER  36  -5.450   9.646   8.758
  272    HG   SER  36           HG       SER  36  -6.399   8.203   7.516
  273    H    LYS  37           H        LYS  37  -4.111  11.378   5.830
  274    HA   LYS  37           HA       LYS  37  -5.308  12.358   3.485
  275   1HB   LYS  37          2HB       LYS  37  -2.570  11.122   4.085
  276   2HB   LYS  37          1HB       LYS  37  -3.043  11.691   2.463
  277   1HG   LYS  37          2HG       LYS  37  -1.721  13.342   3.391
  278   2HG   LYS  37          1HG       LYS  37  -3.371  13.999   3.296
  279   1HD   LYS  37          2HD       LYS  37  -2.599  12.701   5.919
  280   2HD   LYS  37          1HD       LYS  37  -1.625  14.114   5.499
  281   1HE   LYS  37          2HE       LYS  37  -4.717  14.224   5.569
  282   2HE   LYS  37          1HE       LYS  37  -3.629  14.603   6.963
  283   1HZ   LYS  37          1HZ       LYS  37  -2.530  16.251   5.536
  284   2HZ   LYS  37          2HZ       LYS  37  -4.105  16.594   5.918
  285   3HZ   LYS  37          3HZ       LYS  37  -3.733  16.054   4.349
  286    H    ALA  38           H        ALA  38  -4.619   9.182   4.696
  287    HA   ALA  38           HA       ALA  38  -4.955   7.654   2.305
  288   1HB   ALA  38          1HB       ALA  38  -5.089   6.812   5.218
  289   2HB   ALA  38          2HB       ALA  38  -3.570   7.036   4.269
  290   3HB   ALA  38          3HB       ALA  38  -4.735   5.811   3.743
  291    H    ALA  39           H        ALA  39  -7.156   9.109   4.626
  292    HA   ALA  39           HA       ALA  39  -9.369   7.614   3.538
  293   1HB   ALA  39          1HB       ALA  39  -9.127   8.195   6.027
  294   2HB   ALA  39          2HB       ALA  39 -10.660   8.788   5.303
  295   3HB   ALA  39          3HB       ALA  39  -9.289   9.929   5.589
  296    H    GLN  40           H        GLN  40  -8.113  10.934   3.473
  297    HA   GLN  40           HA       GLN  40 -10.388  12.089   2.419
  298   1HB   GLN  40          2HB       GLN  40  -7.507  12.907   2.766
  299   2HB   GLN  40          1HB       GLN  40  -8.520  13.899   1.703
  300   1HG   GLN  40          2HG       GLN  40 -10.275  13.898   3.688
  301   2HG   GLN  40          1HG       GLN  40  -8.902  13.336   4.699
  302   1HE2  GLN  40          1HE2      GLN  40  -9.514  15.811   2.098
  303   2HE2  GLN  40          2HE2      GLN  40  -8.804  17.137   2.985
  304    H    SER  41           H        SER  41  -7.641  10.762   0.600
  305    HA   SER  41           HA       SER  41  -8.561  12.292  -1.703
  306   1HB   SER  41          2HB       SER  41  -6.273  12.464  -0.931
  307   2HB   SER  41          1HB       SER  41  -5.988  10.730  -1.281
  308    HG   SER  41           HG       SER  41  -5.472  12.503  -2.956
  309    H    GLN  42           H        GLN  42  -7.144  10.242  -3.482
  310    HA   GLN  42           HA       GLN  42  -9.524   8.680  -4.060
  311   1HB   GLN  42          2HB       GLN  42  -6.861   9.025  -5.534
  312   2HB   GLN  42          1HB       GLN  42  -8.258   8.078  -6.129
  313   1HG   GLN  42          2HG       GLN  42  -9.663  10.171  -6.158
  314   2HG   GLN  42          1HG       GLN  42  -8.231  11.133  -5.653
  315   1HE2  GLN  42          1HE2      GLN  42  -6.406  11.294  -7.161
  316   2HE2  GLN  42          2HE2      GLN  42  -6.631  10.936  -8.854
  317    H    LEU  43           H        LEU  43  -7.192   8.323  -1.911
  318    HA   LEU  43           HA       LEU  43  -6.111   5.796  -2.632
  319   1HB   LEU  43          2HB       LEU  43  -5.094   7.833  -1.251
  320   2HB   LEU  43          1HB       LEU  43  -5.933   7.085   0.131
  321    HG   LEU  43           HG       LEU  43  -4.677   4.877  -0.626
  322   1HD1  LEU  43          1HD1      LEU  43  -2.999   6.997  -2.106
  323   2HD1  LEU  43          2HD1      LEU  43  -3.972   5.714  -2.885
  324   3HD1  LEU  43          3HD1      LEU  43  -2.555   5.265  -1.870
  325   1HD2  LEU  43          1HD2      LEU  43  -2.469   5.821   0.506
  326   2HD2  LEU  43          2HD2      LEU  43  -3.962   5.726   1.465
  327   3HD2  LEU  43          3HD2      LEU  43  -3.433   7.306   0.753
  328    H    SER  44           H        SER  44  -6.573   3.796  -1.938
  329    HA   SER  44           HA       SER  44  -7.898   3.506   0.631
  330   1HB   SER  44          2HB       SER  44  -8.655   1.850  -1.853
  331   2HB   SER  44          1HB       SER  44  -9.195   1.539  -0.168
  332    HG   SER  44           HG       SER  44  -9.738   3.838  -1.738
  333    H    GLN  45           H        GLN  45  -5.108   3.311   0.677
  334    HA   GLN  45           HA       GLN  45  -4.150   0.829   0.149
  335   1HB   GLN  45          2HB       GLN  45  -3.824   2.825   2.465
  336   2HB   GLN  45          1HB       GLN  45  -2.753   1.410   2.249
  337   1HG   GLN  45          2HG       GLN  45  -2.157   2.117   0.003
  338   2HG   GLN  45          1HG       GLN  45  -3.106   3.631   0.134
  339   1HE2  GLN  45          2HE2      GLN  45  -0.211   2.916  -0.019
  340   2HE2  GLN  45          1HE2      GLN  45   0.662   3.807   1.262
  341    H    GLY  46           H        GLY  46  -5.384  -0.965   0.522
  342   1HA   GLY  46          2HA       GLY  46  -5.507  -2.119   3.017
  343   2HA   GLY  46          1HA       GLY  46  -7.013  -1.169   2.826
  344    H    ASP  47           H        ASP  47  -4.928  -3.152   0.693
  345    HA   ASP  47           HA       ASP  47  -6.694  -5.268   0.548
  346   1HB   ASP  47          2HB       ASP  47  -7.345  -3.135  -1.207
  347   2HB   ASP  47          1HB       ASP  47  -6.389  -4.161  -2.274
  348    H    LEU  48           H        LEU  48  -5.487  -6.648  -1.726
  349    HA   LEU  48           HA       LEU  48  -2.868  -6.885  -0.687
  350   1HB   LEU  48          2HB       LEU  48  -4.740  -8.560  -0.912
  351   2HB   LEU  48          1HB       LEU  48  -4.663  -8.376  -2.676
  352    HG   LEU  48           HG       LEU  48  -2.359  -9.457  -0.919
  353   1HD1  LEU  48          1HD1      LEU  48  -4.579 -10.857  -2.524
  354   2HD1  LEU  48          2HD1      LEU  48  -4.340 -10.866  -0.731
  355   3HD1  LEU  48          3HD1      LEU  48  -3.139 -11.687  -1.785
  356   1HD2  LEU  48          1HD2      LEU  48  -1.449  -8.584  -2.951
  357   2HD2  LEU  48          2HD2      LEU  48  -2.877  -9.125  -3.920
  358   3HD2  LEU  48          3HD2      LEU  48  -1.673 -10.354  -3.296
  359    H    VAL  49           H        VAL  49  -1.061  -6.080  -1.675
  360    HA   VAL  49           HA       VAL  49  -1.525  -4.318  -3.826
  361    HB   VAL  49           HB       VAL  49   0.848  -4.758  -2.005
  362   1HG1  VAL  49          1HG1      VAL  49   1.240  -2.327  -2.495
  363   2HG1  VAL  49          2HG1      VAL  49  -0.095  -2.350  -3.708
  364   3HG1  VAL  49          3HG1      VAL  49   1.401  -3.336  -3.988
  365   1HG2  VAL  49          1HG2      VAL  49  -1.672  -3.004  -1.670
  366   2HG2  VAL  49          2HG2      VAL  49  -0.161  -2.834  -0.712
  367   3HG2  VAL  49          3HG2      VAL  49  -1.125  -4.336  -0.582
  368    H    VAL  50           H        VAL  50  -0.596  -4.429  -5.859
  369    HA   VAL  50           HA       VAL  50   0.786  -6.875  -6.540
  370    HB   VAL  50           HB       VAL  50   0.090  -4.700  -8.531
  371   1HG1  VAL  50          1HG1      VAL  50   1.510  -6.673  -9.216
  372   2HG1  VAL  50          2HG1      VAL  50  -0.114  -6.701  -9.994
  373   3HG1  VAL  50          3HG1      VAL  50   0.235  -7.787  -8.601
  374   1HG2  VAL  50          1HG2      VAL  50  -1.986  -4.861  -7.414
  375   2HG2  VAL  50          2HG2      VAL  50  -1.861  -6.672  -7.231
  376   3HG2  VAL  50          3HG2      VAL  50  -2.092  -5.914  -8.860
  377    H    ALA  51           H        ALA  51   1.141  -3.363  -6.956
  378    HA   ALA  51           HA       ALA  51   4.041  -3.673  -7.057
  379   1HB   ALA  51          1HB       ALA  51   4.169  -2.032  -8.938
  380   2HB   ALA  51          2HB       ALA  51   2.367  -1.963  -8.994
  381   3HB   ALA  51          3HB       ALA  51   3.225  -3.485  -9.422
  382    H    ILE  52           H        ILE  52   5.238  -2.081  -6.236
  383    HA   ILE  52           HA       ILE  52   3.900   0.191  -5.005
  384    HB   ILE  52           HB       ILE  52   4.565  -1.987  -3.651
  385   1HG1  ILE  52          2HG1      ILE  52   3.328  -0.059  -2.772
  386   2HG1  ILE  52          1HG1      ILE  52   4.511  -0.710  -1.606
  387   1HG2  ILE  52          1HG2      ILE  52   6.950  -1.973  -4.166
  388   2HG2  ILE  52          2HG2      ILE  52   6.669  -1.746  -2.401
  389   3HG2  ILE  52          3HG2      ILE  52   7.149  -0.342  -3.426
  390   1HD1  ILE  52          1HD1      ILE  52   4.891   1.866  -3.279
  391   2HD1  ILE  52          2HD1      ILE  52   6.092   1.178  -2.121
  392   3HD1  ILE  52          3HD1      ILE  52   4.507   1.765  -1.529
  393    H    ASP  53           H        ASP  53   4.922   2.048  -5.554
  394    HA   ASP  53           HA       ASP  53   6.275   3.412  -6.504
  395   1HB   ASP  53          2HB       ASP  53   7.898   2.312  -4.776
  396   2HB   ASP  53          1HB       ASP  53   8.628   1.488  -6.190
  397    H    GLY  54           H        GLY  54   5.080   1.004  -7.898
  398   1HA   GLY  54          2HA       GLY  54   4.702   0.617 -10.100
  399   2HA   GLY  54          1HA       GLY  54   6.209   1.488 -10.536
  400    H    VAL  55           H        VAL  55   6.730  -0.781  -7.980
  401    HA   VAL  55           HA       VAL  55   7.866  -2.629  -9.934
  402    HB   VAL  55           HB       VAL  55   8.923  -1.835  -7.201
  403   1HG1  VAL  55          1HG1      VAL  55   9.575  -4.162  -7.975
  404   2HG1  VAL  55          2HG1      VAL  55  10.978  -3.036  -7.987
  405   3HG1  VAL  55          3HG1      VAL  55  10.162  -3.458  -9.533
  406   1HG2  VAL  55          1HG2      VAL  55   9.141   0.117  -8.697
  407   2HG2  VAL  55          2HG2      VAL  55   9.778  -0.926 -10.026
  408   3HG2  VAL  55          3HG2      VAL  55  10.742  -0.674  -8.523
  409    H    ASN  56           H        ASN  56   7.463  -4.841  -9.539
  410    HA   ASN  56           HA       ASN  56   5.196  -5.191  -7.906
  411   1HB   ASN  56          2HB       ASN  56   4.785  -7.160  -8.912
  412   2HB   ASN  56          1HB       ASN  56   5.664  -6.267 -10.192
  413   1HD2  ASN  56          1HD2      ASN  56   8.057  -6.883 -10.466
  414   2HD2  ASN  56          2HD2      ASN  56   8.507  -8.526 -10.063
  415    H    THR  57           H        THR  57   4.769  -6.636  -6.239
  416    HA   THR  57           HA       THR  57   6.525  -6.140  -4.204
  417    HB   THR  57           HB       THR  57   4.654  -7.163  -2.839
  418    HG1  THR  57           1HG      THR  57   2.761  -7.326  -4.310
  419   1HG2  THR  57          1HG2      THR  57   3.101  -5.318  -3.453
  420   2HG2  THR  57          2HG2      THR  57   3.966  -5.051  -5.010
  421   3HG2  THR  57          3HG2      THR  57   4.811  -4.741  -3.465
  422    H    ASP  58           H        ASP  58   6.909  -8.728  -6.122
  423    HA   ASP  58           HA       ASP  58   7.026 -10.960  -4.717
  424   1HB   ASP  58          2HB       ASP  58   7.592 -10.459  -7.131
  425   2HB   ASP  58          1HB       ASP  58   9.239  -9.990  -6.606
  426    H    THR  59           H        THR  59   9.638  -8.520  -4.488
  427    HA   THR  59           HA       THR  59  10.675 -10.082  -2.229
  428    HB   THR  59           HB       THR  59  12.110  -9.915  -4.235
  429    HG1  THR  59           1HG      THR  59  13.739  -9.915  -3.024
  430   1HG2  THR  59          1HG2      THR  59  12.221  -6.908  -3.486
  431   2HG2  THR  59          2HG2      THR  59  11.500  -7.605  -4.981
  432   3HG2  THR  59          3HG2      THR  59  13.272  -7.745  -4.680
  433    H    MET  60           H        MET  60   8.516  -7.855  -2.307
  434    HA   MET  60           HA       MET  60   9.815  -5.899  -0.612
  435   1HB   MET  60          2HB       MET  60   7.269  -6.227  -2.202
  436   2HB   MET  60          1HB       MET  60   7.306  -5.013  -0.878
  437   1HG   MET  60          2HG       MET  60   7.765  -3.855  -2.881
  438   2HG   MET  60          1HG       MET  60   9.288  -3.920  -1.934
  439   1HE   MET  60          1HE       MET  60  10.206  -3.638  -5.699
  440   2HE   MET  60          2HE       MET  60   9.898  -2.799  -4.148
  441   3HE   MET  60          3HE       MET  60   8.520  -3.278  -5.204
  442    H    THR  61           H        THR  61  10.096  -6.847   1.383
  443    HA   THR  61           HA       THR  61   8.087  -8.373   2.658
  444    HB   THR  61           HB       THR  61   9.569  -8.271   4.616
  445    HG1  THR  61           1HG      THR  61  11.610  -7.155   4.125
  446   1HG2  THR  61          1HG2      THR  61  10.048  -9.862   2.704
  447   2HG2  THR  61          2HG2      THR  61  11.534  -9.336   3.562
  448   3HG2  THR  61          3HG2      THR  61  11.122  -8.624   1.964
  449    H    HIS  62           H        HIS  62   7.433  -7.700   5.033
  450    HA   HIS  62           HA       HIS  62   5.906  -5.419   4.996
  451   1HB   HIS  62          2HB       HIS  62   5.584  -7.327   6.530
  452   2HB   HIS  62          1HB       HIS  62   7.126  -6.958   7.349
  453    HD1  HIS  62           1HD      HIS  62   3.654  -5.306   6.811
  454    HD2  HIS  62           2HD      HIS  62   6.804  -5.437   9.590
  455    HE1  HIS  62           1HE      HIS  62   2.886  -4.114   8.929
  456    H    LEU  63           H        LEU  63   9.206  -5.845   6.277
  457    HA   LEU  63           HA       LEU  63   9.594  -3.242   7.224
  458   1HB   LEU  63          2HB       LEU  63  11.044  -5.204   7.752
  459   2HB   LEU  63          1HB       LEU  63  11.523  -5.303   6.039
  460    HG   LEU  63           HG       LEU  63  12.507  -2.951   6.246
  461   1HD1  LEU  63          1HD1      LEU  63  11.299  -2.163   8.305
  462   2HD1  LEU  63          2HD1      LEU  63  13.081  -2.159   8.557
  463   3HD1  LEU  63          3HD1      LEU  63  12.080  -3.478   9.266
  464   1HD2  LEU  63          1HD2      LEU  63  13.856  -4.974   6.207
  465   2HD2  LEU  63          2HD2      LEU  63  13.652  -5.197   7.994
  466   3HD2  LEU  63          3HD2      LEU  63  14.566  -3.770   7.351
  467    H    GLU  64           H        GLU  64  10.365  -4.691   3.976
  468    HA   GLU  64           HA       GLU  64  11.356  -2.330   3.010
  469   1HB   GLU  64          2HB       GLU  64  11.218  -4.907   2.105
  470   2HB   GLU  64          1HB       GLU  64  10.082  -4.137   0.956
  471   1HG   GLU  64          2HG       GLU  64  11.806  -2.571   0.207
  472   2HG   GLU  64          1HG       GLU  64  12.793  -2.890   1.685
  473    H    ALA  65           H        ALA  65   8.032  -3.645   2.600
  474    HA   ALA  65           HA       ALA  65   7.035  -1.613   1.048
  475   1HB   ALA  65          1HB       ALA  65   6.095  -3.884   1.508
  476   2HB   ALA  65          2HB       ALA  65   4.854  -2.585   1.772
  477   3HB   ALA  65          3HB       ALA  65   5.673  -3.382   3.179
  478    H    GLN  66           H        GLN  66   7.088  -1.847   4.594
  479    HA   GLN  66           HA       GLN  66   5.825   0.503   5.250
  480   1HB   GLN  66          2HB       GLN  66   6.497  -1.361   6.790
  481   2HB   GLN  66          1HB       GLN  66   8.190  -1.060   6.408
  482   1HG   GLN  66          2HG       GLN  66   8.210  -0.121   8.403
  483   2HG   GLN  66          1HG       GLN  66   7.693   1.374   7.566
  484   1HE2  GLN  66          1HE2      GLN  66   5.083   1.410   7.346
  485   2HE2  GLN  66          2HE2      GLN  66   4.229   0.934   8.804
  486    H    ASN  67           H        ASN  67   9.286  -0.059   4.588
  487    HA   ASN  67           HA       ASN  67  10.057   2.624   4.812
  488   1HB   ASN  67          2HB       ASN  67  11.256   0.074   3.633
  489   2HB   ASN  67          1HB       ASN  67  12.040   1.640   3.247
  490   1HD2  ASN  67          1HD2      ASN  67  11.760  -0.813   5.681
  491   2HD2  ASN  67          2HD2      ASN  67  12.917  -0.024   6.737
  492    H    LYS  68           H        LYS  68   9.111   0.784   1.878
  493    HA   LYS  68           HA       LYS  68   9.747   2.769   0.079
  494   1HB   LYS  68          2HB       LYS  68   7.529   0.669  -0.022
  495   2HB   LYS  68          1HB       LYS  68   8.084   1.634  -1.433
  496   1HG   LYS  68          2HG       LYS  68   9.923  -0.284   0.108
  497   2HG   LYS  68          1HG       LYS  68   8.897  -0.755  -1.270
  498   1HD   LYS  68          2HD       LYS  68  10.102   0.862  -2.723
  499   2HD   LYS  68          1HD       LYS  68  11.134   1.364  -1.343
  500   1HE   LYS  68          2HE       LYS  68  12.032  -0.949  -1.099
  501   2HE   LYS  68          1HE       LYS  68  10.887  -1.543  -2.356
  502   1HZ   LYS  68          1HZ       LYS  68  12.029   0.082  -3.894
  503   2HZ   LYS  68          2HZ       LYS  68  12.946  -1.261  -3.399
  504   3HZ   LYS  68          3HZ       LYS  68  13.240   0.243  -2.733
  505    H    ILE  69           H        ILE  69   6.471   2.144   1.568
  506    HA   ILE  69           HA       ILE  69   5.305   4.404   0.597
  507    HB   ILE  69           HB       ILE  69   4.856   2.759   3.094
  508   1HG1  ILE  69          2HG1      ILE  69   3.371   2.946   0.408
  509   2HG1  ILE  69          1HG1      ILE  69   4.534   1.676   0.748
  510   1HG2  ILE  69          1HG2      ILE  69   3.803   4.816   3.608
  511   2HG2  ILE  69          2HG2      ILE  69   2.464   3.941   2.779
  512   3HG2  ILE  69          3HG2      ILE  69   3.390   5.176   1.875
  513   1HD1  ILE  69          1HD1      ILE  69   3.217   0.893   2.746
  514   2HD1  ILE  69          2HD1      ILE  69   2.358   0.720   1.168
  515   3HD1  ILE  69          3HD1      ILE  69   1.905   2.042   2.299
  516    H    LYS  70           H        LYS  70   6.995   4.143   3.808
  517    HA   LYS  70           HA       LYS  70   6.367   6.866   4.305
  518   1HB   LYS  70          2HB       LYS  70   7.608   4.577   5.730
  519   2HB   LYS  70          1HB       LYS  70   8.281   6.148   6.200
  520   1HG   LYS  70          2HG       LYS  70   6.486   5.484   7.675
  521   2HG   LYS  70          1HG       LYS  70   6.165   7.042   6.857
  522   1HD   LYS  70          2HD       LYS  70   4.531   6.000   5.358
  523   2HD   LYS  70          1HD       LYS  70   4.995   4.364   5.897
  524   1HE   LYS  70          2HE       LYS  70   2.801   5.164   6.861
  525   2HE   LYS  70          1HE       LYS  70   4.011   4.732   8.131
  526   1HZ   LYS  70          1HZ       LYS  70   3.734   7.542   7.184
  527   2HZ   LYS  70          2HZ       LYS  70   4.391   6.944   8.618
  528   3HZ   LYS  70          3HZ       LYS  70   2.747   6.915   8.400
  529    H    SER  71           H        SER  71   8.711   5.790   2.194
  530    HA   SER  71           HA       SER  71  10.458   8.041   2.975
  531   1HB   SER  71          2HB       SER  71  11.163   5.708   1.127
  532   2HB   SER  71          1HB       SER  71  12.253   7.020   1.698
  533    HG   SER  71           HG       SER  71  11.048   4.920   3.091
  534    H    ALA  72           H        ALA  72   7.995   7.195   0.898
  535    HA   ALA  72           HA       ALA  72   8.977   8.724  -1.368
  536   1HB   ALA  72          1HB       ALA  72   7.812   6.505  -1.651
  537   2HB   ALA  72          2HB       ALA  72   6.913   7.837  -2.473
  538   3HB   ALA  72          3HB       ALA  72   6.360   7.199  -0.865
  539    H    SER  73           H        SER  73   7.755  10.475  -2.260
  540    HA   SER  73           HA       SER  73   5.644  11.609  -0.707
  541   1HB   SER  73          2HB       SER  73   6.688  13.814  -0.292
  542   2HB   SER  73          1HB       SER  73   7.446  12.490   0.649
  543    HG   SER  73           HG       SER  73   9.051  13.722  -0.218
  544    H    TYR  74           H        TYR  74   8.063  12.816  -2.991
  545    HA   TYR  74           HA       TYR  74   6.573  14.255  -4.663
  546   1HB   TYR  74          2HB       TYR  74   8.902  12.357  -5.341
  547   2HB   TYR  74          1HB       TYR  74   8.286  13.618  -6.466
  548    HD1  TYR  74           1HD      TYR  74   8.424  15.961  -5.885
  549    HD2  TYR  74           2HD      TYR  74  10.277  12.990  -3.493
  550    HE1  TYR  74           1HE      TYR  74   9.839  17.681  -4.859
  551    HE2  TYR  74           2HE      TYR  74  11.687  14.696  -2.450
  552    HH   TYR  74           HH       TYR  74  11.439  18.122  -3.383
  553    H    ASN  75           H        ASN  75   6.957  10.718  -4.982
  554    HA   ASN  75           HA       ASN  75   4.197  10.779  -5.510
  555   1HB   ASN  75          2HB       ASN  75   4.174   9.252  -7.529
  556   2HB   ASN  75          1HB       ASN  75   4.663  10.954  -7.836
  557   1HD2  ASN  75          1HD2      ASN  75   6.330   7.808  -6.937
  558   2HD2  ASN  75          2HD2      ASN  75   7.333   7.844  -8.354
  559    H    LEU  76           H        LEU  76   3.152   9.129  -4.588
  560    HA   LEU  76           HA       LEU  76   4.732   6.687  -4.074
  561   1HB   LEU  76          2HB       LEU  76   4.014   7.805  -1.989
  562   2HB   LEU  76          1HB       LEU  76   2.338   7.830  -2.563
  563    HG   LEU  76           HG       LEU  76   2.271   5.309  -2.519
  564   1HD1  LEU  76          1HD1      LEU  76   5.087   5.537  -1.285
  565   2HD1  LEU  76          2HD1      LEU  76   4.712   4.803  -2.898
  566   3HD1  LEU  76          3HD1      LEU  76   4.090   4.047  -1.385
  567   1HD2  LEU  76          1HD2      LEU  76   2.248   5.080  -0.063
  568   2HD2  LEU  76          2HD2      LEU  76   1.547   6.673  -0.545
  569   3HD2  LEU  76          3HD2      LEU  76   3.222   6.585   0.109
  570    H    SER  77           H        SER  77   4.301   5.535  -5.948
  571    HA   SER  77           HA       SER  77   1.552   5.425  -6.896
  572   1HB   SER  77          2HB       SER  77   4.118   4.246  -8.047
  573   2HB   SER  77          1HB       SER  77   2.493   4.115  -8.802
  574    HG   SER  77           HG       SER  77   2.444   6.343  -8.982
  575    H    LEU  78           H        LEU  78   0.176   3.970  -6.023
  576    HA   LEU  78           HA       LEU  78   1.245   1.323  -5.383
  577   1HB   LEU  78          2HB       LEU  78  -1.418   2.481  -4.467
  578   2HB   LEU  78          1HB       LEU  78  -0.574   1.024  -3.880
  579    HG   LEU  78           HG       LEU  78  -0.447   2.586  -2.161
  580   1HD1  LEU  78          1HD1      LEU  78   1.906   3.031  -1.761
  581   2HD1  LEU  78          2HD1      LEU  78   2.295   2.877  -3.510
  582   3HD1  LEU  78          3HD1      LEU  78   1.726   1.438  -2.586
  583   1HD2  LEU  78          1HD2      LEU  78   0.085   4.893  -2.206
  584   2HD2  LEU  78          2HD2      LEU  78  -1.166   4.582  -3.472
  585   3HD2  LEU  78          3HD2      LEU  78   0.548   4.839  -3.944
  586    H    THR  79           H        THR  79   0.356  -0.456  -6.397
  587    HA   THR  79           HA       THR  79  -2.251  -0.133  -7.669
  588    HB   THR  79           HB       THR  79   0.123  -1.704  -8.783
  589    HG1  THR  79           1HG      THR  79   0.022   0.610  -9.269
  590   1HG2  THR  79          1HG2      THR  79  -2.832  -1.419  -9.646
  591   2HG2  THR  79          2HG2      THR  79  -1.985  -2.939  -9.124
  592   3HG2  THR  79          3HG2      THR  79  -1.529  -2.142 -10.670
  593    H    LEU  80           H        LEU  80  -3.574  -1.413  -6.371
  594    HA   LEU  80           HA       LEU  80  -2.603  -4.045  -5.573
  595   1HB   LEU  80          2HB       LEU  80  -3.707  -3.832  -3.465
  596   2HB   LEU  80          1HB       LEU  80  -2.445  -2.555  -3.664
  597    HG   LEU  80           HG       LEU  80  -5.427  -2.246  -4.009
  598   1HD1  LEU  80          1HD1      LEU  80  -4.564  -2.801  -1.700
  599   2HD1  LEU  80          2HD1      LEU  80  -5.376  -1.154  -1.777
  600   3HD1  LEU  80          3HD1      LEU  80  -3.543  -1.295  -1.756
  601   1HD2  LEU  80          1HD2      LEU  80  -2.955  -0.464  -4.189
  602   2HD2  LEU  80          2HD2      LEU  80  -4.476   0.330  -3.536
  603   3HD2  LEU  80          3HD2      LEU  80  -4.454  -0.393  -5.220
  604    H    GLN  81           H        GLN  81  -4.390  -5.534  -5.111
  605    HA   GLN  81           HA       GLN  81  -6.232  -5.283  -7.350
  606   1HB   GLN  81          2HB       GLN  81  -5.896  -7.683  -5.527
  607   2HB   GLN  81          1HB       GLN  81  -6.803  -7.567  -7.059
  608   1HG   GLN  81          2HG       GLN  81  -4.284  -6.671  -7.865
  609   2HG   GLN  81          1HG       GLN  81  -3.829  -7.843  -6.585
  610   1HE2  GLN  81          1HE2      GLN  81  -4.000  -7.651  -9.833
  611   2HE2  GLN  81          2HE2      GLN  81  -4.534  -9.272 -10.183
  612    H    LYS  82           H        LYS  82  -8.482  -4.884  -7.155
  613    HA   LYS  82           HA       LYS  82  -9.380  -4.363  -4.528
  614   1HB   LYS  82          2HB       LYS  82 -10.018  -3.333  -6.945
  615   2HB   LYS  82          1HB       LYS  82 -11.335  -4.528  -6.806
  616   1HG   LYS  82          2HG       LYS  82 -12.237  -2.574  -5.787
  617   2HG   LYS  82          1HG       LYS  82 -11.668  -3.560  -4.399
  618   1HD   LYS  82          2HD       LYS  82  -9.370  -2.181  -4.944
  619   2HD   LYS  82          1HD       LYS  82 -10.529  -0.994  -5.589
  620   1HE   LYS  82          2HE       LYS  82 -10.338  -2.096  -2.699
  621   2HE   LYS  82          1HE       LYS  82 -10.024  -0.409  -3.254
  622   1HZ   LYS  82          1HZ       LYS  82 -12.614  -1.856  -3.138
  623   2HZ   LYS  82          2HZ       LYS  82 -12.459  -0.387  -3.946
  624   3HZ   LYS  82          3HZ       LYS  82 -12.150  -0.482  -2.288
  625    H    SER  83           H        SER  83  -9.704  -5.924  -3.158
  626    HA   SER  83           HA       SER  83 -11.738  -7.934  -3.894
  627   1HB   SER  83          2HB       SER  83  -9.968  -7.935  -1.402
  628   2HB   SER  83          1HB       SER  83 -11.223  -9.154  -1.839
  629    HG   SER  83           HG       SER  83  -8.786  -8.564  -3.101
  630    H    LYS  84           H        LYS  84 -10.971  -5.152  -1.803
  631    HA   LYS  84           HA       LYS  84 -13.383  -5.356  -0.309
  632   1HB   LYS  84          2HB       LYS  84 -11.186  -3.342  -0.669
  633   2HB   LYS  84          1HB       LYS  84 -12.775  -2.704  -0.163
  634   1HG   LYS  84          2HG       LYS  84 -11.472  -3.036   1.769
  635   2HG   LYS  84          1HG       LYS  84 -12.848  -4.182   1.789
  636   1HD   LYS  84          2HD       LYS  84 -11.367  -6.072   1.293
  637   2HD   LYS  84          1HD       LYS  84 -10.048  -4.965   0.804
  638   1HE   LYS  84          2HE       LYS  84  -9.525  -5.927   3.012
  639   2HE   LYS  84          1HE       LYS  84  -9.766  -4.144   3.120
  640   1HZ   LYS  84          1HZ       LYS  84 -10.879  -5.065   4.896
  641   2HZ   LYS  84          2HZ       LYS  84 -11.640  -6.287   3.998
  642   3HZ   LYS  84          3HZ       LYS  84 -12.130  -4.699   3.847
  643    H    ARG  85           H        ARG  85 -15.426  -5.002  -1.009
  644    HA   ARG  85           HA       ARG  85 -15.730  -3.282  -3.350
  645   1HB   ARG  85          2HB       ARG  85 -16.659  -5.738  -3.147
  646   2HB   ARG  85          1HB       ARG  85 -17.906  -5.007  -2.103
  647   1HG   ARG  85          2HG       ARG  85 -18.344  -3.362  -4.112
  648   2HG   ARG  85          1HG       ARG  85 -17.242  -4.424  -5.039
  649   1HD   ARG  85          2HD       ARG  85 -18.842  -6.384  -4.244
  650   2HD   ARG  85          1HD       ARG  85 -20.026  -5.082  -3.876
  651    HE   ARG  85           HE       ARG  85 -18.947  -5.955  -6.519
  652   1HH1  ARG  85          1HH1      ARG  85 -21.003  -3.466  -4.966
  653   2HH1  ARG  85          2HH1      ARG  85 -22.114  -3.438  -6.286
  654   1HH2  ARG  85          1HH2      ARG  85 -20.200  -5.525  -8.367
  655   2HH2  ARG  85          2HH2      ARG  85 -21.629  -4.556  -8.242
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1  -8.954  -6.489 -13.528
    2   2H    MET   1          2HT       MET   1  -7.598  -5.500 -13.429
    3   3H    MET   1          3HT       MET   1  -9.001  -5.065 -12.624
    4    HA   MET   1           HA       MET   1  -8.789  -7.101 -11.273
    5   1HB   MET   1          2HB       MET   1  -5.990  -7.155 -12.549
    6   2HB   MET   1          1HB       MET   1  -6.505  -8.161 -11.171
    7   1HG   MET   1          2HG       MET   1  -7.535  -8.315 -14.043
    8   2HG   MET   1          1HG       MET   1  -6.505  -9.476 -13.188
    9   1HE   MET   1          1HE       MET   1  -7.483 -10.183 -10.487
   10   2HE   MET   1          2HE       MET   1  -7.217 -11.388 -11.791
   11   3HE   MET   1          3HE       MET   1  -8.719 -11.441 -10.806
   12    H    ALA   2           H        ALA   2  -6.251  -4.607 -11.882
   13    HA   ALA   2           HA       ALA   2  -6.458  -3.980  -9.027
   14   1HB   ALA   2          1HB       ALA   2  -4.278  -5.107  -9.375
   15   2HB   ALA   2          2HB       ALA   2  -4.012  -3.355  -9.104
   16   3HB   ALA   2          3HB       ALA   2  -3.917  -4.028 -10.778
   17    H    TYR   3           H        TYR   3  -5.971  -1.850  -8.434
   18    HA   TYR   3           HA       TYR   3  -6.253   0.069 -10.629
   19   1HB   TYR   3          2HB       TYR   3  -7.568   1.519  -9.564
   20   2HB   TYR   3          1HB       TYR   3  -8.346  -0.058  -9.187
   21    HD1  TYR   3           1HD      TYR   3  -7.728   2.965  -7.996
   22    HD2  TYR   3           2HD      TYR   3  -6.983  -1.054  -6.804
   23    HE1  TYR   3           1HE      TYR   3  -7.537   3.693  -5.652
   24    HE2  TYR   3           2HE      TYR   3  -6.867  -0.352  -4.494
   25    HH   TYR   3           HH       TYR   3  -6.759   1.341  -3.089
   26    H    SER   4           H        SER   4  -5.137   2.048 -10.383
   27    HA   SER   4           HA       SER   4  -2.891   1.889  -8.505
   28   1HB   SER   4          2HB       SER   4  -2.230   1.149 -10.858
   29   2HB   SER   4          1HB       SER   4  -2.682   2.785 -11.434
   30    HG   SER   4           HG       SER   4  -0.657   1.995  -9.614
   31    H    VAL   5           H        VAL   5  -2.706   3.711  -7.325
   32    HA   VAL   5           HA       VAL   5  -3.754   6.182  -8.473
   33    HB   VAL   5           HB       VAL   5  -5.527   5.859  -7.131
   34   1HG1  VAL   5          1HG1      VAL   5  -5.465   4.967  -4.841
   35   2HG1  VAL   5          2HG1      VAL   5  -3.719   4.536  -5.052
   36   3HG1  VAL   5          3HG1      VAL   5  -4.989   3.774  -6.104
   37   1HG2  VAL   5          1HG2      VAL   5  -5.349   7.414  -5.266
   38   2HG2  VAL   5          2HG2      VAL   5  -4.349   8.048  -6.629
   39   3HG2  VAL   5          3HG2      VAL   5  -3.562   7.269  -5.224
   40    H    THR   6           H        THR   6  -2.525   7.815  -8.390
   41    HA   THR   6           HA       THR   6  -0.062   7.770  -6.921
   42    HB   THR   6           HB       THR   6  -0.350  10.331  -7.929
   43    HG1  THR   6           1HG      THR   6  -0.804   9.619 -10.172
   44   1HG2  THR   6          1HG2      THR   6   1.656   8.727  -8.021
   45   2HG2  THR   6          2HG2      THR   6   1.329   9.516  -9.601
   46   3HG2  THR   6          3HG2      THR   6   0.810   7.813  -9.324
   47    H    LEU   7           H        LEU   7   0.053   8.414  -4.889
   48    HA   LEU   7           HA       LEU   7  -1.981  10.246  -3.842
   49   1HB   LEU   7          2HB       LEU   7  -1.590   7.960  -2.817
   50   2HB   LEU   7          1HB       LEU   7   0.062   8.472  -2.417
   51    HG   LEU   7           HG       LEU   7  -0.918  10.333  -0.981
   52   1HD1  LEU   7          1HD1      LEU   7  -3.330  10.122  -0.287
   53   2HD1  LEU   7          2HD1      LEU   7  -3.582   8.869  -1.561
   54   3HD1  LEU   7          3HD1      LEU   7  -3.179  10.568  -2.023
   55   1HD2  LEU   7          1HD2      LEU   7  -1.681   8.713   0.839
   56   2HD2  LEU   7          2HD2      LEU   7  -0.135   8.254   0.033
   57   3HD2  LEU   7          3HD2      LEU   7  -1.651   7.392  -0.404
   58    H    THR   8           H        THR   8  -1.418  12.291  -3.159
   59    HA   THR   8           HA       THR   8   1.444  12.877  -2.963
   60    HB   THR   8           HB       THR   8   0.474  13.801  -5.064
   61    HG1  THR   8           1HG      THR   8   2.161  14.819  -4.469
   62   1HG2  THR   8          1HG2      THR   8  -1.050  15.693  -3.149
   63   2HG2  THR   8          2HG2      THR   8  -1.814  14.417  -4.182
   64   3HG2  THR   8          3HG2      THR   8  -0.948  15.800  -4.936
   65    H    GLY   9           H        GLY   9   2.014  14.443  -1.388
   66   1HA   GLY   9          2HA       GLY   9   0.726  16.045   0.134
   67   2HA   GLY   9          1HA       GLY   9   0.125  14.479   0.813
   68    HA   PRO  10           HA       PRO  10   3.954  15.617   2.893
   69   1HB   PRO  10          2HB       PRO  10   2.386  14.394   5.224
   70   2HB   PRO  10          1HB       PRO  10   3.558  15.773   5.228
   71   1HG   PRO  10          2HG       PRO  10   0.859  16.240   5.210
   72   2HG   PRO  10          1HG       PRO  10   1.934  17.203   4.117
   73   1HD   PRO  10          2HD       PRO  10   0.245  14.741   3.380
   74   2HD   PRO  10          1HD       PRO  10   0.455  16.325   2.504
   75    H    GLY  11           H        GLY  11   2.577  12.609   4.295
   76   1HA   GLY  11          2HA       GLY  11   4.380  10.801   3.383
   77   2HA   GLY  11          1HA       GLY  11   5.245  11.711   4.666
   78    HA   PRO  12           HA       PRO  12   2.757   9.293   7.479
   79   1HB   PRO  12          2HB       PRO  12   1.349  11.849   8.410
   80   2HB   PRO  12          1HB       PRO  12   1.943  10.462   9.414
   81   1HG   PRO  12          2HG       PRO  12   3.463  12.713   9.222
   82   2HG   PRO  12          1HG       PRO  12   4.275  11.109   8.950
   83   1HD   PRO  12          2HD       PRO  12   3.209  13.061   6.823
   84   2HD   PRO  12          1HD       PRO  12   4.822  12.217   6.900
   85    H    TRP  13           H        TRP  13   1.732   8.581   5.382
   86    HA   TRP  13           HA       TRP  13  -0.584   9.594   4.440
   87   1HB   TRP  13          2HB       TRP  13   0.385   6.693   4.167
   88   2HB   TRP  13          1HB       TRP  13  -0.781   7.430   3.126
   89    HD1  TRP  13           HD       TRP  13   2.792   6.763   3.453
   90    HE1  TRP  13           1HE      TRP  13   4.241   8.159   1.819
   91    HE3  TRP  13           3HE      TRP  13  -0.566  10.399   2.335
   92    HZ2  TRP  13           2HZ      TRP  13   3.961  10.465   0.299
   93    HZ3  TRP  13           3HZ      TRP  13   0.096  12.185   0.826
   94    HH2  TRP  13           HH       TRP  13   2.343  12.228  -0.185
   95    H    GLY  14           H        GLY  14  -0.448   6.679   6.544
   96   1HA   GLY  14          2HA       GLY  14  -1.872   6.529   8.326
   97   2HA   GLY  14          1HA       GLY  14  -3.156   7.396   7.419
   98    H    PHE  15           H        PHE  15  -1.144   4.488   6.886
   99    HA   PHE  15           HA       PHE  15  -3.625   2.910   6.757
  100   1HB   PHE  15          2HB       PHE  15  -2.774   1.729   4.739
  101   2HB   PHE  15          1HB       PHE  15  -2.898   3.470   4.449
  102    HD1  PHE  15           1HD      PHE  15  -0.905   4.894   4.569
  103    HD2  PHE  15           2HD      PHE  15  -0.521   0.650   4.752
  104    HE1  PHE  15           1HE      PHE  15   1.552   5.075   4.364
  105    HE2  PHE  15           2HE      PHE  15   1.851   0.867   4.275
  106    HZ   PHE  15           HZ       PHE  15   2.910   3.051   4.239
  107    H    ARG  16           H        ARG  16  -3.426   0.576   6.944
  108    HA   ARG  16           HA       ARG  16  -1.477   0.134   9.052
  109   1HB   ARG  16          2HB       ARG  16  -4.416  -0.663   8.756
  110   2HB   ARG  16          1HB       ARG  16  -3.346  -1.439   9.963
  111   1HG   ARG  16          2HG       ARG  16  -3.923   1.582   9.745
  112   2HG   ARG  16          1HG       ARG  16  -4.769   0.471  10.847
  113   1HD   ARG  16          2HD       ARG  16  -2.780   0.037  12.164
  114   2HD   ARG  16          1HD       ARG  16  -1.684   0.793  10.973
  115    HE   ARG  16           HE       ARG  16  -3.425   2.219  12.928
  116   1HH1  ARG  16          1HH1      ARG  16  -1.370   2.755   9.998
  117   2HH1  ARG  16          2HH1      ARG  16  -0.658   4.144  10.745
  118   1HH2  ARG  16          1HH2      ARG  16  -2.731   4.108  13.568
  119   2HH2  ARG  16          2HH2      ARG  16  -1.539   5.054  12.687
  120    H    LEU  17           H        LEU  17  -0.212  -1.599   9.028
  121    HA   LEU  17           HA       LEU  17  -0.440  -3.130   6.569
  122   1HB   LEU  17          2HB       LEU  17   1.894  -2.336   8.382
  123   2HB   LEU  17          1HB       LEU  17   2.059  -3.550   7.054
  124    HG   LEU  17           HG       LEU  17   2.907  -1.450   6.313
  125   1HD1  LEU  17          1HD1      LEU  17   1.716  -1.155   4.270
  126   2HD1  LEU  17          2HD1      LEU  17   0.139  -1.616   5.041
  127   3HD1  LEU  17          3HD1      LEU  17   1.427  -2.859   4.774
  128   1HD2  LEU  17          1HD2      LEU  17   1.900   0.680   6.483
  129   2HD2  LEU  17          2HD2      LEU  17   1.666  -0.069   8.094
  130   3HD2  LEU  17          3HD2      LEU  17   0.292   0.017   6.926
  131    H    GLN  18           H        GLN  18  -0.900  -5.192   6.533
  132    HA   GLN  18           HA       GLN  18  -0.249  -6.871   8.812
  133   1HB   GLN  18          2HB       GLN  18  -3.052  -6.518   7.648
  134   2HB   GLN  18          1HB       GLN  18  -2.540  -7.907   8.674
  135   1HG   GLN  18          2HG       GLN  18  -1.913  -6.275  10.501
  136   2HG   GLN  18          1HG       GLN  18  -2.584  -4.933   9.516
  137   1HE2  GLN  18          1HE2      GLN  18  -4.512  -7.851   9.129
  138   2HE2  GLN  18          2HE2      GLN  18  -5.761  -7.317  10.217
  139    H    GLY  19           H        GLY  19   0.520  -8.760   8.245
  140   1HA   GLY  19          2HA       GLY  19   0.680 -10.634   6.988
  141   2HA   GLY  19          1HA       GLY  19   0.038  -9.772   5.553
  142    H    GLY  20           H        GLY  20   1.623 -10.386   4.121
  143   1HA   GLY  20          2HA       GLY  20   3.444  -9.651   3.046
  144   2HA   GLY  20          1HA       GLY  20   4.263  -9.232   4.581
  145    H    LYS  21           H        LYS  21   5.367 -10.583   2.361
  146    HA   LYS  21           HA       LYS  21   5.602 -13.140   2.249
  147   1HB   LYS  21          2HB       LYS  21   6.708 -11.089   1.030
  148   2HB   LYS  21          1HB       LYS  21   7.987 -11.182   2.261
  149   1HG   LYS  21          2HG       LYS  21   8.796 -12.343   0.322
  150   2HG   LYS  21          1HG       LYS  21   8.345 -13.632   1.480
  151   1HD   LYS  21          2HD       LYS  21   5.951 -13.379   0.241
  152   2HD   LYS  21          1HD       LYS  21   6.922 -12.713  -1.077
  153   1HE   LYS  21          2HE       LYS  21   7.382 -15.479   0.242
  154   2HE   LYS  21          1HE       LYS  21   6.532 -15.220  -1.326
  155   1HZ   LYS  21          1HZ       LYS  21   9.341 -14.277  -0.916
  156   2HZ   LYS  21          2HZ       LYS  21   8.508 -14.587  -2.355
  157   3HZ   LYS  21          3HZ       LYS  21   8.952 -15.849  -1.337
  158    H    ASP  22           H        ASP  22   6.958 -11.280   4.849
  159    HA   ASP  22           HA       ASP  22   8.970 -13.006   5.646
  160   1HB   ASP  22          2HB       ASP  22   8.529 -10.478   6.056
  161   2HB   ASP  22          1HB       ASP  22   7.318 -10.968   7.296
  162    H    PHE  23           H        PHE  23   5.530 -12.877   6.524
  163    HA   PHE  23           HA       PHE  23   5.858 -14.946   8.506
  164   1HB   PHE  23          2HB       PHE  23   3.358 -13.551   7.347
  165   2HB   PHE  23          1HB       PHE  23   3.411 -14.598   8.807
  166    HD1  PHE  23           1HD      PHE  23   5.318 -13.834  10.544
  167    HD2  PHE  23           2HD      PHE  23   3.390 -11.318   7.726
  168    HE1  PHE  23           1HE      PHE  23   5.878 -11.888  11.912
  169    HE2  PHE  23           2HE      PHE  23   3.947  -9.356   9.087
  170    HZ   PHE  23           HZ       PHE  23   5.231  -9.637  11.173
  171    H    ASN  24           H        ASN  24   4.374 -14.426   5.402
  172    HA   ASN  24           HA       ASN  24   4.738 -16.345   3.917
  173   1HB   ASN  24          2HB       ASN  24   3.295 -18.289   4.040
  174   2HB   ASN  24          1HB       ASN  24   4.429 -18.217   5.400
  175   1HD2  ASN  24          1HD2      ASN  24   2.388 -19.892   5.524
  176   2HD2  ASN  24          2HD2      ASN  24   1.180 -19.375   6.685
  177    H    MET  25           H        MET  25   2.827 -13.863   4.628
  178    HA   MET  25           HA       MET  25   0.572 -14.644   3.001
  179   1HB   MET  25          2HB       MET  25   1.236 -12.710   5.102
  180   2HB   MET  25          1HB       MET  25   0.380 -11.904   3.789
  181   1HG   MET  25          2HG       MET  25  -1.298 -12.592   5.332
  182   2HG   MET  25          1HG       MET  25  -1.440 -13.673   3.926
  183   1HE   MET  25          1HE       MET  25   1.063 -13.629   7.104
  184   2HE   MET  25          2HE       MET  25  -0.013 -14.530   8.216
  185   3HE   MET  25          3HE       MET  25  -0.580 -13.001   7.472
  186    HA   PRO  26           HA       PRO  26   2.090 -11.834  -0.208
  187   1HB   PRO  26          2HB       PRO  26  -0.246 -10.587  -1.072
  188   2HB   PRO  26          1HB       PRO  26   0.227 -12.240  -1.573
  189   1HG   PRO  26          2HG       PRO  26  -1.964 -11.468   0.291
  190   2HG   PRO  26          1HG       PRO  26  -1.731 -12.982  -0.632
  191   1HD   PRO  26          2HD       PRO  26  -1.027 -12.132   2.084
  192   2HD   PRO  26          1HD       PRO  26  -0.898 -13.861   1.600
  193    H    LEU  27           H        LEU  27   2.349  -9.426  -0.517
  194    HA   LEU  27           HA       LEU  27   2.244  -8.050   1.934
  195   1HB   LEU  27          2HB       LEU  27   3.623  -7.861  -0.419
  196   2HB   LEU  27          1HB       LEU  27   2.530  -6.477  -0.614
  197    HG   LEU  27           HG       LEU  27   4.287  -7.105   1.837
  198   1HD1  LEU  27          1HD1      LEU  27   4.801  -5.068  -0.425
  199   2HD1  LEU  27          2HD1      LEU  27   5.579  -6.692  -0.272
  200   3HD1  LEU  27          3HD1      LEU  27   5.888  -5.441   0.980
  201   1HD2  LEU  27          1HD2      LEU  27   3.919  -4.664   2.455
  202   2HD2  LEU  27          2HD2      LEU  27   2.377  -5.602   2.477
  203   3HD2  LEU  27          3HD2      LEU  27   2.760  -4.513   1.087
  204    H    THR  28           H        THR  28   0.345  -7.613   2.870
  205    HA   THR  28           HA       THR  28  -1.630  -6.276   1.170
  206    HB   THR  28           HB       THR  28  -3.366  -7.383   1.703
  207    HG1  THR  28           1HG      THR  28  -2.141  -7.921   4.203
  208   1HG2  THR  28          1HG2      THR  28  -1.419  -9.624   2.414
  209   2HG2  THR  28          2HG2      THR  28  -1.668  -8.986   0.744
  210   3HG2  THR  28          3HG2      THR  28  -3.048  -9.727   1.643
  211    H    ILE  29           H        ILE  29  -3.131  -4.965   2.124
  212    HA   ILE  29           HA       ILE  29  -2.130  -3.567   4.536
  213    HB   ILE  29           HB       ILE  29  -3.289  -2.375   2.034
  214   1HG1  ILE  29          2HG1      ILE  29  -0.542  -2.691   3.313
  215   2HG1  ILE  29          1HG1      ILE  29  -1.036  -3.074   1.653
  216   1HG2  ILE  29          1HG2      ILE  29  -2.345  -1.053   4.676
  217   2HG2  ILE  29          2HG2      ILE  29  -4.078  -1.193   4.147
  218   3HG2  ILE  29          3HG2      ILE  29  -2.960  -0.214   3.202
  219   1HD1  ILE  29          1HD1      ILE  29  -1.095  -0.730   1.021
  220   2HD1  ILE  29          2HD1      ILE  29   0.465  -1.058   1.846
  221   3HD1  ILE  29          3HD1      ILE  29  -0.838  -0.189   2.734
  222    H    SER  30           H        SER  30  -3.758  -2.894   5.978
  223    HA   SER  30           HA       SER  30  -6.145  -4.558   5.802
  224   1HB   SER  30          2HB       SER  30  -4.905  -4.802   7.829
  225   2HB   SER  30          1HB       SER  30  -4.869  -3.047   8.108
  226    HG   SER  30           HG       SER  30  -7.081  -4.839   8.246
  227    H    ARG  31           H        ARG  31  -5.891  -1.174   7.173
  228    HA   ARG  31           HA       ARG  31  -7.430  -0.263   4.991
  229   1HB   ARG  31          2HB       ARG  31  -9.001  -1.364   6.968
  230   2HB   ARG  31          1HB       ARG  31  -8.865   0.295   7.570
  231   1HG   ARG  31          2HG       ARG  31 -10.846   0.205   6.249
  232   2HG   ARG  31          1HG       ARG  31  -9.672   1.045   5.187
  233   1HD   ARG  31          2HD       ARG  31  -9.254  -1.227   4.031
  234   2HD   ARG  31          1HD       ARG  31 -10.559  -1.908   5.086
  235    HE   ARG  31           HE       ARG  31 -11.398   0.510   3.586
  236   1HH1  ARG  31          1HH1      ARG  31 -10.869  -3.034   3.151
  237   2HH1  ARG  31          2HH1      ARG  31 -11.907  -3.029   1.747
  238   1HH2  ARG  31          1HH2      ARG  31 -12.824   0.286   1.785
  239   2HH2  ARG  31          2HH2      ARG  31 -13.096  -1.334   1.155
  240    H    ILE  32           H        ILE  32  -8.184   2.062   5.542
  241    HA   ILE  32           HA       ILE  32  -5.897   3.626   6.083
  242    HB   ILE  32           HB       ILE  32  -8.815   4.057   5.421
  243   1HG1  ILE  32          2HG1      ILE  32  -8.077   5.142   3.415
  244   2HG1  ILE  32          1HG1      ILE  32  -6.369   5.025   3.808
  245   1HG2  ILE  32          1HG2      ILE  32  -6.667   6.176   5.971
  246   2HG2  ILE  32          2HG2      ILE  32  -8.296   6.008   6.794
  247   3HG2  ILE  32          3HG2      ILE  32  -8.207   6.492   5.075
  248   1HD1  ILE  32          1HD1      ILE  32  -6.447   2.557   3.445
  249   2HD1  ILE  32          2HD1      ILE  32  -7.152   3.446   2.040
  250   3HD1  ILE  32          3HD1      ILE  32  -8.249   2.624   3.213
  251    H    THR  33           H        THR  33  -5.580   5.068   7.804
  252    HA   THR  33           HA       THR  33  -6.826   4.526  10.284
  253    HB   THR  33           HB       THR  33  -5.059   6.855   9.433
  254    HG1  THR  33           1HG      THR  33  -3.508   5.737  10.469
  255   1HG2  THR  33          1HG2      THR  33  -4.650   7.118  11.898
  256   2HG2  THR  33          2HG2      THR  33  -5.840   5.815  12.250
  257   3HG2  THR  33          3HG2      THR  33  -6.392   7.378  11.558
  258    HA   PRO  34           HA       PRO  34 -10.421   6.938   9.725
  259   1HB   PRO  34          2HB       PRO  34  -9.258   8.027  12.368
  260   2HB   PRO  34          1HB       PRO  34 -11.022   8.001  11.966
  261   1HG   PRO  34          2HG       PRO  34  -9.938   5.864  13.282
  262   2HG   PRO  34          1HG       PRO  34 -10.974   5.525  11.825
  263   1HD   PRO  34          2HD       PRO  34  -7.966   5.383  12.079
  264   2HD   PRO  34          1HD       PRO  34  -9.066   4.526  10.908
  265    H    GLY  35           H        GLY  35  -8.443   9.622  11.196
  266   1HA   GLY  35          2HA       GLY  35  -9.654  11.267   9.085
  267   2HA   GLY  35          1HA       GLY  35  -9.013  11.773  10.680
  268    H    SER  36           H        SER  36  -7.726   9.959   7.870
  269    HA   SER  36           HA       SER  36  -5.263  11.536   8.108
  270   1HB   SER  36          2HB       SER  36  -4.133   9.545   7.207
  271   2HB   SER  36          1HB       SER  36  -5.093   9.130   8.650
  272    HG   SER  36           HG       SER  36  -6.450   8.017   7.460
  273    H    LYS  37           H        LYS  37  -3.909  11.376   6.004
  274    HA   LYS  37           HA       LYS  37  -5.330  12.513   3.833
  275   1HB   LYS  37          2HB       LYS  37  -2.457  11.644   4.293
  276   2HB   LYS  37          1HB       LYS  37  -3.037  12.002   2.646
  277   1HG   LYS  37          2HG       LYS  37  -2.118  13.991   3.233
  278   2HG   LYS  37          1HG       LYS  37  -3.864  14.268   3.469
  279   1HD   LYS  37          2HD       LYS  37  -3.550  13.973   5.950
  280   2HD   LYS  37          1HD       LYS  37  -1.817  13.598   5.668
  281   1HE   LYS  37          2HE       LYS  37  -1.473  15.910   4.718
  282   2HE   LYS  37          1HE       LYS  37  -3.202  16.301   5.033
  283   1HZ   LYS  37          1HZ       LYS  37  -1.354  15.422   7.218
  284   2HZ   LYS  37          2HZ       LYS  37  -2.847  16.184   7.335
  285   3HZ   LYS  37          3HZ       LYS  37  -1.501  17.011   6.739
  286    H    ALA  38           H        ALA  38  -4.237   9.233   4.592
  287    HA   ALA  38           HA       ALA  38  -4.826   7.937   2.181
  288   1HB   ALA  38          1HB       ALA  38  -4.947   6.932   5.034
  289   2HB   ALA  38          2HB       ALA  38  -3.458   7.100   4.045
  290   3HB   ALA  38          3HB       ALA  38  -4.719   5.963   3.514
  291    H    ALA  39           H        ALA  39  -7.030   9.123   4.701
  292    HA   ALA  39           HA       ALA  39  -9.234   7.807   3.442
  293   1HB   ALA  39          1HB       ALA  39  -9.163   8.321   5.926
  294   2HB   ALA  39          2HB       ALA  39 -10.585   9.079   5.136
  295   3HB   ALA  39          3HB       ALA  39  -9.136  10.074   5.543
  296    H    GLN  40           H        GLN  40  -7.687  10.905   3.012
  297    HA   GLN  40           HA       GLN  40  -9.964  12.301   2.148
  298   1HB   GLN  40          2HB       GLN  40  -6.960  12.734   1.911
  299   2HB   GLN  40          1HB       GLN  40  -8.097  13.865   1.147
  300   1HG   GLN  40          2HG       GLN  40  -9.188  14.337   3.340
  301   2HG   GLN  40          1HG       GLN  40  -8.144  13.112   4.142
  302   1HE2  GLN  40          1HE2      GLN  40  -7.550  14.900   5.562
  303   2HE2  GLN  40          2HE2      GLN  40  -6.382  16.094   5.048
  304    H    SER  41           H        SER  41  -7.400  10.705   0.268
  305    HA   SER  41           HA       SER  41  -8.560  11.943  -2.094
  306   1HB   SER  41          2HB       SER  41  -6.173  12.155  -1.593
  307   2HB   SER  41          1HB       SER  41  -5.950  10.400  -1.885
  308    HG   SER  41           HG       SER  41  -5.516  11.660  -3.773
  309    H    GLN  42           H        GLN  42  -7.419   9.799  -3.889
  310    HA   GLN  42           HA       GLN  42  -9.877   8.327  -4.053
  311   1HB   GLN  42          2HB       GLN  42  -7.342   8.199  -5.774
  312   2HB   GLN  42          1HB       GLN  42  -8.942   7.506  -6.178
  313   1HG   GLN  42          2HG       GLN  42  -9.904   9.884  -6.129
  314   2HG   GLN  42          1HG       GLN  42  -8.231  10.505  -5.908
  315   1HE2  GLN  42          1HE2      GLN  42 -10.430   8.803  -8.131
  316   2HE2  GLN  42          2HE2      GLN  42  -9.468   9.106  -9.570
  317    H    LEU  43           H        LEU  43  -7.439   7.895  -2.093
  318    HA   LEU  43           HA       LEU  43  -6.491   5.317  -2.699
  319   1HB   LEU  43          2HB       LEU  43  -5.391   7.390  -1.479
  320   2HB   LEU  43          1HB       LEU  43  -6.219   6.759  -0.026
  321    HG   LEU  43           HG       LEU  43  -5.054   4.481  -0.667
  322   1HD1  LEU  43          1HD1      LEU  43  -3.230   6.459  -2.190
  323   2HD1  LEU  43          2HD1      LEU  43  -4.295   5.254  -2.973
  324   3HD1  LEU  43          3HD1      LEU  43  -2.925   4.700  -1.940
  325   1HD2  LEU  43          1HD2      LEU  43  -2.929   5.197   0.553
  326   2HD2  LEU  43          2HD2      LEU  43  -4.475   5.637   1.365
  327   3HD2  LEU  43          3HD2      LEU  43  -3.543   6.895   0.474
  328    H    SER  44           H        SER  44  -7.428   3.474  -2.347
  329    HA   SER  44           HA       SER  44  -8.558   2.975   0.324
  330   1HB   SER  44          2HB       SER  44 -10.291   2.713  -1.511
  331   2HB   SER  44          1HB       SER  44  -9.239   1.509  -2.291
  332    HG   SER  44           HG       SER  44 -10.826   1.341  -0.031
  333    H    GLN  45           H        GLN  45  -5.988   2.979   0.651
  334    HA   GLN  45           HA       GLN  45  -4.637   0.766  -0.462
  335   1HB   GLN  45          2HB       GLN  45  -3.624   2.968  -0.076
  336   2HB   GLN  45          1HB       GLN  45  -4.170   2.950   1.662
  337   1HG   GLN  45          2HG       GLN  45  -2.539   1.540   2.346
  338   2HG   GLN  45          1HG       GLN  45  -2.585   0.655   0.783
  339   1HE2  GLN  45          2HE2      GLN  45  -1.552   3.969   1.916
  340   2HE2  GLN  45          1HE2      GLN  45   0.090   3.817   1.308
  341    H    GLY  46           H        GLY  46  -5.392  -1.180   0.212
  342   1HA   GLY  46          2HA       GLY  46  -5.476  -2.139   2.794
  343   2HA   GLY  46          1HA       GLY  46  -7.035  -1.290   2.502
  344    H    ASP  47           H        ASP  47  -4.843  -3.281   0.478
  345    HA   ASP  47           HA       ASP  47  -6.567  -5.469   0.541
  346   1HB   ASP  47          2HB       ASP  47  -7.412  -3.619  -1.335
  347   2HB   ASP  47          1HB       ASP  47  -6.234  -4.473  -2.348
  348    H    LEU  48           H        LEU  48  -5.373  -6.811  -1.847
  349    HA   LEU  48           HA       LEU  48  -2.792  -7.222  -0.737
  350   1HB   LEU  48          2HB       LEU  48  -4.779  -8.800  -1.237
  351   2HB   LEU  48          1HB       LEU  48  -4.456  -8.530  -2.964
  352    HG   LEU  48           HG       LEU  48  -2.496  -9.810  -0.920
  353   1HD1  LEU  48          1HD1      LEU  48  -4.287 -11.037  -3.080
  354   2HD1  LEU  48          2HD1      LEU  48  -4.507 -11.119  -1.287
  355   3HD1  LEU  48          3HD1      LEU  48  -3.064 -11.912  -2.026
  356   1HD2  LEU  48          1HD2      LEU  48  -1.295 -10.406  -3.169
  357   2HD2  LEU  48          2HD2      LEU  48  -1.224  -8.686  -2.577
  358   3HD2  LEU  48          3HD2      LEU  48  -2.378  -9.116  -3.896
  359    H    VAL  49           H        VAL  49  -1.081  -6.041  -1.496
  360    HA   VAL  49           HA       VAL  49  -1.520  -4.292  -3.654
  361    HB   VAL  49           HB       VAL  49   0.857  -4.646  -1.804
  362   1HG1  VAL  49          1HG1      VAL  49   1.082  -2.157  -2.322
  363   2HG1  VAL  49          2HG1      VAL  49  -0.203  -2.326  -3.568
  364   3HG1  VAL  49          3HG1      VAL  49   1.369  -3.198  -3.765
  365   1HG2  VAL  49          1HG2      VAL  49  -1.749  -3.009  -1.485
  366   2HG2  VAL  49          2HG2      VAL  49  -0.257  -2.780  -0.505
  367   3HG2  VAL  49          3HG2      VAL  49  -1.155  -4.326  -0.403
  368    H    VAL  50           H        VAL  50  -0.264  -4.226  -5.594
  369    HA   VAL  50           HA       VAL  50   1.240  -6.637  -6.219
  370    HB   VAL  50           HB       VAL  50   0.595  -4.386  -8.155
  371   1HG1  VAL  50          1HG1      VAL  50   2.353  -6.092  -8.767
  372   2HG1  VAL  50          2HG1      VAL  50   0.866  -6.259  -9.764
  373   3HG1  VAL  50          3HG1      VAL  50   1.171  -7.412  -8.414
  374   1HG2  VAL  50          1HG2      VAL  50  -1.554  -4.928  -7.294
  375   2HG2  VAL  50          2HG2      VAL  50  -1.214  -6.715  -7.300
  376   3HG2  VAL  50          3HG2      VAL  50  -1.360  -5.794  -8.850
  377    H    ALA  51           H        ALA  51   1.451  -3.121  -6.713
  378    HA   ALA  51           HA       ALA  51   4.379  -3.337  -6.556
  379   1HB   ALA  51          1HB       ALA  51   4.530  -1.974  -8.643
  380   2HB   ALA  51          2HB       ALA  51   2.731  -1.920  -8.735
  381   3HB   ALA  51          3HB       ALA  51   3.598  -3.481  -8.941
  382    H    ILE  52           H        ILE  52   5.574  -1.531  -6.261
  383    HA   ILE  52           HA       ILE  52   4.230   0.820  -5.172
  384    HB   ILE  52           HB       ILE  52   5.224  -1.053  -3.648
  385   1HG1  ILE  52          2HG1      ILE  52   4.181   0.968  -2.788
  386   2HG1  ILE  52          1HG1      ILE  52   5.635   0.527  -1.858
  387   1HG2  ILE  52          1HG2      ILE  52   7.455  -1.160  -4.664
  388   2HG2  ILE  52          2HG2      ILE  52   7.522  -0.723  -2.916
  389   3HG2  ILE  52          3HG2      ILE  52   7.778   0.545  -4.178
  390   1HD1  ILE  52          1HD1      ILE  52   5.363   2.863  -3.866
  391   2HD1  ILE  52          2HD1      ILE  52   6.939   2.333  -3.160
  392   3HD1  ILE  52          3HD1      ILE  52   5.640   2.936  -2.091
  393    H    ASP  53           H        ASP  53   4.995   2.633  -6.139
  394    HA   ASP  53           HA       ASP  53   5.985   3.898  -7.560
  395   1HB   ASP  53          2HB       ASP  53   7.860   3.574  -5.948
  396   2HB   ASP  53          1HB       ASP  53   8.543   2.313  -7.025
  397    H    GLY  54           H        GLY  54   5.131   1.004  -8.354
  398   1HA   GLY  54          2HA       GLY  54   4.602   0.245 -10.463
  399   2HA   GLY  54          1HA       GLY  54   5.934   1.213 -11.166
  400    H    VAL  55           H        VAL  55   6.931  -0.508  -8.332
  401    HA   VAL  55           HA       VAL  55   8.040  -2.623 -10.038
  402    HB   VAL  55           HB       VAL  55   9.152  -1.473  -7.462
  403   1HG1  VAL  55          1HG1      VAL  55   9.696  -3.906  -7.782
  404   2HG1  VAL  55          2HG1      VAL  55  11.141  -2.908  -8.148
  405   3HG1  VAL  55          3HG1      VAL  55  10.162  -3.595  -9.490
  406   1HG2  VAL  55          1HG2      VAL  55   9.393   0.175  -9.306
  407   2HG2  VAL  55          2HG2      VAL  55  10.008  -1.111 -10.412
  408   3HG2  VAL  55          3HG2      VAL  55  10.973  -0.609  -8.975
  409    H    ASN  56           H        ASN  56   7.562  -4.755  -9.439
  410    HA   ASN  56           HA       ASN  56   5.427  -4.919  -7.592
  411   1HB   ASN  56          2HB       ASN  56   5.092  -7.143  -8.405
  412   2HB   ASN  56          1HB       ASN  56   5.429  -6.023  -9.777
  413   1HD2  ASN  56          1HD2      ASN  56   6.334  -8.981  -8.364
  414   2HD2  ASN  56          2HD2      ASN  56   7.710  -9.258  -9.423
  415    H    THR  57           H        THR  57   5.200  -5.963  -5.691
  416    HA   THR  57           HA       THR  57   7.553  -5.827  -4.127
  417    HB   THR  57           HB       THR  57   5.896  -5.920  -2.269
  418    HG1  THR  57           1HG      THR  57   3.953  -5.665  -4.287
  419   1HG2  THR  57          1HG2      THR  57   4.935  -3.708  -2.750
  420   2HG2  THR  57          2HG2      THR  57   5.305  -3.870  -4.507
  421   3HG2  THR  57          3HG2      THR  57   6.642  -3.770  -3.307
  422    H    ASP  58           H        ASP  58   7.584  -8.179  -5.731
  423    HA   ASP  58           HA       ASP  58   6.495 -10.393  -4.650
  424   1HB   ASP  58          2HB       ASP  58   7.543 -10.199  -6.879
  425   2HB   ASP  58          1HB       ASP  58   9.176 -10.142  -6.130
  426    H    THR  59           H        THR  59   9.740  -9.122  -3.831
  427    HA   THR  59           HA       THR  59   9.717 -11.000  -1.565
  428    HB   THR  59           HB       THR  59  11.335 -11.317  -3.459
  429    HG1  THR  59           1HG      THR  59  12.488 -10.901  -0.915
  430   1HG2  THR  59          1HG2      THR  59  12.712  -8.829  -2.244
  431   2HG2  THR  59          2HG2      THR  59  11.938  -8.928  -3.869
  432   3HG2  THR  59          3HG2      THR  59  13.378  -9.934  -3.493
  433    H    MET  60           H        MET  60   8.606  -8.155  -1.744
  434    HA   MET  60           HA       MET  60  10.239  -6.766   0.174
  435   1HB   MET  60          2HB       MET  60   7.845  -6.291  -1.640
  436   2HB   MET  60          1HB       MET  60   8.086  -5.198  -0.241
  437   1HG   MET  60          2HG       MET  60   9.004  -4.103  -2.091
  438   2HG   MET  60          1HG       MET  60  10.391  -4.652  -1.110
  439   1HE   MET  60          1HE       MET  60  10.652  -4.540  -5.295
  440   2HE   MET  60          2HE       MET  60  10.662  -3.464  -3.856
  441   3HE   MET  60          3HE       MET  60   9.104  -4.072  -4.522
  442    H    THR  61           H        THR  61   9.651  -6.525   2.286
  443    HA   THR  61           HA       THR  61   7.428  -8.129   3.233
  444    HB   THR  61           HB       THR  61   8.425  -7.936   5.391
  445    HG1  THR  61           1HG      THR  61  10.392  -6.732   5.530
  446   1HG2  THR  61          1HG2      THR  61   9.444  -9.482   3.579
  447   2HG2  THR  61          2HG2      THR  61  10.606  -8.985   4.873
  448   3HG2  THR  61          3HG2      THR  61  10.660  -8.214   3.252
  449    H    HIS  62           H        HIS  62   6.215  -7.075   5.203
  450    HA   HIS  62           HA       HIS  62   4.905  -4.823   4.361
  451   1HB   HIS  62          2HB       HIS  62   3.634  -4.998   6.199
  452   2HB   HIS  62          1HB       HIS  62   4.422  -6.597   6.306
  453    HD1  HIS  62           1HD      HIS  62   6.226  -6.823   8.386
  454    HD2  HIS  62           2HD      HIS  62   4.267  -3.118   8.119
  455    HE1  HIS  62           1HE      HIS  62   6.565  -5.597  10.579
  456    H    LEU  63           H        LEU  63   7.669  -5.028   6.487
  457    HA   LEU  63           HA       LEU  63   7.976  -2.320   7.131
  458   1HB   LEU  63          2HB       LEU  63   9.100  -4.215   8.304
  459   2HB   LEU  63          1HB       LEU  63  10.027  -4.568   6.815
  460    HG   LEU  63           HG       LEU  63  11.020  -2.217   6.963
  461   1HD1  LEU  63          1HD1      LEU  63   9.366  -1.124   8.496
  462   2HD1  LEU  63          2HD1      LEU  63  11.009  -1.121   9.228
  463   3HD1  LEU  63          3HD1      LEU  63   9.776  -2.305   9.798
  464   1HD2  LEU  63          1HD2      LEU  63  12.262  -4.211   7.545
  465   2HD2  LEU  63          2HD2      LEU  63  11.555  -4.233   9.216
  466   3HD2  LEU  63          3HD2      LEU  63  12.659  -2.889   8.710
  467    H    GLU  64           H        GLU  64   9.425  -4.276   4.480
  468    HA   GLU  64           HA       GLU  64  10.868  -2.207   3.381
  469   1HB   GLU  64          2HB       GLU  64  10.212  -4.898   2.770
  470   2HB   GLU  64          1HB       GLU  64   9.884  -4.022   1.252
  471   1HG   GLU  64          2HG       GLU  64  12.212  -3.193   1.174
  472   2HG   GLU  64          1HG       GLU  64  12.474  -3.643   2.896
  473    H    ALA  65           H        ALA  65   7.540  -3.251   2.510
  474    HA   ALA  65           HA       ALA  65   7.137  -1.325   0.556
  475   1HB   ALA  65          1HB       ALA  65   5.866  -3.378   0.883
  476   2HB   ALA  65          2HB       ALA  65   4.730  -1.964   0.884
  477   3HB   ALA  65          3HB       ALA  65   5.191  -2.771   2.445
  478    H    GLN  66           H        GLN  66   6.450  -1.118   4.051
  479    HA   GLN  66           HA       GLN  66   5.352   1.404   4.133
  480   1HB   GLN  66          2HB       GLN  66   5.465  -0.199   6.024
  481   2HB   GLN  66          1HB       GLN  66   7.223  -0.201   5.941
  482   1HG   GLN  66          2HG       GLN  66   6.769   0.991   7.872
  483   2HG   GLN  66          1HG       GLN  66   7.288   2.237   6.714
  484   1HE2  GLN  66          1HE2      GLN  66   4.124   0.577   7.163
  485   2HE2  GLN  66          2HE2      GLN  66   3.233   1.978   7.703
  486    H    ASN  67           H        ASN  67   8.786   0.424   4.279
  487    HA   ASN  67           HA       ASN  67   9.826   3.017   4.351
  488   1HB   ASN  67          2HB       ASN  67  10.938   0.247   3.676
  489   2HB   ASN  67          1HB       ASN  67  11.997   1.696   3.677
  490   1HD2  ASN  67          1HD2      ASN  67  12.550  -0.408   5.396
  491   2HD2  ASN  67          2HD2      ASN  67  12.224   0.087   7.027
  492    H    LYS  68           H        LYS  68   8.946   0.997   1.572
  493    HA   LYS  68           HA       LYS  68  10.110   2.751  -0.314
  494   1HB   LYS  68          2HB       LYS  68   7.809   0.766  -0.625
  495   2HB   LYS  68          1HB       LYS  68   8.647   1.606  -1.969
  496   1HG   LYS  68          2HG       LYS  68   9.971  -0.409  -0.066
  497   2HG   LYS  68          1HG       LYS  68   9.330  -0.758  -1.687
  498   1HD   LYS  68          2HD       LYS  68  10.985   0.750  -2.717
  499   2HD   LYS  68          1HD       LYS  68  11.591   1.256  -1.100
  500   1HE   LYS  68          2HE       LYS  68  12.332  -1.054  -0.578
  501   2HE   LYS  68          1HE       LYS  68  11.614  -1.663  -2.101
  502   1HZ   LYS  68          1HZ       LYS  68  13.128  -0.326  -3.361
  503   2HZ   LYS  68          2HZ       LYS  68  14.011  -1.262  -2.275
  504   3HZ   LYS  68          3HZ       LYS  68  13.800   0.401  -2.013
  505    H    ILE  69           H        ILE  69   6.724   2.433   0.926
  506    HA   ILE  69           HA       ILE  69   5.671   4.612  -0.294
  507    HB   ILE  69           HB       ILE  69   5.171   3.229   2.334
  508   1HG1  ILE  69          2HG1      ILE  69   3.936   3.437  -0.455
  509   2HG1  ILE  69          1HG1      ILE  69   4.203   1.968   0.533
  510   1HG2  ILE  69          1HG2      ILE  69   4.676   5.597   2.836
  511   2HG2  ILE  69          2HG2      ILE  69   3.183   4.663   2.697
  512   3HG2  ILE  69          3HG2      ILE  69   3.701   5.718   1.327
  513   1HD1  ILE  69          1HD1      ILE  69   2.410   2.362   1.988
  514   2HD1  ILE  69          2HD1      ILE  69   1.868   2.317   0.278
  515   3HD1  ILE  69          3HD1      ILE  69   1.935   3.900   1.128
  516    H    LYS  70           H        LYS  70   7.507   4.633   2.734
  517    HA   LYS  70           HA       LYS  70   7.324   7.385   3.114
  518   1HB   LYS  70          2HB       LYS  70   8.748   5.046   4.298
  519   2HB   LYS  70          1HB       LYS  70   9.545   6.614   4.580
  520   1HG   LYS  70          2HG       LYS  70   8.102   6.144   6.418
  521   2HG   LYS  70          1HG       LYS  70   7.533   7.592   5.530
  522   1HD   LYS  70          2HD       LYS  70   5.785   6.094   4.384
  523   2HD   LYS  70          1HD       LYS  70   6.267   4.776   5.493
  524   1HE   LYS  70          2HE       LYS  70   5.063   7.530   6.214
  525   2HE   LYS  70          1HE       LYS  70   4.271   5.898   6.334
  526   1HZ   LYS  70          1HZ       LYS  70   5.192   6.815   8.474
  527   2HZ   LYS  70          2HZ       LYS  70   6.719   6.718   7.853
  528   3HZ   LYS  70          3HZ       LYS  70   5.817   5.301   8.060
  529    H    SER  71           H        SER  71   8.760   6.252   0.463
  530    HA   SER  71           HA       SER  71  11.168   7.895   0.717
  531   1HB   SER  71          2HB       SER  71  10.250   6.054  -1.566
  532   2HB   SER  71          1HB       SER  71  11.834   6.895  -1.444
  533    HG   SER  71           HG       SER  71  10.800   4.972   0.376
  534    H    ALA  72           H        ALA  72   7.972   8.049  -0.343
  535    HA   ALA  72           HA       ALA  72   8.504  10.069  -2.407
  536   1HB   ALA  72          1HB       ALA  72   7.396   7.912  -3.089
  537   2HB   ALA  72          2HB       ALA  72   6.270   9.313  -3.293
  538   3HB   ALA  72          3HB       ALA  72   6.130   8.209  -1.857
  539    H    SER  73           H        SER  73   7.120  11.887  -2.571
  540    HA   SER  73           HA       SER  73   5.128  12.260  -0.510
  541   1HB   SER  73          2HB       SER  73   7.266  14.415  -0.949
  542   2HB   SER  73          1HB       SER  73   5.734  14.608  -0.029
  543    HG   SER  73           HG       SER  73   6.437  13.208   1.472
  544    H    TYR  74           H        TYR  74   6.815  13.857  -3.270
  545    HA   TYR  74           HA       TYR  74   4.540  15.275  -4.009
  546   1HB   TYR  74          2HB       TYR  74   7.072  14.560  -5.570
  547   2HB   TYR  74          1HB       TYR  74   5.787  15.640  -6.217
  548    HD1  TYR  74           1HD      TYR  74   4.976  17.458  -4.395
  549    HD2  TYR  74           2HD      TYR  74   8.841  15.731  -4.705
  550    HE1  TYR  74           1HE      TYR  74   5.926  19.388  -3.247
  551    HE2  TYR  74           2HE      TYR  74   9.802  17.647  -3.530
  552    HH   TYR  74           HH       TYR  74   9.408  19.608  -2.530
  553    H    ASN  75           H        ASN  75   5.721  12.120  -5.273
  554    HA   ASN  75           HA       ASN  75   2.962  11.568  -5.488
  555   1HB   ASN  75          2HB       ASN  75   2.859  10.672  -7.796
  556   2HB   ASN  75          1HB       ASN  75   2.940  12.445  -7.638
  557   1HD2  ASN  75          1HD2      ASN  75   5.701  10.062  -7.635
  558   2HD2  ASN  75          2HD2      ASN  75   6.320  10.625  -9.174
  559    H    LEU  76           H        LEU  76   2.543   9.779  -4.567
  560    HA   LEU  76           HA       LEU  76   4.521   7.620  -4.603
  561   1HB   LEU  76          2HB       LEU  76   3.834   8.533  -2.401
  562   2HB   LEU  76          1HB       LEU  76   2.124   8.375  -2.849
  563    HG   LEU  76           HG       LEU  76   2.352   5.866  -2.875
  564   1HD1  LEU  76          1HD1      LEU  76   5.135   6.351  -1.640
  565   2HD1  LEU  76          2HD1      LEU  76   4.896   5.787  -3.352
  566   3HD1  LEU  76          3HD1      LEU  76   4.334   4.778  -1.970
  567   1HD2  LEU  76          1HD2      LEU  76   2.458   5.607  -0.431
  568   2HD2  LEU  76          2HD2      LEU  76   1.598   7.143  -0.833
  569   3HD2  LEU  76          3HD2      LEU  76   3.311   7.181  -0.267
  570    H    SER  77           H        SER  77   4.094   6.102  -6.183
  571    HA   SER  77           HA       SER  77   1.327   5.738  -7.041
  572   1HB   SER  77          2HB       SER  77   3.053   6.205  -8.760
  573   2HB   SER  77          1HB       SER  77   3.950   4.755  -8.237
  574    HG   SER  77           HG       SER  77   1.382   4.892  -9.458
  575    H    LEU  78           H        LEU  78   0.152   4.221  -6.000
  576    HA   LEU  78           HA       LEU  78   1.497   1.714  -5.293
  577   1HB   LEU  78          2HB       LEU  78  -1.199   2.691  -4.247
  578   2HB   LEU  78          1HB       LEU  78  -0.193   1.351  -3.646
  579    HG   LEU  78           HG       LEU  78  -0.062   2.980  -2.023
  580   1HD1  LEU  78          1HD1      LEU  78   2.210   3.656  -1.803
  581   2HD1  LEU  78          2HD1      LEU  78   2.501   3.626  -3.582
  582   3HD1  LEU  78          3HD1      LEU  78   2.221   2.084  -2.697
  583   1HD2  LEU  78          1HD2      LEU  78   0.174   5.309  -2.159
  584   2HD2  LEU  78          2HD2      LEU  78  -1.129   4.820  -3.303
  585   3HD2  LEU  78          3HD2      LEU  78   0.487   5.275  -3.942
  586    H    THR  79           H        THR  79   0.681  -0.195  -6.153
  587    HA   THR  79           HA       THR  79  -1.890  -0.046  -7.550
  588    HB   THR  79           HB       THR  79   0.573  -1.623  -8.407
  589    HG1  THR  79           1HG      THR  79   0.822  -0.156  -9.924
  590   1HG2  THR  79          1HG2      THR  79  -2.201  -1.121  -9.674
  591   2HG2  THR  79          2HG2      THR  79  -1.591  -2.697  -9.024
  592   3HG2  THR  79          3HG2      THR  79  -0.826  -1.975 -10.485
  593    H    LEU  80           H        LEU  80  -3.290  -1.402  -6.415
  594    HA   LEU  80           HA       LEU  80  -2.294  -3.994  -5.510
  595   1HB   LEU  80          2HB       LEU  80  -3.685  -3.869  -3.568
  596   2HB   LEU  80          1HB       LEU  80  -2.510  -2.499  -3.579
  597    HG   LEU  80           HG       LEU  80  -5.439  -2.414  -4.328
  598   1HD1  LEU  80          1HD1      LEU  80  -4.788  -2.880  -1.903
  599   2HD1  LEU  80          2HD1      LEU  80  -5.753  -1.325  -2.128
  600   3HD1  LEU  80          3HD1      LEU  80  -3.933  -1.273  -1.894
  601   1HD2  LEU  80          1HD2      LEU  80  -3.092  -0.465  -4.186
  602   2HD2  LEU  80          2HD2      LEU  80  -4.736   0.223  -3.772
  603   3HD2  LEU  80          3HD2      LEU  80  -4.429  -0.497  -5.432
  604    H    GLN  81           H        GLN  81  -4.093  -5.582  -5.215
  605    HA   GLN  81           HA       GLN  81  -5.876  -5.304  -7.516
  606   1HB   GLN  81          2HB       GLN  81  -5.358  -7.723  -5.733
  607   2HB   GLN  81          1HB       GLN  81  -6.528  -7.604  -7.081
  608   1HG   GLN  81          2HG       GLN  81  -4.472  -6.967  -8.589
  609   2HG   GLN  81          1HG       GLN  81  -3.462  -7.649  -7.251
  610   1HE2  GLN  81          1HE2      GLN  81  -3.030  -9.864  -7.623
  611   2HE2  GLN  81          2HE2      GLN  81  -4.082 -10.916  -8.534
  612    H    LYS  82           H        LYS  82  -7.945  -4.601  -7.249
  613    HA   LYS  82           HA       LYS  82  -9.021  -4.691  -4.564
  614   1HB   LYS  82          2HB       LYS  82  -9.208  -2.816  -6.574
  615   2HB   LYS  82          1HB       LYS  82 -10.746  -3.682  -6.793
  616   1HG   LYS  82          2HG       LYS  82 -11.274  -2.008  -5.178
  617   2HG   LYS  82          1HG       LYS  82 -10.960  -3.462  -4.168
  618   1HD   LYS  82          2HD       LYS  82  -8.408  -2.482  -4.383
  619   2HD   LYS  82          1HD       LYS  82  -9.298  -0.951  -4.601
  620   1HE   LYS  82          2HE       LYS  82  -9.417  -2.866  -2.174
  621   2HE   LYS  82          1HE       LYS  82  -8.679  -1.215  -2.219
  622   1HZ   LYS  82          1HZ       LYS  82 -11.501  -2.013  -2.123
  623   2HZ   LYS  82          2HZ       LYS  82 -11.111  -0.604  -2.968
  624   3HZ   LYS  82          3HZ       LYS  82 -10.683  -0.730  -1.348
  625    H    SER  83           H        SER  83  -9.855  -6.565  -3.868
  626    HA   SER  83           HA       SER  83 -11.789  -7.911  -5.579
  627   1HB   SER  83          2HB       SER  83 -11.088  -8.349  -2.644
  628   2HB   SER  83          1HB       SER  83 -12.363  -9.253  -3.552
  629    HG   SER  83           HG       SER  83 -10.420 -10.389  -3.628
  630    H    LYS  84           H        LYS  84 -13.959  -7.477  -5.591
  631    HA   LYS  84           HA       LYS  84 -14.685  -4.978  -4.423
  632   1HB   LYS  84          2HB       LYS  84 -15.331  -5.955  -6.729
  633   2HB   LYS  84          1HB       LYS  84 -16.562  -6.908  -5.848
  634   1HG   LYS  84          2HG       LYS  84 -16.355  -3.828  -5.737
  635   2HG   LYS  84          1HG       LYS  84 -17.254  -4.727  -6.984
  636   1HD   LYS  84          2HD       LYS  84 -18.596  -5.861  -5.136
  637   2HD   LYS  84          1HD       LYS  84 -17.863  -4.689  -3.987
  638   1HE   LYS  84          2HE       LYS  84 -18.835  -2.790  -5.354
  639   2HE   LYS  84          1HE       LYS  84 -19.595  -4.001  -6.466
  640   1HZ   LYS  84          1HZ       LYS  84 -20.046  -3.845  -3.535
  641   2HZ   LYS  84          2HZ       LYS  84 -20.876  -4.849  -4.618
  642   3HZ   LYS  84          3HZ       LYS  84 -21.051  -3.150  -4.684
  643    H    ARG  85           H        ARG  85 -15.323  -4.805  -2.278
  644    HA   ARG  85           HA       ARG  85 -17.521  -6.423  -1.535
  645   1HB   ARG  85          2HB       ARG  85 -15.444  -7.817  -1.004
  646   2HB   ARG  85          1HB       ARG  85 -14.981  -6.570   0.187
  647   1HG   ARG  85          2HG       ARG  85 -16.996  -7.069   1.532
  648   2HG   ARG  85          1HG       ARG  85 -17.687  -8.054   0.201
  649   1HD   ARG  85          2HD       ARG  85 -15.892  -9.750   0.424
  650   2HD   ARG  85          1HD       ARG  85 -15.106  -8.802   1.731
  651    HE   ARG  85           HE       ARG  85 -17.687 -10.333   1.883
  652   1HH1  ARG  85          1HH1      ARG  85 -15.470  -8.110   3.638
  653   2HH1  ARG  85          2HH1      ARG  85 -16.048  -8.661   5.157
  654   1HH2  ARG  85          1HH2      ARG  85 -18.411 -10.903   4.005
  655   2HH2  ARG  85          2HH2      ARG  85 -17.269 -10.595   5.291
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1 -10.819  -4.890 -11.094
    2   2H    MET   1          2HT       MET   1 -11.053  -6.389 -11.816
    3   3H    MET   1          3HT       MET   1 -10.074  -5.242 -12.564
    4    HA   MET   1           HA       MET   1  -9.581  -7.034 -10.342
    5   1HB   MET   1          2HB       MET   1  -7.770  -6.011 -12.592
    6   2HB   MET   1          1HB       MET   1  -7.346  -7.275 -11.402
    7   1HG   MET   1          2HG       MET   1  -9.193  -8.703 -12.277
    8   2HG   MET   1          1HG       MET   1  -9.567  -7.473 -13.521
    9   1HE   MET   1          1HE       MET   1  -6.519  -7.449 -15.899
   10   2HE   MET   1          2HE       MET   1  -6.738  -6.340 -14.510
   11   3HE   MET   1          3HE       MET   1  -8.154  -6.821 -15.505
   12    H    ALA   2           H        ALA   2  -7.090  -4.698 -11.337
   13    HA   ALA   2           HA       ALA   2  -7.019  -3.840  -8.532
   14   1HB   ALA   2          1HB       ALA   2  -5.000  -5.083  -9.148
   15   2HB   ALA   2          2HB       ALA   2  -4.577  -3.348  -9.011
   16   3HB   ALA   2          3HB       ALA   2  -4.793  -4.082 -10.644
   17    H    TYR   3           H        TYR   3  -5.994  -1.741  -8.158
   18    HA   TYR   3           HA       TYR   3  -6.645   0.179 -10.252
   19   1HB   TYR   3          2HB       TYR   3  -7.761   1.692  -8.980
   20   2HB   TYR   3          1HB       TYR   3  -8.556   0.124  -8.606
   21    HD1  TYR   3           1HD      TYR   3  -7.578   3.053  -7.353
   22    HD2  TYR   3           2HD      TYR   3  -7.119  -1.074  -6.390
   23    HE1  TYR   3           1HE      TYR   3  -7.201   3.638  -4.994
   24    HE2  TYR   3           2HE      TYR   3  -6.841  -0.505  -4.067
   25    HH   TYR   3           HH       TYR   3  -6.828   1.140  -2.519
   26    H    SER   4           H        SER   4  -5.471   2.147 -10.117
   27    HA   SER   4           HA       SER   4  -2.946   1.835  -8.638
   28   1HB   SER   4          2HB       SER   4  -3.059   1.179 -11.223
   29   2HB   SER   4          1HB       SER   4  -2.991   2.944 -11.486
   30    HG   SER   4           HG       SER   4  -1.039   2.946 -10.355
   31    H    VAL   5           H        VAL   5  -2.569   3.641  -7.423
   32    HA   VAL   5           HA       VAL   5  -3.579   6.173  -8.459
   33    HB   VAL   5           HB       VAL   5  -5.257   5.915  -6.988
   34   1HG1  VAL   5          1HG1      VAL   5  -5.077   5.059  -4.710
   35   2HG1  VAL   5          2HG1      VAL   5  -3.353   4.592  -4.990
   36   3HG1  VAL   5          3HG1      VAL   5  -4.692   3.816  -5.949
   37   1HG2  VAL   5          1HG2      VAL   5  -4.873   7.501  -5.179
   38   2HG2  VAL   5          2HG2      VAL   5  -3.940   8.059  -6.627
   39   3HG2  VAL   5          3HG2      VAL   5  -3.095   7.281  -5.270
   40    H    THR   6           H        THR   6  -2.279   7.803  -8.413
   41    HA   THR   6           HA       THR   6   0.216   7.588  -6.952
   42    HB   THR   6           HB       THR   6   0.437  10.011  -7.920
   43    HG1  THR   6           1HG      THR   6  -1.273  10.310  -9.114
   44   1HG2  THR   6          1HG2      THR   6   1.937   8.016  -8.338
   45   2HG2  THR   6          2HG2      THR   6   1.660   8.966  -9.841
   46   3HG2  THR   6          3HG2      THR   6   0.778   7.416  -9.585
   47    H    LEU   7           H        LEU   7   0.331   8.367  -4.912
   48    HA   LEU   7           HA       LEU   7  -1.685  10.346  -4.100
   49   1HB   LEU   7          2HB       LEU   7  -1.416   8.085  -2.900
   50   2HB   LEU   7          1HB       LEU   7   0.185   8.672  -2.353
   51    HG   LEU   7           HG       LEU   7  -0.893  10.565  -1.171
   52   1HD1  LEU   7          1HD1      LEU   7  -3.387  10.487  -0.748
   53   2HD1  LEU   7          2HD1      LEU   7  -3.546   9.216  -2.018
   54   3HD1  LEU   7          3HD1      LEU   7  -3.006  10.880  -2.459
   55   1HD2  LEU   7          1HD2      LEU   7  -1.876   9.135   0.656
   56   2HD2  LEU   7          2HD2      LEU   7  -0.372   8.406  -0.033
   57   3HD2  LEU   7          3HD2      LEU   7  -1.978   7.751  -0.504
   58    H    THR   8           H        THR   8  -1.092  12.400  -3.584
   59    HA   THR   8           HA       THR   8   1.658  12.782  -2.710
   60    HB   THR   8           HB       THR   8   1.371  13.736  -4.980
   61    HG1  THR   8           1HG      THR   8   2.863  14.556  -3.539
   62   1HG2  THR   8          1HG2      THR   8  -0.491  15.758  -3.549
   63   2HG2  THR   8          2HG2      THR   8  -1.022  14.514  -4.749
   64   3HG2  THR   8          3HG2      THR   8   0.099  15.832  -5.241
   65    H    GLY   9           H        GLY   9   1.916  14.514  -1.083
   66   1HA   GLY   9          2HA       GLY   9  -0.150  15.998  -0.227
   67   2HA   GLY   9          1HA       GLY   9  -0.196  14.491   0.776
   68    HA   PRO  10           HA       PRO  10   3.099  17.284   2.414
   69   1HB   PRO  10          2HB       PRO  10   0.967  17.986   4.489
   70   2HB   PRO  10          1HB       PRO  10   2.352  18.983   3.902
   71   1HG   PRO  10          2HG       PRO  10  -0.163  19.447   2.923
   72   2HG   PRO  10          1HG       PRO  10   1.237  19.382   1.767
   73   1HD   PRO  10          2HD       PRO  10  -0.755  17.122   2.429
   74   2HD   PRO  10          1HD       PRO  10  -0.168  17.736   0.819
   75    H    GLY  11           H        GLY  11   0.628  15.685   4.446
   76   1HA   GLY  11          2HA       GLY  11   2.743  14.699   6.175
   77   2HA   GLY  11          1HA       GLY  11   0.971  14.783   6.497
   78    HA   PRO  12           HA       PRO  12   2.640  10.756   4.875
   79   1HB   PRO  12          2HB       PRO  12   2.997   9.170   7.100
   80   2HB   PRO  12          1HB       PRO  12   4.156  10.490   6.685
   81   1HG   PRO  12          2HG       PRO  12   1.781  10.674   8.637
   82   2HG   PRO  12          1HG       PRO  12   3.515  11.096   8.965
   83   1HD   PRO  12          2HD       PRO  12   1.653  12.997   8.162
   84   2HD   PRO  12          1HD       PRO  12   3.390  13.059   7.596
   85    H    TRP  13           H        TRP  13   1.788   8.576   4.742
   86    HA   TRP  13           HA       TRP  13  -1.068   8.709   4.757
   87   1HB   TRP  13          2HB       TRP  13   0.453   6.249   3.920
   88   2HB   TRP  13          1HB       TRP  13  -1.003   6.832   3.222
   89    HD1  TRP  13           HD       TRP  13   1.896   5.898   2.121
   90    HE1  TRP  13           1HE      TRP  13   3.527   7.465   0.807
   91    HE3  TRP  13           3HE      TRP  13  -0.554  10.265   2.733
   92    HZ2  TRP  13           2HZ      TRP  13   3.548  10.085  -0.054
   93    HZ3  TRP  13           3HZ      TRP  13   0.150  12.194   1.394
   94    HH2  TRP  13           HH       TRP  13   2.223  12.158   0.114
   95    H    GLY  14           H        GLY  14  -2.411   7.790   6.313
   96   1HA   GLY  14          2HA       GLY  14  -1.093   6.211   8.378
   97   2HA   GLY  14          1HA       GLY  14  -2.667   7.062   8.415
   98    H    PHE  15           H        PHE  15  -0.980   4.200   7.179
   99    HA   PHE  15           HA       PHE  15  -3.530   2.753   7.277
  100   1HB   PHE  15          2HB       PHE  15  -2.885   1.616   5.136
  101   2HB   PHE  15          1HB       PHE  15  -2.885   3.378   4.944
  102    HD1  PHE  15           1HD      PHE  15  -0.801   4.610   4.896
  103    HD2  PHE  15           2HD      PHE  15  -0.803   0.373   4.998
  104    HE1  PHE  15           1HE      PHE  15   1.640   4.597   4.509
  105    HE2  PHE  15           2HE      PHE  15   1.535   0.351   4.327
  106    HZ   PHE  15           HZ       PHE  15   2.809   2.446   4.231
  107    H    ARG  16           H        ARG  16  -3.516   0.494   7.591
  108    HA   ARG  16           HA       ARG  16  -1.473  -0.086   9.529
  109   1HB   ARG  16          2HB       ARG  16  -3.898   0.077  10.254
  110   2HB   ARG  16          1HB       ARG  16  -4.258  -1.312   9.180
  111   1HG   ARG  16          2HG       ARG  16  -4.119  -2.047  11.499
  112   2HG   ARG  16          1HG       ARG  16  -2.899  -2.819  10.462
  113   1HD   ARG  16          2HD       ARG  16  -1.840  -2.324  12.582
  114   2HD   ARG  16          1HD       ARG  16  -1.159  -1.194  11.331
  115    HE   ARG  16           HE       ARG  16  -3.465   0.023  12.679
  116   1HH1  ARG  16          1HH1      ARG  16  -0.046  -0.871  13.419
  117   2HH1  ARG  16          2HH1      ARG  16   0.204   0.553  14.346
  118   1HH2  ARG  16          1HH2      ARG  16  -3.203   1.535  14.202
  119   2HH2  ARG  16          2HH2      ARG  16  -1.712   1.737  15.061
  120    H    LEU  17           H        LEU  17   0.065  -1.601   8.914
  121    HA   LEU  17           HA       LEU  17  -0.549  -3.140   6.586
  122   1HB   LEU  17          2HB       LEU  17   2.073  -2.827   8.127
  123   2HB   LEU  17          1HB       LEU  17   1.861  -3.754   6.619
  124    HG   LEU  17           HG       LEU  17   0.890  -1.518   5.624
  125   1HD1  LEU  17          1HD1      LEU  17   2.273   0.464   6.686
  126   2HD1  LEU  17          2HD1      LEU  17   2.411  -0.616   8.138
  127   3HD1  LEU  17          3HD1      LEU  17   0.786  -0.093   7.536
  128   1HD2  LEU  17          1HD2      LEU  17   2.921  -2.712   4.855
  129   2HD2  LEU  17          2HD2      LEU  17   3.886  -1.970   6.184
  130   3HD2  LEU  17          3HD2      LEU  17   3.190  -0.930   4.874
  131    H    GLN  18           H        GLN  18  -1.289  -5.226   6.719
  132    HA   GLN  18           HA       GLN  18  -0.351  -6.861   8.968
  133   1HB   GLN  18          2HB       GLN  18  -3.241  -6.758   8.026
  134   2HB   GLN  18          1HB       GLN  18  -2.537  -7.817   9.287
  135   1HG   GLN  18          2HG       GLN  18  -1.784  -5.601  10.456
  136   2HG   GLN  18          1HG       GLN  18  -2.950  -4.756   9.380
  137   1HE2  GLN  18          1HE2      GLN  18  -2.702  -5.768  12.475
  138   2HE2  GLN  18          2HE2      GLN  18  -4.288  -6.389  12.769
  139    H    GLY  19           H        GLY  19   0.777  -8.426   8.207
  140   1HA   GLY  19          2HA       GLY  19   1.168 -10.356   7.174
  141   2HA   GLY  19          1HA       GLY  19  -0.249 -10.163   6.109
  142    H    GLY  20           H        GLY  20   2.810 -10.810   5.834
  143   1HA   GLY  20          2HA       GLY  20   2.887  -9.663   3.246
  144   2HA   GLY  20          1HA       GLY  20   4.120  -8.990   4.386
  145    H    LYS  21           H        LYS  21   5.421 -10.011   2.489
  146    HA   LYS  21           HA       LYS  21   5.244 -12.612   1.918
  147   1HB   LYS  21          2HB       LYS  21   6.569 -10.540   0.829
  148   2HB   LYS  21          1HB       LYS  21   7.957 -11.301   1.627
  149   1HG   LYS  21          2HG       LYS  21   7.901 -12.255  -0.565
  150   2HG   LYS  21          1HG       LYS  21   7.161 -13.517   0.469
  151   1HD   LYS  21          2HD       LYS  21   4.939 -11.957  -0.224
  152   2HD   LYS  21          1HD       LYS  21   5.952 -11.751  -1.668
  153   1HE   LYS  21          2HE       LYS  21   4.941 -14.428  -0.459
  154   2HE   LYS  21          1HE       LYS  21   4.318 -13.590  -1.933
  155   1HZ   LYS  21          1HZ       LYS  21   6.879 -13.811  -2.591
  156   2HZ   LYS  21          2HZ       LYS  21   5.728 -14.965  -2.912
  157   3HZ   LYS  21          3HZ       LYS  21   6.753 -15.173  -1.584
  158    H    ASP  22           H        ASP  22   7.099 -11.394   4.664
  159    HA   ASP  22           HA       ASP  22   8.787 -13.631   4.727
  160   1HB   ASP  22          2HB       ASP  22   9.731 -12.776   6.665
  161   2HB   ASP  22          1HB       ASP  22   9.258 -11.343   5.709
  162    H    PHE  23           H        PHE  23   5.552 -13.201   5.816
  163    HA   PHE  23           HA       PHE  23   5.610 -15.734   7.294
  164   1HB   PHE  23          2HB       PHE  23   3.938 -13.211   7.312
  165   2HB   PHE  23          1HB       PHE  23   3.028 -14.727   7.555
  166    HD1  PHE  23           1HD      PHE  23   2.470 -14.861   9.718
  167    HD2  PHE  23           2HD      PHE  23   6.446 -13.681   8.761
  168    HE1  PHE  23           1HE      PHE  23   3.054 -14.881  12.090
  169    HE2  PHE  23           2HE      PHE  23   7.032 -13.728  11.113
  170    HZ   PHE  23           HZ       PHE  23   5.342 -14.328  12.799
  171    H    ASN  24           H        ASN  24   5.633 -15.113   4.248
  172    HA   ASN  24           HA       ASN  24   4.881 -15.942   2.433
  173   1HB   ASN  24          2HB       ASN  24   3.784 -18.234   4.128
  174   2HB   ASN  24          1HB       ASN  24   4.085 -18.287   2.351
  175   1HD2  ASN  24          1HD2      ASN  24   5.328 -19.658   4.845
  176   2HD2  ASN  24          2HD2      ASN  24   7.053 -19.474   4.592
  177    H    MET  25           H        MET  25   3.223 -14.002   3.642
  178    HA   MET  25           HA       MET  25   0.584 -14.688   2.631
  179   1HB   MET  25          2HB       MET  25   1.731 -12.333   4.174
  180   2HB   MET  25          1HB       MET  25   0.068 -12.331   3.665
  181   1HG   MET  25          2HG       MET  25   0.081 -14.755   4.966
  182   2HG   MET  25          1HG       MET  25   1.443 -13.959   5.814
  183   1HE   MET  25          1HE       MET  25  -3.042 -12.690   5.817
  184   2HE   MET  25          2HE       MET  25  -2.338 -14.116   4.993
  185   3HE   MET  25          3HE       MET  25  -2.031 -12.460   4.355
  186    HA   PRO  26           HA       PRO  26   1.524 -11.683  -0.643
  187   1HB   PRO  26          2HB       PRO  26  -1.102 -10.432  -0.766
  188   2HB   PRO  26          1HB       PRO  26  -0.504 -11.784  -1.762
  189   1HG   PRO  26          2HG       PRO  26  -2.541 -11.890   0.324
  190   2HG   PRO  26          1HG       PRO  26  -1.927 -13.201  -0.734
  191   1HD   PRO  26          2HD       PRO  26  -1.134 -12.285   2.066
  192   2HD   PRO  26          1HD       PRO  26  -1.014 -13.988   1.468
  193    H    LEU  27           H        LEU  27   1.883  -9.250  -0.685
  194    HA   LEU  27           HA       LEU  27   1.939  -8.157   1.915
  195   1HB   LEU  27          2HB       LEU  27   3.256  -7.707  -0.403
  196   2HB   LEU  27          1HB       LEU  27   2.128  -6.333  -0.491
  197    HG   LEU  27           HG       LEU  27   3.830  -7.112   1.943
  198   1HD1  LEU  27          1HD1      LEU  27   4.513  -4.987  -0.182
  199   2HD1  LEU  27          2HD1      LEU  27   5.293  -6.612  -0.019
  200   3HD1  LEU  27          3HD1      LEU  27   5.476  -5.400   1.294
  201   1HD2  LEU  27          1HD2      LEU  27   3.499  -4.710   2.690
  202   2HD2  LEU  27          2HD2      LEU  27   1.940  -5.593   2.571
  203   3HD2  LEU  27          3HD2      LEU  27   2.416  -4.443   1.264
  204    H    THR  28           H        THR  28   0.115  -7.766   3.004
  205    HA   THR  28           HA       THR  28  -2.101  -6.599   1.466
  206    HB   THR  28           HB       THR  28  -3.606  -7.816   2.153
  207    HG1  THR  28           1HG      THR  28  -2.423  -8.043   4.707
  208   1HG2  THR  28          1HG2      THR  28  -1.326  -9.602   3.215
  209   2HG2  THR  28          2HG2      THR  28  -1.628  -9.259   1.466
  210   3HG2  THR  28          3HG2      THR  28  -2.889 -10.115   2.444
  211    H    ILE  29           H        ILE  29  -3.492  -5.241   2.485
  212    HA   ILE  29           HA       ILE  29  -2.424  -3.763   4.828
  213    HB   ILE  29           HB       ILE  29  -3.662  -2.571   2.365
  214   1HG1  ILE  29          2HG1      ILE  29  -0.894  -2.643   3.644
  215   2HG1  ILE  29          1HG1      ILE  29  -1.355  -3.163   2.000
  216   1HG2  ILE  29          1HG2      ILE  29  -2.965  -1.422   5.161
  217   2HG2  ILE  29          2HG2      ILE  29  -4.586  -1.452   4.336
  218   3HG2  ILE  29          3HG2      ILE  29  -3.297  -0.395   3.734
  219   1HD1  ILE  29          1HD1      ILE  29  -1.824  -0.830   1.312
  220   2HD1  ILE  29          2HD1      ILE  29  -0.134  -1.025   1.915
  221   3HD1  ILE  29          3HD1      ILE  29  -1.361  -0.244   2.965
  222    H    SER  30           H        SER  30  -3.967  -3.111   6.331
  223    HA   SER  30           HA       SER  30  -6.570  -4.447   6.077
  224   1HB   SER  30          2HB       SER  30  -5.262  -5.085   8.015
  225   2HB   SER  30          1HB       SER  30  -5.108  -3.380   8.536
  226    HG   SER  30           HG       SER  30  -6.801  -4.654   9.536
  227    H    ARG  31           H        ARG  31  -5.826  -1.540   7.992
  228    HA   ARG  31           HA       ARG  31  -8.079  -0.266   6.612
  229   1HB   ARG  31          2HB       ARG  31  -8.452  -1.574   8.780
  230   2HB   ARG  31          1HB       ARG  31  -7.504  -0.322   9.611
  231   1HG   ARG  31          2HG       ARG  31  -9.196   1.388   8.935
  232   2HG   ARG  31          1HG       ARG  31 -10.067   0.164   7.957
  233   1HD   ARG  31          2HD       ARG  31 -10.628  -1.144   9.969
  234   2HD   ARG  31          1HD       ARG  31  -9.716   0.014  11.025
  235    HE   ARG  31           HE       ARG  31 -11.285   1.814   9.968
  236   1HH1  ARG  31          1HH1      ARG  31 -12.488  -1.526  10.550
  237   2HH1  ARG  31          2HH1      ARG  31 -14.094  -0.966  10.824
  238   1HH2  ARG  31          1HH2      ARG  31 -13.405   2.461  10.487
  239   2HH2  ARG  31          2HH2      ARG  31 -14.543   1.307  11.045
  240    H    ILE  32           H        ILE  32  -8.231   2.001   6.704
  241    HA   ILE  32           HA       ILE  32  -5.770   3.473   6.903
  242    HB   ILE  32           HB       ILE  32  -8.596   3.937   6.006
  243   1HG1  ILE  32          2HG1      ILE  32  -7.704   4.838   4.001
  244   2HG1  ILE  32          1HG1      ILE  32  -6.029   4.777   4.517
  245   1HG2  ILE  32          1HG2      ILE  32  -6.528   6.151   6.516
  246   2HG2  ILE  32          2HG2      ILE  32  -8.193   6.004   7.263
  247   3HG2  ILE  32          3HG2      ILE  32  -8.010   6.321   5.513
  248   1HD1  ILE  32          1HD1      ILE  32  -6.205   2.195   4.456
  249   2HD1  ILE  32          2HD1      ILE  32  -6.576   3.004   2.885
  250   3HD1  ILE  32          3HD1      ILE  32  -7.931   2.413   3.918
  251    H    THR  33           H        THR  33  -5.369   5.054   8.503
  252    HA   THR  33           HA       THR  33  -7.099   5.117  10.805
  253    HB   THR  33           HB       THR  33  -4.628   6.748  10.162
  254    HG1  THR  33           1HG      THR  33  -3.836   5.507  11.874
  255   1HG2  THR  33          1HG2      THR  33  -4.832   7.528  12.545
  256   2HG2  THR  33          2HG2      THR  33  -6.355   6.578  12.736
  257   3HG2  THR  33          3HG2      THR  33  -6.335   7.997  11.669
  258    HA   PRO  34           HA       PRO  34  -9.366   8.090   8.531
  259   1HB   PRO  34          2HB       PRO  34 -11.224   8.977  10.354
  260   2HB   PRO  34          1HB       PRO  34 -11.021   7.199   9.940
  261   1HG   PRO  34          2HG       PRO  34  -9.634   8.502  12.325
  262   2HG   PRO  34          1HG       PRO  34 -10.905   7.193  12.363
  263   1HD   PRO  34          2HD       PRO  34  -8.291   6.477  12.160
  264   2HD   PRO  34          1HD       PRO  34  -9.486   5.683  11.047
  265    H    GLY  35           H        GLY  35 -10.006  10.404   8.362
  266   1HA   GLY  35          2HA       GLY  35  -9.549  12.552   8.467
  267   2HA   GLY  35          1HA       GLY  35  -8.554  12.280   9.927
  268    H    SER  36           H        SER  36  -7.094  10.260   7.965
  269    HA   SER  36           HA       SER  36  -5.021  12.165   7.405
  270   1HB   SER  36          2HB       SER  36  -3.608  10.220   7.037
  271   2HB   SER  36          1HB       SER  36  -4.569   9.991   8.520
  272    HG   SER  36           HG       SER  36  -5.645   8.412   7.582
  273    H    LYS  37           H        LYS  37  -3.668  11.773   5.344
  274    HA   LYS  37           HA       LYS  37  -5.117  12.246   3.036
  275   1HB   LYS  37          2HB       LYS  37  -2.322  11.136   3.507
  276   2HB   LYS  37          1HB       LYS  37  -2.918  11.580   1.882
  277   1HG   LYS  37          2HG       LYS  37  -2.613  13.516   4.255
  278   2HG   LYS  37          1HG       LYS  37  -1.417  13.242   2.963
  279   1HD   LYS  37          2HD       LYS  37  -2.378  15.042   1.991
  280   2HD   LYS  37          1HD       LYS  37  -3.540  13.841   1.382
  281   1HE   LYS  37          2HE       LYS  37  -4.791  15.740   2.224
  282   2HE   LYS  37          1HE       LYS  37  -5.032  14.406   3.423
  283   1HZ   LYS  37          1HZ       LYS  37  -3.156  15.493   4.717
  284   2HZ   LYS  37          2HZ       LYS  37  -4.573  16.343   4.634
  285   3HZ   LYS  37          3HZ       LYS  37  -3.292  16.824   3.686
  286    H    ALA  38           H        ALA  38  -4.318   9.238   4.569
  287    HA   ALA  38           HA       ALA  38  -4.748   7.493   2.361
  288   1HB   ALA  38          1HB       ALA  38  -4.802   6.863   5.331
  289   2HB   ALA  38          2HB       ALA  38  -3.295   7.073   4.362
  290   3HB   ALA  38          3HB       ALA  38  -4.437   5.775   3.934
  291    H    ALA  39           H        ALA  39  -6.883   9.121   4.626
  292    HA   ALA  39           HA       ALA  39  -9.107   7.514   3.716
  293   1HB   ALA  39          1HB       ALA  39  -8.930   8.221   6.132
  294   2HB   ALA  39          2HB       ALA  39 -10.391   8.939   5.368
  295   3HB   ALA  39          3HB       ALA  39  -8.906   9.941   5.628
  296    H    GLN  40           H        GLN  40  -7.940  10.849   3.519
  297    HA   GLN  40           HA       GLN  40 -10.051  12.093   2.415
  298   1HB   GLN  40          2HB       GLN  40  -7.050  12.437   2.297
  299   2HB   GLN  40          1HB       GLN  40  -8.037  13.561   1.352
  300   1HG   GLN  40          2HG       GLN  40  -8.462  13.133   4.380
  301   2HG   GLN  40          1HG       GLN  40  -7.347  14.354   3.687
  302   1HE2  GLN  40          1HE2      GLN  40  -8.580  15.545   1.635
  303   2HE2  GLN  40          2HE2      GLN  40 -10.054  16.306   2.171
  304    H    SER  41           H        SER  41  -7.491  10.510   0.533
  305    HA   SER  41           HA       SER  41  -8.521  11.802  -1.850
  306   1HB   SER  41          2HB       SER  41  -6.102  11.821  -1.212
  307   2HB   SER  41          1HB       SER  41  -6.035  10.069  -1.492
  308    HG   SER  41           HG       SER  41  -6.201  12.207  -3.277
  309    H    GLN  42           H        GLN  42  -7.385   9.707  -3.587
  310    HA   GLN  42           HA       GLN  42  -9.758   8.156  -4.001
  311   1HB   GLN  42          2HB       GLN  42  -7.002   8.135  -5.351
  312   2HB   GLN  42          1HB       GLN  42  -8.482   7.368  -6.004
  313   1HG   GLN  42          2HG       GLN  42  -9.551   9.578  -6.306
  314   2HG   GLN  42          1HG       GLN  42  -8.172  10.423  -5.538
  315   1HE2  GLN  42          1HE2      GLN  42  -5.956  10.025  -6.589
  316   2HE2  GLN  42          2HE2      GLN  42  -5.949   9.985  -8.334
  317    H    LEU  43           H        LEU  43  -7.115   7.881  -2.050
  318    HA   LEU  43           HA       LEU  43  -6.287   5.243  -2.465
  319   1HB   LEU  43          2HB       LEU  43  -5.152   7.372  -1.311
  320   2HB   LEU  43          1HB       LEU  43  -5.933   6.767   0.163
  321    HG   LEU  43           HG       LEU  43  -4.800   4.449  -0.563
  322   1HD1  LEU  43          1HD1      LEU  43  -3.009   6.491  -2.040
  323   2HD1  LEU  43          2HD1      LEU  43  -4.071   5.289  -2.836
  324   3HD1  LEU  43          3HD1      LEU  43  -2.683   4.734  -1.832
  325   1HD2  LEU  43          1HD2      LEU  43  -2.554   5.351   0.550
  326   2HD2  LEU  43          2HD2      LEU  43  -4.048   5.336   1.516
  327   3HD2  LEU  43          3HD2      LEU  43  -3.470   6.876   0.766
  328    H    SER  44           H        SER  44  -7.225   3.364  -1.901
  329    HA   SER  44           HA       SER  44  -7.986   3.239   0.886
  330   1HB   SER  44          2HB       SER  44  -9.769   1.610   0.556
  331   2HB   SER  44          1HB       SER  44 -10.168   3.241  -0.050
  332    HG   SER  44           HG       SER  44 -10.848   1.704  -1.431
  333    H    GLN  45           H        GLN  45  -5.510   2.744   0.697
  334    HA   GLN  45           HA       GLN  45  -4.664   0.292   0.056
  335   1HB   GLN  45          2HB       GLN  45  -4.245   2.127   2.479
  336   2HB   GLN  45          1HB       GLN  45  -3.222   0.694   2.140
  337   1HG   GLN  45          2HG       GLN  45  -2.511   1.543  -0.003
  338   2HG   GLN  45          1HG       GLN  45  -3.545   3.004   0.135
  339   1HE2  GLN  45          2HE2      GLN  45  -0.600   2.224   0.157
  340   2HE2  GLN  45          1HE2      GLN  45   0.171   3.351   1.288
  341    H    GLY  46           H        GLY  46  -5.670  -1.593   0.356
  342   1HA   GLY  46          2HA       GLY  46  -5.799  -2.741   2.855
  343   2HA   GLY  46          1HA       GLY  46  -7.420  -2.057   2.535
  344    H    ASP  47           H        ASP  47  -4.965  -3.627   0.422
  345    HA   ASP  47           HA       ASP  47  -6.550  -5.977   0.151
  346   1HB   ASP  47          2HB       ASP  47  -7.412  -3.963  -1.470
  347   2HB   ASP  47          1HB       ASP  47  -6.028  -4.444  -2.464
  348    H    LEU  48           H        LEU  48  -5.218  -6.927  -2.217
  349    HA   LEU  48           HA       LEU  48  -2.603  -7.343  -1.080
  350   1HB   LEU  48          2HB       LEU  48  -3.879  -8.522  -3.596
  351   2HB   LEU  48          1HB       LEU  48  -2.277  -8.929  -2.917
  352    HG   LEU  48           HG       LEU  48  -3.470 -10.683  -2.072
  353   1HD1  LEU  48          1HD1      LEU  48  -4.045 -10.431   0.283
  354   2HD1  LEU  48          2HD1      LEU  48  -4.322  -8.664   0.112
  355   3HD1  LEU  48          3HD1      LEU  48  -2.647  -9.318  -0.103
  356   1HD2  LEU  48          1HD2      LEU  48  -5.662  -9.773  -3.087
  357   2HD2  LEU  48          2HD2      LEU  48  -5.866  -8.837  -1.538
  358   3HD2  LEU  48          3HD2      LEU  48  -5.856 -10.660  -1.490
  359    H    VAL  49           H        VAL  49  -1.002  -6.088  -1.463
  360    HA   VAL  49           HA       VAL  49  -1.202  -4.114  -3.513
  361    HB   VAL  49           HB       VAL  49   0.903  -4.638  -1.384
  362   1HG1  VAL  49          1HG1      VAL  49   1.359  -2.190  -1.687
  363   2HG1  VAL  49          2HG1      VAL  49   0.221  -2.151  -3.096
  364   3HG1  VAL  49          3HG1      VAL  49   1.747  -3.126  -3.188
  365   1HG2  VAL  49          1HG2      VAL  49  -1.642  -2.877  -1.379
  366   2HG2  VAL  49          2HG2      VAL  49  -0.328  -2.814  -0.151
  367   3HG2  VAL  49          3HG2      VAL  49  -1.309  -4.302  -0.321
  368    H    VAL  50           H        VAL  50  -0.219  -4.318  -5.538
  369    HA   VAL  50           HA       VAL  50   1.324  -6.719  -5.969
  370    HB   VAL  50           HB       VAL  50   0.471  -4.843  -8.175
  371   1HG1  VAL  50          1HG1      VAL  50   2.064  -6.733  -8.646
  372   2HG1  VAL  50          2HG1      VAL  50   0.456  -7.011  -9.393
  373   3HG1  VAL  50          3HG1      VAL  50   0.907  -7.890  -7.886
  374   1HG2  VAL  50          1HG2      VAL  50  -1.579  -5.061  -7.032
  375   2HG2  VAL  50          2HG2      VAL  50  -1.304  -6.819  -6.635
  376   3HG2  VAL  50          3HG2      VAL  50  -1.589  -6.284  -8.340
  377    H    ALA  51           H        ALA  51   1.502  -3.359  -7.109
  378    HA   ALA  51           HA       ALA  51   4.429  -3.532  -7.052
  379   1HB   ALA  51          1HB       ALA  51   4.492  -2.082  -9.085
  380   2HB   ALA  51          2HB       ALA  51   2.690  -2.096  -9.142
  381   3HB   ALA  51          3HB       ALA  51   3.616  -3.615  -9.411
  382    H    ILE  52           H        ILE  52   5.568  -1.826  -6.440
  383    HA   ILE  52           HA       ILE  52   4.144   0.527  -5.468
  384    HB   ILE  52           HB       ILE  52   5.393  -1.466  -3.948
  385   1HG1  ILE  52          2HG1      ILE  52   4.591   1.381  -3.130
  386   2HG1  ILE  52          1HG1      ILE  52   3.451   0.027  -3.425
  387   1HG2  ILE  52          1HG2      ILE  52   7.602  -0.607  -4.413
  388   2HG2  ILE  52          2HG2      ILE  52   7.170  -0.295  -2.715
  389   3HG2  ILE  52          3HG2      ILE  52   7.147   1.069  -3.928
  390   1HD1  ILE  52          1HD1      ILE  52   5.613   0.130  -1.217
  391   2HD1  ILE  52          2HD1      ILE  52   4.594  -1.314  -1.601
  392   3HD1  ILE  52          3HD1      ILE  52   3.826   0.206  -1.020
  393    H    ASP  53           H        ASP  53   4.821   2.266  -6.524
  394    HA   ASP  53           HA       ASP  53   5.916   3.508  -7.932
  395   1HB   ASP  53          2HB       ASP  53   8.114   2.360  -6.186
  396   2HB   ASP  53          1HB       ASP  53   8.568   3.467  -7.504
  397    H    GLY  54           H        GLY  54   5.317   0.730  -8.842
  398   1HA   GLY  54          2HA       GLY  54   5.344  -0.085 -10.920
  399   2HA   GLY  54          1HA       GLY  54   6.760   0.929 -11.337
  400    H    VAL  55           H        VAL  55   7.258  -0.753  -8.405
  401    HA   VAL  55           HA       VAL  55   8.617  -2.932  -9.813
  402    HB   VAL  55           HB       VAL  55   9.314  -1.586  -7.179
  403   1HG1  VAL  55          1HG1      VAL  55   9.932  -4.010  -7.168
  404   2HG1  VAL  55          2HG1      VAL  55  11.398  -2.994  -7.355
  405   3HG1  VAL  55          3HG1      VAL  55  10.709  -3.831  -8.792
  406   1HG2  VAL  55          1HG2      VAL  55   9.856  -0.095  -9.094
  407   2HG2  VAL  55          2HG2      VAL  55  10.663  -1.466  -9.956
  408   3HG2  VAL  55          3HG2      VAL  55  11.358  -0.816  -8.429
  409    H    ASN  56           H        ASN  56   7.987  -5.007  -9.181
  410    HA   ASN  56           HA       ASN  56   5.680  -5.150  -7.589
  411   1HB   ASN  56          2HB       ASN  56   7.139  -6.861  -9.368
  412   2HB   ASN  56          1HB       ASN  56   7.058  -7.773  -7.848
  413   1HD2  ASN  56          1HD2      ASN  56   5.287  -9.103  -7.833
  414   2HD2  ASN  56          2HD2      ASN  56   3.687  -8.640  -8.338
  415    H    THR  57           H        THR  57   5.244  -6.100  -5.633
  416    HA   THR  57           HA       THR  57   7.219  -5.647  -3.680
  417    HB   THR  57           HB       THR  57   5.385  -6.263  -2.103
  418    HG1  THR  57           1HG      THR  57   3.314  -6.320  -3.369
  419   1HG2  THR  57          1HG2      THR  57   4.022  -4.266  -2.661
  420   2HG2  THR  57          2HG2      THR  57   4.658  -4.251  -4.349
  421   3HG2  THR  57          3HG2      THR  57   5.761  -3.916  -2.976
  422    H    ASP  58           H        ASP  58   6.991  -8.276  -5.588
  423    HA   ASP  58           HA       ASP  58   7.236 -10.439  -3.979
  424   1HB   ASP  58          2HB       ASP  58   8.654  -9.548  -6.549
  425   2HB   ASP  58          1HB       ASP  58   9.081 -11.134  -5.810
  426    H    THR  59           H        THR  59   9.637  -7.898  -4.225
  427    HA   THR  59           HA       THR  59  11.236  -9.373  -2.265
  428    HB   THR  59           HB       THR  59  12.301  -9.039  -4.441
  429    HG1  THR  59           1HG      THR  59  14.054  -8.923  -3.456
  430   1HG2  THR  59          1HG2      THR  59  12.221  -6.038  -3.696
  431   2HG2  THR  59          2HG2      THR  59  11.348  -6.817  -5.066
  432   3HG2  THR  59          3HG2      THR  59  13.148  -6.778  -5.047
  433    H    MET  60           H        MET  60   8.828  -7.853  -1.617
  434    HA   MET  60           HA       MET  60  10.123  -6.022   0.255
  435   1HB   MET  60          2HB       MET  60   7.669  -5.750  -1.538
  436   2HB   MET  60          1HB       MET  60   7.948  -4.659  -0.121
  437   1HG   MET  60          2HG       MET  60  10.136  -3.952  -1.175
  438   2HG   MET  60          1HG       MET  60   9.799  -5.025  -2.555
  439   1HE   MET  60          1HE       MET  60   9.544  -3.902  -4.598
  440   2HE   MET  60          2HE       MET  60  10.539  -2.696  -3.711
  441   3HE   MET  60          3HE       MET  60   9.168  -2.162  -4.740
  442    H    THR  61           H        THR  61   9.584  -6.339   2.315
  443    HA   THR  61           HA       THR  61   7.400  -8.126   3.022
  444    HB   THR  61           HB       THR  61   8.316  -7.869   5.310
  445    HG1  THR  61           1HG      THR  61  10.667  -6.854   4.373
  446   1HG2  THR  61          1HG2      THR  61   9.060  -9.721   3.790
  447   2HG2  THR  61          2HG2      THR  61  10.411  -9.147   4.838
  448   3HG2  THR  61          3HG2      THR  61  10.339  -8.648   3.106
  449    H    HIS  62           H        HIS  62   6.115  -7.219   5.065
  450    HA   HIS  62           HA       HIS  62   4.785  -4.960   4.580
  451   1HB   HIS  62          2HB       HIS  62   4.011  -4.954   6.804
  452   2HB   HIS  62          1HB       HIS  62   4.289  -6.652   6.352
  453    HD1  HIS  62           1HD      HIS  62   6.645  -7.709   7.410
  454    HD2  HIS  62           2HD      HIS  62   5.066  -4.285   9.231
  455    HE1  HIS  62           1HE      HIS  62   7.726  -7.493   9.708
  456    H    LEU  63           H        LEU  63   7.511  -5.080   6.806
  457    HA   LEU  63           HA       LEU  63   7.931  -2.407   7.279
  458   1HB   LEU  63          2HB       LEU  63   9.009  -4.313   8.472
  459   2HB   LEU  63          1HB       LEU  63   9.944  -4.702   6.998
  460    HG   LEU  63           HG       LEU  63  11.039  -2.411   7.154
  461   1HD1  LEU  63          1HD1      LEU  63   9.366  -1.168   8.515
  462   2HD1  LEU  63          2HD1      LEU  63  10.940  -1.242   9.382
  463   3HD1  LEU  63          3HD1      LEU  63   9.595  -2.322   9.886
  464   1HD2  LEU  63          1HD2      LEU  63  12.135  -4.464   7.928
  465   2HD2  LEU  63          2HD2      LEU  63  11.363  -4.290   9.561
  466   3HD2  LEU  63          3HD2      LEU  63  12.566  -3.061   8.986
  467    H    GLU  64           H        GLU  64   9.523  -4.358   4.659
  468    HA   GLU  64           HA       GLU  64  10.969  -2.170   3.799
  469   1HB   GLU  64          2HB       GLU  64  10.884  -4.858   3.092
  470   2HB   GLU  64          1HB       GLU  64  10.290  -4.076   1.601
  471   1HG   GLU  64          2HG       GLU  64  12.350  -2.440   1.928
  472   2HG   GLU  64          1HG       GLU  64  12.852  -3.521   3.266
  473    H    ALA  65           H        ALA  65   7.792  -3.326   2.637
  474    HA   ALA  65           HA       ALA  65   7.554  -1.431   0.589
  475   1HB   ALA  65          1HB       ALA  65   6.347  -3.560   0.746
  476   2HB   ALA  65          2HB       ALA  65   5.166  -2.188   0.604
  477   3HB   ALA  65          3HB       ALA  65   5.456  -2.985   2.209
  478    H    GLN  66           H        GLN  66   6.566  -1.344   4.015
  479    HA   GLN  66           HA       GLN  66   5.348   1.139   4.006
  480   1HB   GLN  66          2HB       GLN  66   5.041  -0.064   5.952
  481   2HB   GLN  66          1HB       GLN  66   6.687  -0.738   5.918
  482   1HG   GLN  66          2HG       GLN  66   7.700   1.202   6.872
  483   2HG   GLN  66          1HG       GLN  66   6.152   2.148   6.827
  484   1HE2  GLN  66          1HE2      GLN  66   4.260   0.769   7.954
  485   2HE2  GLN  66          2HE2      GLN  66   4.706  -0.082   9.419
  486    H    ASN  67           H        ASN  67   8.799   0.281   4.386
  487    HA   ASN  67           HA       ASN  67   9.678   2.934   4.616
  488   1HB   ASN  67          2HB       ASN  67  11.012   0.276   3.885
  489   2HB   ASN  67          1HB       ASN  67  11.953   1.795   4.016
  490   1HD2  ASN  67          1HD2      ASN  67  12.595  -0.281   5.667
  491   2HD2  ASN  67          2HD2      ASN  67  12.186   0.137   7.296
  492    H    LYS  68           H        LYS  68   9.349   0.885   1.706
  493    HA   LYS  68           HA       LYS  68  10.273   2.777  -0.080
  494   1HB   LYS  68          2HB       LYS  68   7.889   0.958  -0.665
  495   2HB   LYS  68          1HB       LYS  68   9.002   1.734  -1.829
  496   1HG   LYS  68          2HG       LYS  68   9.478  -0.718  -0.087
  497   2HG   LYS  68          1HG       LYS  68   9.442  -0.550  -1.844
  498   1HD   LYS  68          2HD       LYS  68  11.607   0.677  -1.822
  499   2HD   LYS  68          1HD       LYS  68  11.599   0.644  -0.022
  500   1HE   LYS  68          2HE       LYS  68  11.432  -1.910  -0.131
  501   2HE   LYS  68          1HE       LYS  68  11.727  -1.807  -1.912
  502   1HZ   LYS  68          1HZ       LYS  68  13.875  -0.941  -1.512
  503   2HZ   LYS  68          2HZ       LYS  68  13.669  -2.213  -0.389
  504   3HZ   LYS  68          3HZ       LYS  68  13.538  -0.628   0.131
  505    H    ILE  69           H        ILE  69   6.950   2.301   1.134
  506    HA   ILE  69           HA       ILE  69   5.709   4.368  -0.123
  507    HB   ILE  69           HB       ILE  69   5.289   2.902   2.459
  508   1HG1  ILE  69          2HG1      ILE  69   4.198   2.954  -0.342
  509   2HG1  ILE  69          1HG1      ILE  69   4.294   1.605   0.837
  510   1HG2  ILE  69          1HG2      ILE  69   4.690   5.141   3.153
  511   2HG2  ILE  69          2HG2      ILE  69   3.202   4.215   2.874
  512   3HG2  ILE  69          3HG2      ILE  69   3.791   5.385   1.608
  513   1HD1  ILE  69          1HD1      ILE  69   2.346   2.235   2.011
  514   2HD1  ILE  69          2HD1      ILE  69   2.005   2.027   0.260
  515   3HD1  ILE  69          3HD1      ILE  69   2.084   3.686   0.953
  516    H    LYS  70           H        LYS  70   7.445   4.608   2.992
  517    HA   LYS  70           HA       LYS  70   6.766   7.300   3.320
  518   1HB   LYS  70          2HB       LYS  70   8.515   5.275   4.640
  519   2HB   LYS  70          1HB       LYS  70   9.023   6.960   4.895
  520   1HG   LYS  70          2HG       LYS  70   7.708   6.386   6.692
  521   2HG   LYS  70          1HG       LYS  70   6.776   7.588   5.748
  522   1HD   LYS  70          2HD       LYS  70   5.259   5.900   4.888
  523   2HD   LYS  70          1HD       LYS  70   6.315   4.561   5.438
  524   1HE   LYS  70          2HE       LYS  70   4.631   6.390   7.255
  525   2HE   LYS  70          1HE       LYS  70   4.406   4.630   6.875
  526   1HZ   LYS  70          1HZ       LYS  70   6.458   5.935   8.559
  527   2HZ   LYS  70          2HZ       LYS  70   6.856   4.506   7.785
  528   3HZ   LYS  70          3HZ       LYS  70   5.550   4.549   8.850
  529    H    SER  71           H        SER  71   8.903   6.201   0.967
  530    HA   SER  71           HA       SER  71  10.910   8.223   1.505
  531   1HB   SER  71          2HB       SER  71  11.406   5.868   0.656
  532   2HB   SER  71          1HB       SER  71  10.675   6.335  -0.904
  533    HG   SER  71           HG       SER  71  12.451   7.365  -1.342
  534    H    ALA  72           H        ALA  72   7.953   7.939  -0.053
  535    HA   ALA  72           HA       ALA  72   8.524   9.829  -2.188
  536   1HB   ALA  72          1HB       ALA  72   7.523   7.590  -2.648
  537   2HB   ALA  72          2HB       ALA  72   6.373   8.901  -3.110
  538   3HB   ALA  72          3HB       ALA  72   6.168   7.971  -1.551
  539    H    SER  73           H        SER  73   7.303  11.627  -2.634
  540    HA   SER  73           HA       SER  73   5.093  12.292  -0.907
  541   1HB   SER  73          2HB       SER  73   5.801  14.531  -0.312
  542   2HB   SER  73          1HB       SER  73   6.930  13.320   0.356
  543    HG   SER  73           HG       SER  73   7.508  15.377  -1.128
  544    H    TYR  74           H        TYR  74   7.103  13.215  -3.699
  545    HA   TYR  74           HA       TYR  74   5.230  15.013  -4.764
  546   1HB   TYR  74          2HB       TYR  74   7.617  13.469  -5.938
  547   2HB   TYR  74          1HB       TYR  74   6.603  14.548  -6.947
  548    HD1  TYR  74           1HD      TYR  74   6.907  16.816  -6.944
  549    HD2  TYR  74           2HD      TYR  74   8.736  14.498  -3.890
  550    HE1  TYR  74           1HE      TYR  74   8.177  18.772  -6.225
  551    HE2  TYR  74           2HE      TYR  74   9.972  16.448  -3.135
  552    HH   TYR  74           HH       TYR  74  10.344  18.635  -3.395
  553    H    ASN  75           H        ASN  75   5.963  11.612  -5.582
  554    HA   ASN  75           HA       ASN  75   3.170  11.194  -5.575
  555   1HB   ASN  75          2HB       ASN  75   3.035   9.945  -7.779
  556   2HB   ASN  75          1HB       ASN  75   3.084  11.728  -7.857
  557   1HD2  ASN  75          1HD2      ASN  75   5.935   9.478  -7.507
  558   2HD2  ASN  75          2HD2      ASN  75   6.576   9.893  -9.086
  559    H    LEU  76           H        LEU  76   2.728   9.333  -4.571
  560    HA   LEU  76           HA       LEU  76   4.759   7.193  -4.722
  561   1HB   LEU  76          2HB       LEU  76   4.094   7.934  -2.409
  562   2HB   LEU  76          1HB       LEU  76   2.385   7.666  -2.824
  563    HG   LEU  76           HG       LEU  76   2.769   5.217  -3.062
  564   1HD1  LEU  76          1HD1      LEU  76   5.665   5.845  -2.170
  565   2HD1  LEU  76          2HD1      LEU  76   5.212   5.212  -3.808
  566   3HD1  LEU  76          3HD1      LEU  76   4.940   4.204  -2.342
  567   1HD2  LEU  76          1HD2      LEU  76   3.054   4.735  -0.713
  568   2HD2  LEU  76          2HD2      LEU  76   2.213   6.321  -0.847
  569   3HD2  LEU  76          3HD2      LEU  76   3.987   6.249  -0.452
  570    H    SER  77           H        SER  77   4.276   5.532  -6.114
  571    HA   SER  77           HA       SER  77   1.540   5.533  -7.188
  572   1HB   SER  77          2HB       SER  77   3.497   5.947  -8.712
  573   2HB   SER  77          1HB       SER  77   4.074   4.295  -8.345
  574    HG   SER  77           HG       SER  77   2.852   4.301 -10.201
  575    H    LEU  78           H        LEU  78   0.274   4.159  -5.938
  576    HA   LEU  78           HA       LEU  78   1.404   1.530  -5.329
  577   1HB   LEU  78          2HB       LEU  78  -1.234   2.673  -4.353
  578   2HB   LEU  78          1HB       LEU  78  -0.382   1.222  -3.776
  579    HG   LEU  78           HG       LEU  78  -0.096   2.759  -2.069
  580   1HD1  LEU  78          1HD1      LEU  78   2.270   3.144  -1.851
  581   2HD1  LEU  78          2HD1      LEU  78   2.535   2.996  -3.628
  582   3HD1  LEU  78          3HD1      LEU  78   1.982   1.565  -2.664
  583   1HD2  LEU  78          1HD2      LEU  78   0.476   5.033  -2.111
  584   2HD2  LEU  78          2HD2      LEU  78  -0.895   4.784  -3.253
  585   3HD2  LEU  78          3HD2      LEU  78   0.766   5.038  -3.896
  586    H    THR  79           H        THR  79   0.673  -0.281  -6.309
  587    HA   THR  79           HA       THR  79  -1.919  -0.169  -7.658
  588    HB   THR  79           HB       THR  79   0.412  -1.904  -8.552
  589    HG1  THR  79           1HG      THR  79  -0.405   0.595  -9.602
  590   1HG2  THR  79          1HG2      THR  79  -2.220  -0.910  -9.832
  591   2HG2  THR  79          2HG2      THR  79  -1.912  -2.575  -9.198
  592   3HG2  THR  79          3HG2      THR  79  -0.992  -1.973 -10.637
  593    H    LEU  80           H        LEU  80  -3.243  -1.378  -6.259
  594    HA   LEU  80           HA       LEU  80  -2.329  -4.031  -5.440
  595   1HB   LEU  80          2HB       LEU  80  -3.526  -3.840  -3.413
  596   2HB   LEU  80          1HB       LEU  80  -2.303  -2.505  -3.513
  597    HG   LEU  80           HG       LEU  80  -5.268  -2.352  -4.020
  598   1HD1  LEU  80          1HD1      LEU  80  -4.611  -2.825  -1.665
  599   2HD1  LEU  80          2HD1      LEU  80  -5.399  -1.172  -1.853
  600   3HD1  LEU  80          3HD1      LEU  80  -3.576  -1.316  -1.674
  601   1HD2  LEU  80          1HD2      LEU  80  -2.903  -0.433  -4.112
  602   2HD2  LEU  80          2HD2      LEU  80  -4.510   0.278  -3.574
  603   3HD2  LEU  80          3HD2      LEU  80  -4.348  -0.492  -5.229
  604    H    GLN  81           H        GLN  81  -4.352  -5.444  -5.049
  605    HA   GLN  81           HA       GLN  81  -6.135  -5.082  -7.262
  606   1HB   GLN  81          2HB       GLN  81  -6.016  -7.117  -5.038
  607   2HB   GLN  81          1HB       GLN  81  -7.177  -7.195  -6.399
  608   1HG   GLN  81          2HG       GLN  81  -4.116  -7.213  -6.782
  609   2HG   GLN  81          1HG       GLN  81  -5.103  -8.686  -6.521
  610   1HE2  GLN  81          1HE2      GLN  81  -3.486  -7.672  -8.906
  611   2HE2  GLN  81          2HE2      GLN  81  -4.602  -7.838 -10.234
  612    H    LYS  82           H        LYS  82  -8.597  -5.091  -6.997
  613    HA   LYS  82           HA       LYS  82  -9.372  -4.655  -4.199
  614   1HB   LYS  82          2HB       LYS  82 -10.272  -3.279  -6.594
  615   2HB   LYS  82          1HB       LYS  82 -11.621  -4.256  -5.973
  616   1HG   LYS  82          2HG       LYS  82 -11.753  -2.052  -5.000
  617   2HG   LYS  82          1HG       LYS  82 -11.356  -3.227  -3.715
  618   1HD   LYS  82          2HD       LYS  82  -8.886  -2.271  -4.874
  619   2HD   LYS  82          1HD       LYS  82  -9.882  -0.830  -4.587
  620   1HE   LYS  82          2HE       LYS  82  -9.336  -2.996  -2.436
  621   2HE   LYS  82          1HE       LYS  82  -8.279  -1.555  -2.663
  622   1HZ   LYS  82          1HZ       LYS  82 -10.122  -1.479  -0.949
  623   2HZ   LYS  82          2HZ       LYS  82 -11.189  -1.217  -2.227
  624   3HZ   LYS  82          3HZ       LYS  82  -9.941  -0.124  -1.935
  625    H    SER  83           H        SER  83 -10.243  -6.318  -3.246
  626    HA   SER  83           HA       SER  83 -10.486  -8.765  -4.574
  627   1HB   SER  83          2HB       SER  83 -11.467  -7.940  -1.791
  628   2HB   SER  83          1HB       SER  83 -11.275  -9.631  -2.385
  629    HG   SER  83           HG       SER  83  -9.228  -7.670  -2.122
  630    H    LYS  84           H        LYS  84 -12.036  -9.029  -6.114
  631    HA   LYS  84           HA       LYS  84 -14.723  -8.076  -5.586
  632   1HB   LYS  84          2HB       LYS  84 -13.439  -9.245  -8.083
  633   2HB   LYS  84          1HB       LYS  84 -15.098  -8.571  -8.000
  634   1HG   LYS  84          2HG       LYS  84 -12.526  -6.945  -7.522
  635   2HG   LYS  84          1HG       LYS  84 -13.392  -7.107  -9.069
  636   1HD   LYS  84          2HD       LYS  84 -15.468  -6.175  -7.964
  637   2HD   LYS  84          1HD       LYS  84 -14.482  -5.805  -6.507
  638   1HE   LYS  84          2HE       LYS  84 -12.981  -4.331  -7.902
  639   2HE   LYS  84          1HE       LYS  84 -13.923  -4.791  -9.373
  640   1HZ   LYS  84          1HZ       LYS  84 -15.892  -3.794  -8.303
  641   2HZ   LYS  84          2HZ       LYS  84 -14.672  -2.695  -8.632
  642   3HZ   LYS  84          3HZ       LYS  84 -14.919  -3.199  -7.050
  643    H    ARG  85           H        ARG  85 -16.625  -9.367  -5.944
  644    HA   ARG  85           HA       ARG  85 -16.174 -12.229  -6.165
  645   1HB   ARG  85          2HB       ARG  85 -16.618 -11.234  -3.725
  646   2HB   ARG  85          1HB       ARG  85 -18.310 -11.248  -4.253
  647   1HG   ARG  85          2HG       ARG  85 -16.348 -13.649  -4.263
  648   2HG   ARG  85          1HG       ARG  85 -17.512 -13.265  -2.960
  649   1HD   ARG  85          2HD       ARG  85 -19.427 -13.598  -4.530
  650   2HD   ARG  85          1HD       ARG  85 -18.263 -14.105  -5.828
  651    HE   ARG  85           HE       ARG  85 -17.434 -15.830  -4.034
  652   1HH1  ARG  85          1HH1      ARG  85 -20.897 -14.892  -4.214
  653   2HH1  ARG  85          2HH1      ARG  85 -21.386 -16.492  -3.745
  654   1HH2  ARG  85          1HH2      ARG  85 -18.227 -17.882  -3.447
  655   2HH2  ARG  85          2HH2      ARG  85 -19.898 -18.234  -3.615
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1  -7.812  -8.278 -10.762
    2   2H    MET   1          2HT       MET   1  -8.381  -8.371 -12.337
    3   3H    MET   1          3HT       MET   1  -9.246  -7.496 -11.178
    4    HA   MET   1           HA       MET   1  -6.656  -6.860 -12.409
    5   1HB   MET   1          2HB       MET   1  -8.732  -6.363 -13.695
    6   2HB   MET   1          1HB       MET   1  -9.349  -5.392 -12.331
    7   1HG   MET   1          2HG       MET   1  -7.522  -3.752 -12.642
    8   2HG   MET   1          1HG       MET   1  -6.825  -4.734 -13.963
    9   1HE   MET   1          1HE       MET   1  -6.859  -2.234 -14.986
   10   2HE   MET   1          2HE       MET   1  -7.796  -1.683 -13.557
   11   3HE   MET   1          3HE       MET   1  -8.366  -1.280 -15.208
   12    H    ALA   2           H        ALA   2  -5.427  -5.032 -11.693
   13    HA   ALA   2           HA       ALA   2  -5.993  -4.289  -8.918
   14   1HB   ALA   2          1HB       ALA   2  -3.789  -5.353  -9.306
   15   2HB   ALA   2          2HB       ALA   2  -3.599  -3.623  -8.841
   16   3HB   ALA   2          3HB       ALA   2  -3.405  -4.121 -10.571
   17    H    TYR   3           H        TYR   3  -5.860  -2.182  -8.212
   18    HA   TYR   3           HA       TYR   3  -6.341  -0.217 -10.344
   19   1HB   TYR   3          2HB       TYR   3  -7.774   1.023  -9.161
   20   2HB   TYR   3          1HB       TYR   3  -8.327  -0.654  -8.855
   21    HD1  TYR   3           1HD      TYR   3  -7.793   2.405  -7.531
   22    HD2  TYR   3           2HD      TYR   3  -7.077  -1.667  -6.537
   23    HE1  TYR   3           1HE      TYR   3  -7.841   2.987  -5.137
   24    HE2  TYR   3           2HE      TYR   3  -7.126  -1.089  -4.169
   25    HH   TYR   3           HH       TYR   3  -8.265   1.791  -2.910
   26    H    SER   4           H        SER   4  -5.328   1.786 -10.252
   27    HA   SER   4           HA       SER   4  -3.043   1.864  -8.406
   28   1HB   SER   4          2HB       SER   4  -2.436   1.226 -10.801
   29   2HB   SER   4          1HB       SER   4  -2.938   2.874 -11.275
   30    HG   SER   4           HG       SER   4  -0.859   2.000  -9.576
   31    H    VAL   5           H        VAL   5  -2.871   3.707  -7.250
   32    HA   VAL   5           HA       VAL   5  -3.969   6.141  -8.376
   33    HB   VAL   5           HB       VAL   5  -5.649   6.013  -6.946
   34   1HG1  VAL   5          1HG1      VAL   5  -5.674   4.940  -4.755
   35   2HG1  VAL   5          2HG1      VAL   5  -3.985   4.337  -5.011
   36   3HG1  VAL   5          3HG1      VAL   5  -5.332   3.801  -6.100
   37   1HG2  VAL   5          1HG2      VAL   5  -5.264   7.342  -4.940
   38   2HG2  VAL   5          2HG2      VAL   5  -4.298   8.024  -6.298
   39   3HG2  VAL   5          3HG2      VAL   5  -3.496   7.052  -5.008
   40    H    THR   6           H        THR   6  -2.698   7.752  -8.379
   41    HA   THR   6           HA       THR   6  -0.095   7.521  -7.087
   42    HB   THR   6           HB       THR   6  -1.149   9.460  -9.159
   43    HG1  THR   6           1HG      THR   6  -0.133   8.170 -10.526
   44   1HG2  THR   6          1HG2      THR   6   0.690  10.502  -7.740
   45   2HG2  THR   6          2HG2      THR   6   1.325  10.076  -9.364
   46   3HG2  THR   6          3HG2      THR   6   1.698   9.021  -7.962
   47    H    LEU   7           H        LEU   7   0.137   8.433  -5.161
   48    HA   LEU   7           HA       LEU   7  -1.968  10.173  -4.187
   49   1HB   LEU   7          2HB       LEU   7  -1.358   7.928  -3.175
   50   2HB   LEU   7          1HB       LEU   7   0.252   8.582  -2.785
   51    HG   LEU   7           HG       LEU   7  -0.847  10.296  -1.284
   52   1HD1  LEU   7          1HD1      LEU   7  -3.404   8.672  -1.887
   53   2HD1  LEU   7          2HD1      LEU   7  -3.131  10.393  -2.326
   54   3HD1  LEU   7          3HD1      LEU   7  -3.237   9.925  -0.592
   55   1HD2  LEU   7          1HD2      LEU   7  -1.469   8.578   0.492
   56   2HD2  LEU   7          2HD2      LEU   7   0.081   8.218  -0.360
   57   3HD2  LEU   7          3HD2      LEU   7  -1.407   7.298  -0.783
   58    H    THR   8           H        THR   8  -1.639  12.200  -3.451
   59    HA   THR   8           HA       THR   8   1.064  13.315  -3.797
   60    HB   THR   8           HB       THR   8  -1.539  14.818  -4.230
   61    HG1  THR   8           1HG      THR   8  -1.645  13.436  -5.790
   62   1HG2  THR   8          1HG2      THR   8   0.568  16.186  -3.868
   63   2HG2  THR   8          2HG2      THR   8  -0.001  16.286  -5.569
   64   3HG2  THR   8          3HG2      THR   8   1.391  15.230  -5.157
   65    H    GLY   9           H        GLY   9   1.874  14.398  -1.943
   66   1HA   GLY   9          2HA       GLY   9   0.516  16.302  -0.727
   67   2HA   GLY   9          1HA       GLY   9   0.059  14.845   0.225
   68    HA   PRO  10           HA       PRO  10   4.294  15.926   1.646
   69   1HB   PRO  10          2HB       PRO  10   4.252  18.225   3.128
   70   2HB   PRO  10          1HB       PRO  10   4.516  18.206   1.344
   71   1HG   PRO  10          2HG       PRO  10   1.900  18.773   2.854
   72   2HG   PRO  10          1HG       PRO  10   2.618  19.707   1.472
   73   1HD   PRO  10          2HD       PRO  10   0.646  17.690   1.209
   74   2HD   PRO  10          1HD       PRO  10   1.831  18.113  -0.105
   75    H    GLY  11           H        GLY  11   4.604  14.581   3.266
   76   1HA   GLY  11          2HA       GLY  11   4.565  14.342   5.619
   77   2HA   GLY  11          1HA       GLY  11   2.807  14.719   5.594
   78    HA   PRO  12           HA       PRO  12   3.641  10.243   5.403
   79   1HB   PRO  12          2HB       PRO  12   2.697   9.387   7.853
   80   2HB   PRO  12          1HB       PRO  12   4.267  10.261   7.688
   81   1HG   PRO  12          2HG       PRO  12   1.538  11.497   8.379
   82   2HG   PRO  12          1HG       PRO  12   3.085  11.640   9.320
   83   1HD   PRO  12          2HD       PRO  12   2.305  13.537   7.450
   84   2HD   PRO  12          1HD       PRO  12   4.061  13.071   7.641
   85    H    TRP  13           H        TRP  13   2.253   8.321   5.503
   86    HA   TRP  13           HA       TRP  13  -0.519   8.969   4.800
   87   1HB   TRP  13          2HB       TRP  13   1.002   6.490   3.853
   88   2HB   TRP  13          1HB       TRP  13  -0.427   7.162   3.154
   89    HD1  TRP  13           HD       TRP  13   3.245   6.941   3.021
   90    HE1  TRP  13           1HE      TRP  13   4.266   8.428   1.172
   91    HE3  TRP  13           3HE      TRP  13  -0.632  10.127   2.396
   92    HZ2  TRP  13           2HZ      TRP  13   3.474  10.626  -0.348
   93    HZ3  TRP  13           3HZ      TRP  13  -0.371  12.017   0.848
   94    HH2  TRP  13           HH       TRP  13   1.683  12.280  -0.473
   95    H    GLY  14           H        GLY  14  -1.962   8.212   6.346
   96   1HA   GLY  14          2HA       GLY  14  -0.978   6.340   8.290
   97   2HA   GLY  14          1HA       GLY  14  -2.500   7.270   8.266
   98    H    PHE  15           H        PHE  15  -0.887   4.404   7.004
   99    HA   PHE  15           HA       PHE  15  -3.450   3.000   7.127
  100   1HB   PHE  15          2HB       PHE  15  -2.885   1.790   5.000
  101   2HB   PHE  15          1HB       PHE  15  -2.930   3.541   4.723
  102    HD1  PHE  15           1HD      PHE  15  -0.762   4.804   4.690
  103    HD2  PHE  15           2HD      PHE  15  -0.868   0.549   4.730
  104    HE1  PHE  15           1HE      PHE  15   1.689   4.705   4.353
  105    HE2  PHE  15           2HE      PHE  15   1.453   0.485   4.032
  106    HZ   PHE  15           HZ       PHE  15   2.783   2.549   4.000
  107    H    ARG  16           H        ARG  16  -3.435   0.771   7.505
  108    HA   ARG  16           HA       ARG  16  -1.234   0.154   9.292
  109   1HB   ARG  16          2HB       ARG  16  -4.164  -0.685   9.120
  110   2HB   ARG  16          1HB       ARG  16  -3.018  -1.726  10.006
  111   1HG   ARG  16          2HG       ARG  16  -3.458   1.232  10.666
  112   2HG   ARG  16          1HG       ARG  16  -4.369  -0.126  11.408
  113   1HD   ARG  16          2HD       ARG  16  -2.216  -1.121  12.253
  114   2HD   ARG  16          1HD       ARG  16  -1.314   0.318  11.597
  115    HE   ARG  16           HE       ARG  16  -3.560   1.155  13.305
  116   1HH1  ARG  16          1HH1      ARG  16  -0.421  -0.527  13.718
  117   2HH1  ARG  16          2HH1      ARG  16  -0.380  -0.087  15.392
  118   1HH2  ARG  16          1HH2      ARG  16  -3.278   1.889  15.287
  119   2HH2  ARG  16          2HH2      ARG  16  -1.840   1.566  16.235
  120    H    LEU  17           H        LEU  17   0.146  -1.556   8.720
  121    HA   LEU  17           HA       LEU  17  -0.660  -2.986   6.333
  122   1HB   LEU  17          2HB       LEU  17   2.086  -2.797   7.654
  123   2HB   LEU  17          1HB       LEU  17   1.693  -3.755   6.195
  124    HG   LEU  17           HG       LEU  17   0.789  -1.465   5.229
  125   1HD1  LEU  17          1HD1      LEU  17   2.414   0.420   6.138
  126   2HD1  LEU  17          2HD1      LEU  17   2.591  -0.660   7.580
  127   3HD1  LEU  17          3HD1      LEU  17   0.959  -0.005   7.116
  128   1HD2  LEU  17          1HD2      LEU  17   2.677  -2.790   4.304
  129   2HD2  LEU  17          2HD2      LEU  17   3.795  -2.071   5.529
  130   3HD2  LEU  17          3HD2      LEU  17   3.028  -1.018   4.272
  131    H    GLN  18           H        GLN  18  -0.672  -5.304   6.251
  132    HA   GLN  18           HA       GLN  18  -0.069  -6.722   8.709
  133   1HB   GLN  18          2HB       GLN  18  -2.732  -6.690   7.223
  134   2HB   GLN  18          1HB       GLN  18  -2.244  -8.118   8.173
  135   1HG   GLN  18          2HG       GLN  18  -2.551  -5.261   9.312
  136   2HG   GLN  18          1HG       GLN  18  -3.771  -6.573   9.418
  137   1HE2  GLN  18          1HE2      GLN  18  -2.958  -8.691  10.484
  138   2HE2  GLN  18          2HE2      GLN  18  -1.909  -8.471  11.856
  139    H    GLY  19           H        GLY  19   0.152  -9.031   8.318
  140   1HA   GLY  19          2HA       GLY  19   1.127 -10.698   7.267
  141   2HA   GLY  19          1HA       GLY  19   0.275 -10.161   5.782
  142    H    GLY  20           H        GLY  20   1.940 -10.725   4.381
  143   1HA   GLY  20          2HA       GLY  20   3.492  -9.207   3.243
  144   2HA   GLY  20          1HA       GLY  20   4.504  -9.341   4.735
  145    H    LYS  21           H        LYS  21   5.683 -10.042   2.297
  146    HA   LYS  21           HA       LYS  21   5.207 -12.701   1.682
  147   1HB   LYS  21          2HB       LYS  21   6.715 -10.596   0.576
  148   2HB   LYS  21          1HB       LYS  21   7.923 -11.842   0.961
  149   1HG   LYS  21          2HG       LYS  21   7.259 -12.429  -1.192
  150   2HG   LYS  21          1HG       LYS  21   6.225 -13.503  -0.207
  151   1HD   LYS  21          2HD       LYS  21   4.406 -11.605  -0.393
  152   2HD   LYS  21          1HD       LYS  21   5.526 -10.807  -1.530
  153   1HE   LYS  21          2HE       LYS  21   3.881 -11.955  -2.864
  154   2HE   LYS  21          1HE       LYS  21   5.415 -12.899  -3.026
  155   1HZ   LYS  21          1HZ       LYS  21   4.535 -14.477  -1.403
  156   2HZ   LYS  21          2HZ       LYS  21   3.447 -14.279  -2.646
  157   3HZ   LYS  21          3HZ       LYS  21   3.172 -13.530  -1.146
  158    H    ASP  22           H        ASP  22   6.915 -11.436   4.322
  159    HA   ASP  22           HA       ASP  22   8.782 -13.297   4.930
  160   1HB   ASP  22          2HB       ASP  22   8.120 -11.062   5.992
  161   2HB   ASP  22          1HB       ASP  22   6.753 -11.905   6.790
  162    H    PHE  23           H        PHE  23   5.254 -13.532   5.520
  163    HA   PHE  23           HA       PHE  23   5.626 -16.233   6.609
  164   1HB   PHE  23          2HB       PHE  23   3.671 -13.938   7.075
  165   2HB   PHE  23          1HB       PHE  23   3.070 -15.604   7.293
  166    HD1  PHE  23           1HD      PHE  23   3.457 -16.775   9.192
  167    HD2  PHE  23           2HD      PHE  23   5.792 -13.321   8.412
  168    HE1  PHE  23           1HE      PHE  23   4.315 -16.848  11.480
  169    HE2  PHE  23           2HE      PHE  23   6.656 -13.379  10.697
  170    HZ   PHE  23           HZ       PHE  23   5.917 -15.141  12.247
  171    H    ASN  24           H        ASN  24   5.797 -15.649   3.808
  172    HA   ASN  24           HA       ASN  24   5.071 -16.226   1.892
  173   1HB   ASN  24          2HB       ASN  24   3.632 -18.453   3.453
  174   2HB   ASN  24          1HB       ASN  24   3.884 -18.478   1.672
  175   1HD2  ASN  24          1HD2      ASN  24   4.756 -20.526   3.302
  176   2HD2  ASN  24          2HD2      ASN  24   6.492 -20.590   3.147
  177    H    MET  25           H        MET  25   3.486 -14.178   2.962
  178    HA   MET  25           HA       MET  25   0.767 -14.873   2.226
  179   1HB   MET  25          2HB       MET  25   2.102 -13.510   4.327
  180   2HB   MET  25          1HB       MET  25   1.140 -12.256   3.521
  181   1HG   MET  25          2HG       MET  25  -0.922 -13.520   4.049
  182   2HG   MET  25          1HG       MET  25   0.046 -14.993   4.420
  183   1HE   MET  25          1HE       MET  25  -1.478 -14.436   7.821
  184   2HE   MET  25          2HE       MET  25  -0.983 -15.602   6.552
  185   3HE   MET  25          3HE       MET  25  -2.188 -14.327   6.172
  186    HA   PRO  26           HA       PRO  26   1.129 -11.568  -0.865
  187   1HB   PRO  26          2HB       PRO  26  -1.456 -10.339  -0.545
  188   2HB   PRO  26          1HB       PRO  26  -1.064 -11.703  -1.607
  189   1HG   PRO  26          2HG       PRO  26  -2.699 -11.795   0.829
  190   2HG   PRO  26          1HG       PRO  26  -2.336 -13.085  -0.366
  191   1HD   PRO  26          2HD       PRO  26  -0.977 -12.287   2.238
  192   2HD   PRO  26          1HD       PRO  26  -1.053 -13.972   1.583
  193    H    LEU  27           H        LEU  27   1.634  -9.180  -0.776
  194    HA   LEU  27           HA       LEU  27   1.974  -8.282   1.907
  195   1HB   LEU  27          2HB       LEU  27   3.258  -7.834  -0.432
  196   2HB   LEU  27          1HB       LEU  27   2.227  -6.375  -0.429
  197    HG   LEU  27           HG       LEU  27   3.991  -7.411   1.848
  198   1HD1  LEU  27          1HD1      LEU  27   4.593  -5.108  -0.126
  199   2HD1  LEU  27          2HD1      LEU  27   5.349  -6.757  -0.122
  200   3HD1  LEU  27          3HD1      LEU  27   5.632  -5.632   1.254
  201   1HD2  LEU  27          1HD2      LEU  27   3.787  -5.107   2.869
  202   2HD2  LEU  27          2HD2      LEU  27   2.180  -5.887   2.739
  203   3HD2  LEU  27          3HD2      LEU  27   2.664  -4.624   1.541
  204    H    THR  28           H        THR  28   0.229  -7.704   3.098
  205    HA   THR  28           HA       THR  28  -2.044  -6.648   1.584
  206    HB   THR  28           HB       THR  28  -3.558  -7.524   2.849
  207    HG1  THR  28           1HG      THR  28  -3.162  -8.422   4.888
  208   1HG2  THR  28          1HG2      THR  28  -1.256  -9.545   3.239
  209   2HG2  THR  28          2HG2      THR  28  -1.865  -9.065   1.614
  210   3HG2  THR  28          3HG2      THR  28  -2.980  -9.875   2.817
  211    H    ILE  29           H        ILE  29  -3.220  -4.968   2.319
  212    HA   ILE  29           HA       ILE  29  -2.116  -3.477   4.637
  213    HB   ILE  29           HB       ILE  29  -3.351  -2.294   2.163
  214   1HG1  ILE  29          2HG1      ILE  29  -0.579  -2.401   3.455
  215   2HG1  ILE  29          1HG1      ILE  29  -1.034  -2.980   1.831
  216   1HG2  ILE  29          1HG2      ILE  29  -2.458  -1.061   4.869
  217   2HG2  ILE  29          2HG2      ILE  29  -4.166  -1.167   4.261
  218   3HG2  ILE  29          3HG2      ILE  29  -2.998  -0.127   3.432
  219   1HD1  ILE  29          1HD1      ILE  29  -1.385  -0.712   0.996
  220   2HD1  ILE  29          2HD1      ILE  29   0.240  -0.788   1.783
  221   3HD1  ILE  29          3HD1      ILE  29  -1.124   0.000   2.632
  222    H    SER  30           H        SER  30  -3.663  -2.799   6.119
  223    HA   SER  30           HA       SER  30  -6.195  -4.277   5.940
  224   1HB   SER  30          2HB       SER  30  -4.918  -5.003   7.771
  225   2HB   SER  30          1HB       SER  30  -4.556  -3.352   8.321
  226    HG   SER  30           HG       SER  30  -6.305  -4.537   9.413
  227    H    ARG  31           H        ARG  31  -5.455  -1.247   7.763
  228    HA   ARG  31           HA       ARG  31  -7.706  -0.082   6.294
  229   1HB   ARG  31          2HB       ARG  31  -8.917   0.392   8.326
  230   2HB   ARG  31          1HB       ARG  31  -8.584  -1.345   8.165
  231   1HG   ARG  31          2HG       ARG  31  -8.050  -1.205  10.344
  232   2HG   ARG  31          1HG       ARG  31  -6.451  -0.773   9.712
  233   1HD   ARG  31          2HD       ARG  31  -6.899   0.819  11.466
  234   2HD   ARG  31          1HD       ARG  31  -7.204   1.727   9.948
  235    HE   ARG  31           HE       ARG  31  -9.592   1.518  10.282
  236   1HH1  ARG  31          1HH1      ARG  31  -7.874  -0.166  12.951
  237   2HH1  ARG  31          2HH1      ARG  31  -9.251  -0.132  13.970
  238   1HH2  ARG  31          1HH2      ARG  31 -11.351   1.631  11.797
  239   2HH2  ARG  31          2HH2      ARG  31 -11.138   0.934  13.369
  240    H    ILE  32           H        ILE  32  -8.106   2.071   6.482
  241    HA   ILE  32           HA       ILE  32  -5.753   3.710   6.626
  242    HB   ILE  32           HB       ILE  32  -8.604   3.938   5.726
  243   1HG1  ILE  32          2HG1      ILE  32  -7.786   4.783   3.672
  244   2HG1  ILE  32          1HG1      ILE  32  -6.138   5.014   4.232
  245   1HG2  ILE  32          1HG2      ILE  32  -6.700   6.329   6.126
  246   2HG2  ILE  32          2HG2      ILE  32  -8.315   6.101   6.949
  247   3HG2  ILE  32          3HG2      ILE  32  -8.244   6.319   5.183
  248   1HD1  ILE  32          1HD1      ILE  32  -5.883   2.454   4.339
  249   2HD1  ILE  32          2HD1      ILE  32  -6.315   3.089   2.710
  250   3HD1  ILE  32          3HD1      ILE  32  -7.585   2.322   3.739
  251    H    THR  33           H        THR  33  -5.399   5.404   8.103
  252    HA   THR  33           HA       THR  33  -6.763   5.250  10.560
  253    HB   THR  33           HB       THR  33  -4.778   7.324   9.615
  254    HG1  THR  33           1HG      THR  33  -3.430   6.036  10.917
  255   1HG2  THR  33          1HG2      THR  33  -4.462   7.612  12.131
  256   2HG2  THR  33          2HG2      THR  33  -5.857   6.498  12.411
  257   3HG2  THR  33          3HG2      THR  33  -6.126   8.085  11.644
  258    HA   PRO  34           HA       PRO  34  -9.830   8.404   9.690
  259   1HB   PRO  34          2HB       PRO  34  -9.179   8.600  12.707
  260   2HB   PRO  34          1HB       PRO  34 -10.773   8.960  11.934
  261   1HG   PRO  34          2HG       PRO  34 -10.359   6.472  12.987
  262   2HG   PRO  34          1HG       PRO  34 -10.990   6.554  11.281
  263   1HD   PRO  34          2HD       PRO  34  -8.087   6.120  12.210
  264   2HD   PRO  34          1HD       PRO  34  -8.991   5.304  10.864
  265    H    GLY  35           H        GLY  35  -9.659  10.358   8.912
  266   1HA   GLY  35          2HA       GLY  35  -9.230  12.551   8.847
  267   2HA   GLY  35          1HA       GLY  35  -8.231  12.414  10.331
  268    H    SER  36           H        SER  36  -7.261  10.112   8.116
  269    HA   SER  36           HA       SER  36  -4.861  11.628   7.627
  270   1HB   SER  36          2HB       SER  36  -5.037   9.158   8.362
  271   2HB   SER  36          1HB       SER  36  -5.408   8.787   6.657
  272    HG   SER  36           HG       SER  36  -3.110   9.677   7.916
  273    H    LYS  37           H        LYS  37  -3.763  11.503   5.546
  274    HA   LYS  37           HA       LYS  37  -5.185  12.484   3.347
  275   1HB   LYS  37          2HB       LYS  37  -2.471  11.042   3.576
  276   2HB   LYS  37          1HB       LYS  37  -3.005  11.990   2.161
  277   1HG   LYS  37          2HG       LYS  37  -3.074  14.055   3.664
  278   2HG   LYS  37          1HG       LYS  37  -2.568  13.033   5.048
  279   1HD   LYS  37          2HD       LYS  37  -0.533  12.349   3.533
  280   2HD   LYS  37          1HD       LYS  37  -0.921  13.821   2.597
  281   1HE   LYS  37          2HE       LYS  37  -0.203  13.605   5.617
  282   2HE   LYS  37          1HE       LYS  37   0.844  14.214   4.278
  283   1HZ   LYS  37          1HZ       LYS  37  -0.020  16.129   5.222
  284   2HZ   LYS  37          2HZ       LYS  37  -1.535  15.465   5.519
  285   3HZ   LYS  37          3HZ       LYS  37  -1.091  15.890   3.945
  286    H    ALA  38           H        ALA  38  -4.213   9.352   4.424
  287    HA   ALA  38           HA       ALA  38  -4.754   7.749   2.213
  288   1HB   ALA  38          1HB       ALA  38  -4.822   7.039   5.184
  289   2HB   ALA  38          2HB       ALA  38  -3.320   7.253   4.224
  290   3HB   ALA  38          3HB       ALA  38  -4.461   5.951   3.785
  291    H    ALA  39           H        ALA  39  -6.998   9.242   4.480
  292    HA   ALA  39           HA       ALA  39  -9.103   7.434   3.684
  293   1HB   ALA  39          1HB       ALA  39  -8.886   8.279   6.086
  294   2HB   ALA  39          2HB       ALA  39 -10.452   8.737   5.339
  295   3HB   ALA  39          3HB       ALA  39  -9.129   9.947   5.492
  296    H    GLN  40           H        GLN  40  -8.240  10.858   3.394
  297    HA   GLN  40           HA       GLN  40 -10.649  11.661   2.255
  298   1HB   GLN  40          2HB       GLN  40  -7.971  12.829   2.900
  299   2HB   GLN  40          1HB       GLN  40  -8.820  13.655   1.590
  300   1HG   GLN  40          2HG       GLN  40 -10.923  13.657   3.166
  301   2HG   GLN  40          1HG       GLN  40  -9.803  13.160   4.482
  302   1HE2  GLN  40          1HE2      GLN  40 -11.360  15.798   3.317
  303   2HE2  GLN  40          2HE2      GLN  40 -10.237  17.029   3.834
  304    H    SER  41           H        SER  41  -7.707  10.564   0.665
  305    HA   SER  41           HA       SER  41  -8.428  12.004  -1.734
  306   1HB   SER  41          2HB       SER  41  -6.227  12.038  -0.756
  307   2HB   SER  41          1HB       SER  41  -6.040  10.272  -0.955
  308    HG   SER  41           HG       SER  41  -5.104  11.773  -2.598
  309    H    GLN  42           H        GLN  42  -7.152   9.949  -3.508
  310    HA   GLN  42           HA       GLN  42  -9.646   8.562  -4.054
  311   1HB   GLN  42          2HB       GLN  42  -7.074   8.482  -5.688
  312   2HB   GLN  42          1HB       GLN  42  -8.737   8.095  -6.208
  313   1HG   GLN  42          2HG       GLN  42  -7.520  10.845  -5.561
  314   2HG   GLN  42          1HG       GLN  42  -8.083  10.234  -7.147
  315   1HE2  GLN  42          1HE2      GLN  42  -8.885  12.466  -4.933
  316   2HE2  GLN  42          2HE2      GLN  42 -10.608  12.463  -5.131
  317    H    LEU  43           H        LEU  43  -7.085   8.085  -2.175
  318    HA   LEU  43           HA       LEU  43  -6.234   5.457  -2.769
  319   1HB   LEU  43          2HB       LEU  43  -5.046   7.496  -1.572
  320   2HB   LEU  43          1HB       LEU  43  -5.915   6.968  -0.115
  321    HG   LEU  43           HG       LEU  43  -4.829   4.585  -0.699
  322   1HD1  LEU  43          1HD1      LEU  43  -2.923   6.503  -2.189
  323   2HD1  LEU  43          2HD1      LEU  43  -4.012   5.322  -2.976
  324   3HD1  LEU  43          3HD1      LEU  43  -2.676   4.742  -1.914
  325   1HD2  LEU  43          1HD2      LEU  43  -2.714   5.306   0.609
  326   2HD2  LEU  43          2HD2      LEU  43  -4.281   5.681   1.366
  327   3HD2  LEU  43          3HD2      LEU  43  -3.353   6.986   0.527
  328    H    SER  44           H        SER  44  -6.829   3.494  -1.892
  329    HA   SER  44           HA       SER  44  -7.890   3.569   0.778
  330   1HB   SER  44          2HB       SER  44  -9.734   1.893   0.261
  331   2HB   SER  44          1HB       SER  44 -10.013   3.598  -0.185
  332    HG   SER  44           HG       SER  44 -10.549   2.720  -1.956
  333    H    GLN  45           H        GLN  45  -5.496   3.043   0.580
  334    HA   GLN  45           HA       GLN  45  -4.640   0.560  -0.272
  335   1HB   GLN  45          2HB       GLN  45  -3.646   2.298   2.048
  336   2HB   GLN  45          1HB       GLN  45  -2.859   0.795   1.502
  337   1HG   GLN  45          2HG       GLN  45  -2.722   1.833  -0.829
  338   2HG   GLN  45          1HG       GLN  45  -3.049   3.412  -0.075
  339   1HE2  GLN  45          2HE2      GLN  45  -1.221   4.350   1.293
  340   2HE2  GLN  45          1HE2      GLN  45   0.371   3.654   1.133
  341    H    GLY  46           H        GLY  46  -5.596  -1.357   0.247
  342   1HA   GLY  46          2HA       GLY  46  -5.511  -2.343   2.844
  343   2HA   GLY  46          1HA       GLY  46  -7.108  -1.594   2.582
  344    H    ASP  47           H        ASP  47  -4.861  -3.571   0.587
  345    HA   ASP  47           HA       ASP  47  -6.588  -5.790   0.538
  346   1HB   ASP  47          2HB       ASP  47  -7.233  -3.762  -1.290
  347   2HB   ASP  47          1HB       ASP  47  -6.143  -4.714  -2.289
  348    H    LEU  48           H        LEU  48  -5.410  -7.042  -1.791
  349    HA   LEU  48           HA       LEU  48  -2.791  -7.494  -0.757
  350   1HB   LEU  48          2HB       LEU  48  -4.094  -8.734  -3.207
  351   2HB   LEU  48          1HB       LEU  48  -2.596  -9.229  -2.369
  352    HG   LEU  48           HG       LEU  48  -4.120 -10.789  -1.652
  353   1HD1  LEU  48          1HD1      LEU  48  -4.759 -10.461   0.706
  354   2HD1  LEU  48          2HD1      LEU  48  -4.524  -8.676   0.583
  355   3HD1  LEU  48          3HD1      LEU  48  -3.110  -9.793   0.390
  356   1HD2  LEU  48          1HD2      LEU  48  -6.114  -9.310  -2.617
  357   2HD2  LEU  48          2HD2      LEU  48  -6.172  -8.662  -0.914
  358   3HD2  LEU  48          3HD2      LEU  48  -6.475 -10.428  -1.197
  359    H    VAL  49           H        VAL  49  -1.108  -6.257  -1.353
  360    HA   VAL  49           HA       VAL  49  -1.346  -4.427  -3.482
  361    HB   VAL  49           HB       VAL  49   0.812  -5.099  -1.469
  362   1HG1  VAL  49          1HG1      VAL  49   1.634  -2.791  -1.939
  363   2HG1  VAL  49          2HG1      VAL  49   0.503  -2.657  -3.337
  364   3HG1  VAL  49          3HG1      VAL  49   1.863  -3.868  -3.358
  365   1HG2  VAL  49          1HG2      VAL  49  -1.439  -2.975  -1.561
  366   2HG2  VAL  49          2HG2      VAL  49  -0.129  -3.030  -0.343
  367   3HG2  VAL  49          3HG2      VAL  49  -1.325  -4.361  -0.408
  368    H    VAL  50           H        VAL  50  -0.120  -4.315  -5.433
  369    HA   VAL  50           HA       VAL  50   1.349  -6.728  -6.133
  370    HB   VAL  50           HB       VAL  50   0.710  -4.471  -8.057
  371   1HG1  VAL  50          1HG1      VAL  50   2.447  -6.199  -8.676
  372   2HG1  VAL  50          2HG1      VAL  50   0.950  -6.355  -9.660
  373   3HG1  VAL  50          3HG1      VAL  50   1.256  -7.502  -8.307
  374   1HG2  VAL  50          1HG2      VAL  50  -1.445  -4.976  -7.214
  375   2HG2  VAL  50          2HG2      VAL  50  -1.114  -6.774  -7.188
  376   3HG2  VAL  50          3HG2      VAL  50  -1.248  -5.870  -8.755
  377    H    ALA  51           H        ALA  51   1.587  -3.224  -6.656
  378    HA   ALA  51           HA       ALA  51   4.510  -3.444  -6.524
  379   1HB   ALA  51          1HB       ALA  51   4.629  -1.972  -8.562
  380   2HB   ALA  51          2HB       ALA  51   2.831  -1.966  -8.645
  381   3HB   ALA  51          3HB       ALA  51   3.744  -3.494  -8.909
  382    H    ILE  52           H        ILE  52   5.699  -1.714  -6.002
  383    HA   ILE  52           HA       ILE  52   4.331   0.624  -4.907
  384    HB   ILE  52           HB       ILE  52   5.380  -1.144  -3.398
  385   1HG1  ILE  52          2HG1      ILE  52   4.455   0.979  -2.568
  386   2HG1  ILE  52          1HG1      ILE  52   5.916   0.481  -1.693
  387   1HG2  ILE  52          1HG2      ILE  52   7.551  -1.394  -4.463
  388   2HG2  ILE  52          2HG2      ILE  52   7.762  -0.768  -2.776
  389   3HG2  ILE  52          3HG2      ILE  52   7.933   0.347  -4.166
  390   1HD1  ILE  52          1HD1      ILE  52   5.656   2.787  -3.721
  391   2HD1  ILE  52          2HD1      ILE  52   7.251   2.190  -3.120
  392   3HD1  ILE  52          3HD1      ILE  52   6.051   2.863  -1.973
  393    H    ASP  53           H        ASP  53   4.885   2.439  -5.903
  394    HA   ASP  53           HA       ASP  53   5.781   3.827  -7.287
  395   1HB   ASP  53          2HB       ASP  53   7.490   3.431  -5.323
  396   2HB   ASP  53          1HB       ASP  53   8.535   2.722  -6.591
  397    H    GLY  54           H        GLY  54   5.241   1.088  -8.279
  398   1HA   GLY  54          2HA       GLY  54   5.032   0.508 -10.515
  399   2HA   GLY  54          1HA       GLY  54   6.606   1.275 -10.875
  400    H    VAL  55           H        VAL  55   7.149  -0.467  -8.051
  401    HA   VAL  55           HA       VAL  55   8.265  -2.605  -9.721
  402    HB   VAL  55           HB       VAL  55   9.215  -1.510  -7.061
  403   1HG1  VAL  55          1HG1      VAL  55   9.811  -3.923  -7.374
  404   2HG1  VAL  55          2HG1      VAL  55  11.254  -2.891  -7.629
  405   3HG1  VAL  55          3HG1      VAL  55  10.389  -3.581  -9.050
  406   1HG2  VAL  55          1HG2      VAL  55   9.553   0.178  -8.868
  407   2HG2  VAL  55          2HG2      VAL  55  10.269  -1.088  -9.935
  408   3HG2  VAL  55          3HG2      VAL  55  11.116  -0.595  -8.426
  409    H    ASN  56           H        ASN  56   7.684  -4.723  -9.262
  410    HA   ASN  56           HA       ASN  56   5.574  -5.083  -7.511
  411   1HB   ASN  56          2HB       ASN  56   5.553  -7.377  -8.097
  412   2HB   ASN  56          1HB       ASN  56   5.886  -6.372  -9.553
  413   1HD2  ASN  56          1HD2      ASN  56   8.897  -6.475  -8.064
  414   2HD2  ASN  56          2HD2      ASN  56   9.499  -7.773  -9.052
  415    H    THR  57           H        THR  57   5.233  -6.190  -5.643
  416    HA   THR  57           HA       THR  57   7.351  -6.166  -3.759
  417    HB   THR  57           HB       THR  57   5.551  -6.815  -2.179
  418    HG1  THR  57           1HG      THR  57   3.911  -6.444  -4.446
  419   1HG2  THR  57          1HG2      THR  57   4.390  -4.626  -2.348
  420   2HG2  THR  57          2HG2      THR  57   4.895  -4.427  -4.062
  421   3HG2  THR  57          3HG2      THR  57   6.131  -4.412  -2.766
  422    H    ASP  58           H        ASP  58   8.385  -7.793  -5.283
  423    HA   ASP  58           HA       ASP  58   7.606 -10.444  -5.271
  424   1HB   ASP  58          2HB       ASP  58   9.894 -10.990  -6.044
  425   2HB   ASP  58          1HB       ASP  58   9.090  -9.665  -6.956
  426    H    THR  59           H        THR  59  10.122  -9.056  -3.215
  427    HA   THR  59           HA       THR  59   9.457 -11.161  -1.263
  428    HB   THR  59           HB       THR  59  11.593 -11.483  -2.501
  429    HG1  THR  59           1HG      THR  59  12.822 -11.798  -0.604
  430   1HG2  THR  59          1HG2      THR  59  12.501  -8.979  -0.921
  431   2HG2  THR  59          2HG2      THR  59  12.243  -9.072  -2.709
  432   3HG2  THR  59          3HG2      THR  59  13.532 -10.050  -1.937
  433    H    MET  60           H        MET  60   9.115  -7.972  -1.726
  434    HA   MET  60           HA       MET  60   9.781  -6.756   0.566
  435   1HB   MET  60          2HB       MET  60   7.548  -6.493  -1.457
  436   2HB   MET  60          1HB       MET  60   7.630  -5.351  -0.077
  437   1HG   MET  60          2HG       MET  60   8.639  -4.236  -1.834
  438   2HG   MET  60          1HG       MET  60   9.983  -4.726  -0.773
  439   1HE   MET  60          1HE       MET  60  10.862  -4.549  -4.773
  440   2HE   MET  60          2HE       MET  60  11.023  -3.669  -3.219
  441   3HE   MET  60          3HE       MET  60   9.416  -3.792  -4.032
  442    H    THR  61           H        THR  61   9.045  -6.349   2.482
  443    HA   THR  61           HA       THR  61   7.024  -8.126   3.584
  444    HB   THR  61           HB       THR  61   8.326  -7.914   5.654
  445    HG1  THR  61           1HG      THR  61  10.377  -6.765   5.338
  446   1HG2  THR  61          1HG2      THR  61   9.042  -9.551   3.793
  447   2HG2  THR  61          2HG2      THR  61  10.374  -9.005   4.877
  448   3HG2  THR  61          3HG2      THR  61  10.219  -8.315   3.229
  449    H    HIS  62           H        HIS  62   6.289  -7.162   5.808
  450    HA   HIS  62           HA       HIS  62   4.826  -4.875   5.603
  451   1HB   HIS  62          2HB       HIS  62   4.652  -6.516   7.434
  452   2HB   HIS  62          1HB       HIS  62   6.190  -5.955   8.122
  453    HD1  HIS  62           1HD      HIS  62   3.033  -5.917   9.142
  454    HD2  HIS  62           2HD      HIS  62   5.618  -2.689   8.465
  455    HE1  HIS  62           1HE      HIS  62   2.238  -3.975  10.580
  456    H    LEU  63           H        LEU  63   8.073  -4.933   7.221
  457    HA   LEU  63           HA       LEU  63   8.205  -2.173   7.510
  458   1HB   LEU  63          2HB       LEU  63   9.618  -3.793   8.754
  459   2HB   LEU  63          1HB       LEU  63  10.431  -4.245   7.228
  460    HG   LEU  63           HG       LEU  63  11.222  -1.852   6.986
  461   1HD1  LEU  63          1HD1      LEU  63   9.569  -0.659   8.443
  462   2HD1  LEU  63          2HD1      LEU  63  11.248  -0.395   9.029
  463   3HD1  LEU  63          3HD1      LEU  63  10.178  -1.567   9.883
  464   1HD2  LEU  63          1HD2      LEU  63  12.638  -3.670   7.832
  465   2HD2  LEU  63          2HD2      LEU  63  12.120  -3.315   9.527
  466   3HD2  LEU  63          3HD2      LEU  63  13.057  -2.081   8.581
  467    H    GLU  64           H        GLU  64   9.527  -4.205   4.861
  468    HA   GLU  64           HA       GLU  64  10.827  -2.195   3.531
  469   1HB   GLU  64          2HB       GLU  64   9.746  -4.882   2.996
  470   2HB   GLU  64          1HB       GLU  64   9.777  -3.963   1.486
  471   1HG   GLU  64          2HG       GLU  64  12.162  -4.559   3.361
  472   2HG   GLU  64          1HG       GLU  64  11.841  -5.302   1.759
  473    H    ALA  65           H        ALA  65   7.443  -3.303   2.955
  474    HA   ALA  65           HA       ALA  65   6.950  -1.413   0.967
  475   1HB   ALA  65          1HB       ALA  65   5.764  -3.531   1.306
  476   2HB   ALA  65          2HB       ALA  65   4.569  -2.165   1.357
  477   3HB   ALA  65          3HB       ALA  65   5.117  -2.972   2.893
  478    H    GLN  66           H        GLN  66   6.403  -1.297   4.464
  479    HA   GLN  66           HA       GLN  66   5.143   1.179   4.587
  480   1HB   GLN  66          2HB       GLN  66   5.066  -0.294   6.425
  481   2HB   GLN  66          1HB       GLN  66   6.821  -0.563   6.424
  482   1HG   GLN  66          2HG       GLN  66   7.353   1.365   7.546
  483   2HG   GLN  66          1HG       GLN  66   5.850   2.254   7.087
  484   1HE2  GLN  66          1HE2      GLN  66   3.773   1.443   8.056
  485   2HE2  GLN  66          2HE2      GLN  66   3.838   0.742   9.655
  486    H    ASN  67           H        ASN  67   8.638   0.399   4.756
  487    HA   ASN  67           HA       ASN  67   9.543   3.017   4.847
  488   1HB   ASN  67          2HB       ASN  67  10.666   0.327   3.955
  489   2HB   ASN  67          1HB       ASN  67  11.639   1.791   3.644
  490   1HD2  ASN  67          1HD2      ASN  67  12.570  -0.279   5.294
  491   2HD2  ASN  67          2HD2      ASN  67  12.711   0.368   6.898
  492    H    LYS  68           H        LYS  68   8.975   1.000   1.927
  493    HA   LYS  68           HA       LYS  68   9.877   2.865   0.125
  494   1HB   LYS  68          2HB       LYS  68   7.730   0.717  -0.166
  495   2HB   LYS  68          1HB       LYS  68   8.525   1.548  -1.542
  496   1HG   LYS  68          2HG       LYS  68  10.416   0.252   0.397
  497   2HG   LYS  68          1HG       LYS  68   9.274  -0.849  -0.418
  498   1HD   LYS  68          2HD       LYS  68   9.984   0.051  -2.648
  499   2HD   LYS  68          1HD       LYS  68  11.215   1.073  -1.850
  500   1HE   LYS  68          2HE       LYS  68  11.024  -2.003  -1.540
  501   2HE   LYS  68          1HE       LYS  68  12.076  -1.186  -2.771
  502   1HZ   LYS  68          1HZ       LYS  68  13.557  -0.660  -1.209
  503   2HZ   LYS  68          2HZ       LYS  68  12.782  -1.845  -0.271
  504   3HZ   LYS  68          3HZ       LYS  68  12.425  -0.214  -0.050
  505    H    ILE  69           H        ILE  69   6.402   2.339   1.111
  506    HA   ILE  69           HA       ILE  69   5.339   4.472  -0.142
  507    HB   ILE  69           HB       ILE  69   4.781   2.978   2.412
  508   1HG1  ILE  69          2HG1      ILE  69   3.463   3.211  -0.352
  509   2HG1  ILE  69          1HG1      ILE  69   4.442   1.839   0.172
  510   1HG2  ILE  69          1HG2      ILE  69   3.805   5.038   2.980
  511   2HG2  ILE  69          2HG2      ILE  69   2.428   4.217   2.176
  512   3HG2  ILE  69          3HG2      ILE  69   3.355   5.449   1.266
  513   1HD1  ILE  69          1HD1      ILE  69   2.888   1.208   1.963
  514   2HD1  ILE  69          2HD1      ILE  69   2.147   1.150   0.321
  515   3HD1  ILE  69          3HD1      ILE  69   1.744   2.503   1.442
  516    H    LYS  70           H        LYS  70   6.935   4.611   3.099
  517    HA   LYS  70           HA       LYS  70   6.457   7.392   3.270
  518   1HB   LYS  70          2HB       LYS  70   7.873   5.308   4.891
  519   2HB   LYS  70          1HB       LYS  70   8.375   6.989   5.149
  520   1HG   LYS  70          2HG       LYS  70   6.791   6.580   6.755
  521   2HG   LYS  70          1HG       LYS  70   6.013   7.687   5.583
  522   1HD   LYS  70          2HD       LYS  70   4.675   5.880   4.638
  523   2HD   LYS  70          1HD       LYS  70   5.624   4.637   5.503
  524   1HE   LYS  70          2HE       LYS  70   3.673   6.642   6.819
  525   2HE   LYS  70          1HE       LYS  70   3.437   4.868   6.565
  526   1HZ   LYS  70          1HZ       LYS  70   5.035   6.290   8.516
  527   2HZ   LYS  70          2HZ       LYS  70   5.780   4.910   7.899
  528   3HZ   LYS  70          3HZ       LYS  70   4.245   4.822   8.639
  529    H    SER  71           H        SER  71   8.447   6.119   0.991
  530    HA   SER  71           HA       SER  71  10.635   7.954   1.510
  531   1HB   SER  71          2HB       SER  71   9.994   6.044  -0.793
  532   2HB   SER  71          1HB       SER  71  11.270   7.298  -0.937
  533    HG   SER  71           HG       SER  71  12.353   6.425   0.738
  534    H    ALA  72           H        ALA  72   7.552   7.912   0.062
  535    HA   ALA  72           HA       ALA  72   8.273  10.043  -1.831
  536   1HB   ALA  72          1HB       ALA  72   7.457   7.812  -2.665
  537   2HB   ALA  72          2HB       ALA  72   6.331   9.148  -3.142
  538   3HB   ALA  72          3HB       ALA  72   5.952   8.061  -1.731
  539    H    SER  73           H        SER  73   7.126  11.861  -2.061
  540    HA   SER  73           HA       SER  73   4.693  12.302  -0.563
  541   1HB   SER  73          2HB       SER  73   5.440  14.382   0.515
  542   2HB   SER  73          1HB       SER  73   6.231  12.915   1.154
  543    HG   SER  73           HG       SER  73   7.336  14.996  -0.327
  544    H    TYR  74           H        TYR  74   6.978  13.301  -3.051
  545    HA   TYR  74           HA       TYR  74   5.262  15.347  -4.019
  546   1HB   TYR  74          2HB       TYR  74   7.788  15.162  -4.353
  547   2HB   TYR  74          1HB       TYR  74   7.483  13.841  -5.523
  548    HD1  TYR  74           1HD      TYR  74   6.381  14.346  -7.634
  549    HD2  TYR  74           2HD      TYR  74   7.269  17.419  -4.842
  550    HE1  TYR  74           1HE      TYR  74   6.104  16.028  -9.398
  551    HE2  TYR  74           2HE      TYR  74   7.004  19.104  -6.605
  552    HH   TYR  74           HH       TYR  74   7.280  18.738  -9.497
  553    H    ASN  75           H        ASN  75   6.035  12.024  -5.284
  554    HA   ASN  75           HA       ASN  75   3.208  11.658  -5.433
  555   1HB   ASN  75          2HB       ASN  75   3.187  10.829  -7.809
  556   2HB   ASN  75          1HB       ASN  75   3.315  12.595  -7.571
  557   1HD2  ASN  75          1HD2      ASN  75   5.922  10.080  -7.491
  558   2HD2  ASN  75          2HD2      ASN  75   6.532  10.488  -9.070
  559    H    LEU  76           H        LEU  76   2.547   9.686  -4.969
  560    HA   LEU  76           HA       LEU  76   4.552   7.523  -4.966
  561   1HB   LEU  76          2HB       LEU  76   3.998   8.420  -2.695
  562   2HB   LEU  76          1HB       LEU  76   2.278   8.254  -3.048
  563    HG   LEU  76           HG       LEU  76   2.496   5.755  -3.139
  564   1HD1  LEU  76          1HD1      LEU  76   5.341   6.151  -2.023
  565   2HD1  LEU  76          2HD1      LEU  76   5.005   5.617  -3.723
  566   3HD1  LEU  76          3HD1      LEU  76   4.483   4.612  -2.317
  567   1HD2  LEU  76          1HD2      LEU  76   2.650   5.454  -0.730
  568   2HD2  LEU  76          2HD2      LEU  76   1.861   7.044  -1.057
  569   3HD2  LEU  76          3HD2      LEU  76   3.591   6.979  -0.546
  570    H    SER  77           H        SER  77   3.943   6.026  -6.578
  571    HA   SER  77           HA       SER  77   1.060   5.702  -7.011
  572   1HB   SER  77          2HB       SER  77   3.380   4.644  -8.673
  573   2HB   SER  77          1HB       SER  77   1.634   4.450  -9.039
  574    HG   SER  77           HG       SER  77   1.475   6.645  -9.341
  575    H    LEU  78           H        LEU  78   0.013   4.118  -6.001
  576    HA   LEU  78           HA       LEU  78   1.481   1.660  -5.364
  577   1HB   LEU  78          2HB       LEU  78  -1.177   2.592  -4.168
  578   2HB   LEU  78          1HB       LEU  78  -0.114   1.263  -3.620
  579    HG   LEU  78           HG       LEU  78   0.108   2.937  -2.029
  580   1HD1  LEU  78          1HD1      LEU  78   2.415   3.644  -2.040
  581   2HD1  LEU  78          2HD1      LEU  78   2.576   3.348  -3.806
  582   3HD1  LEU  78          3HD1      LEU  78   2.283   1.966  -2.677
  583   1HD2  LEU  78          1HD2      LEU  78   0.353   5.259  -2.249
  584   2HD2  LEU  78          2HD2      LEU  78  -1.005   4.766  -3.331
  585   3HD2  LEU  78          3HD2      LEU  78   0.598   5.174  -4.034
  586    H    THR  79           H        THR  79   0.619  -0.316  -6.098
  587    HA   THR  79           HA       THR  79  -1.974  -0.227  -7.438
  588    HB   THR  79           HB       THR  79   0.549  -1.605  -8.432
  589    HG1  THR  79           1HG      THR  79   0.397  -0.084 -10.075
  590   1HG2  THR  79          1HG2      THR  79  -2.332  -1.366  -9.527
  591   2HG2  THR  79          2HG2      THR  79  -1.495  -2.879  -8.981
  592   3HG2  THR  79          3HG2      THR  79  -0.930  -2.023 -10.464
  593    H    LEU  80           H        LEU  80  -3.267  -1.609  -6.248
  594    HA   LEU  80           HA       LEU  80  -2.220  -4.194  -5.406
  595   1HB   LEU  80          2HB       LEU  80  -3.471  -4.100  -3.410
  596   2HB   LEU  80          1HB       LEU  80  -2.380  -2.664  -3.497
  597    HG   LEU  80           HG       LEU  80  -5.365  -2.795  -4.027
  598   1HD1  LEU  80          1HD1      LEU  80  -4.543  -3.123  -1.646
  599   2HD1  LEU  80          2HD1      LEU  80  -5.576  -1.612  -1.875
  600   3HD1  LEU  80          3HD1      LEU  80  -3.749  -1.485  -1.756
  601   1HD2  LEU  80          1HD2      LEU  80  -3.164  -0.662  -4.115
  602   2HD2  LEU  80          2HD2      LEU  80  -4.847  -0.094  -3.659
  603   3HD2  LEU  80          3HD2      LEU  80  -4.547  -0.864  -5.283
  604    H    GLN  81           H        GLN  81  -4.075  -5.787  -5.044
  605    HA   GLN  81           HA       GLN  81  -5.633  -5.615  -7.479
  606   1HB   GLN  81          2HB       GLN  81  -5.369  -7.999  -5.616
  607   2HB   GLN  81          1HB       GLN  81  -6.016  -7.934  -7.292
  608   1HG   GLN  81          2HG       GLN  81  -3.634  -7.069  -7.969
  609   2HG   GLN  81          1HG       GLN  81  -3.094  -7.645  -6.357
  610   1HE2  GLN  81          1HE2      GLN  81  -2.367  -9.810  -6.357
  611   2HE2  GLN  81          2HE2      GLN  81  -2.682 -10.906  -7.673
  612    H    LYS  82           H        LYS  82  -7.932  -5.801  -7.585
  613    HA   LYS  82           HA       LYS  82  -9.320  -5.324  -5.143
  614   1HB   LYS  82          2HB       LYS  82  -9.780  -4.661  -7.742
  615   2HB   LYS  82          1HB       LYS  82 -10.786  -6.118  -7.664
  616   1HG   LYS  82          2HG       LYS  82 -12.230  -4.285  -7.062
  617   2HG   LYS  82          1HG       LYS  82 -11.819  -5.062  -5.503
  618   1HD   LYS  82          2HD       LYS  82  -9.715  -3.284  -5.801
  619   2HD   LYS  82          1HD       LYS  82 -10.982  -2.380  -6.653
  620   1HE   LYS  82          2HE       LYS  82 -12.432  -2.361  -4.622
  621   2HE   LYS  82          1HE       LYS  82 -11.297  -3.486  -3.771
  622   1HZ   LYS  82          1HZ       LYS  82  -9.620  -1.861  -3.796
  623   2HZ   LYS  82          2HZ       LYS  82 -11.017  -1.075  -3.216
  624   3HZ   LYS  82          3HZ       LYS  82 -10.506  -0.810  -4.788
  625    H    SER  83           H        SER  83  -9.448  -6.942  -3.660
  626    HA   SER  83           HA       SER  83 -10.120  -9.594  -4.598
  627   1HB   SER  83          2HB       SER  83  -8.445  -9.048  -2.753
  628   2HB   SER  83          1HB       SER  83  -9.846  -8.732  -1.699
  629    HG   SER  83           HG       SER  83  -9.034 -10.912  -1.655
  630    H    LYS  84           H        LYS  84 -11.628 -10.381  -2.353
  631    HA   LYS  84           HA       LYS  84 -14.270  -9.422  -3.136
  632   1HB   LYS  84          2HB       LYS  84 -13.228 -11.866  -1.670
  633   2HB   LYS  84          1HB       LYS  84 -14.906 -11.326  -1.404
  634   1HG   LYS  84          2HG       LYS  84 -15.087 -12.969  -2.999
  635   2HG   LYS  84          1HG       LYS  84 -15.382 -11.424  -3.840
  636   1HD   LYS  84          2HD       LYS  84 -13.065 -11.530  -4.809
  637   2HD   LYS  84          1HD       LYS  84 -12.759 -13.053  -3.901
  638   1HE   LYS  84          2HE       LYS  84 -14.632 -14.188  -5.152
  639   2HE   LYS  84          1HE       LYS  84 -14.972 -12.646  -6.027
  640   1HZ   LYS  84          1HZ       LYS  84 -13.675 -14.041  -7.382
  641   2HZ   LYS  84          2HZ       LYS  84 -12.460 -14.276  -6.242
  642   3HZ   LYS  84          3HZ       LYS  84 -12.694 -12.754  -6.913
  643    H    ARG  85           H        ARG  85 -15.337  -7.926  -2.006
  644    HA   ARG  85           HA       ARG  85 -14.997  -7.920   0.890
  645   1HB   ARG  85          2HB       ARG  85 -15.539  -5.468  -0.874
  646   2HB   ARG  85          1HB       ARG  85 -15.513  -5.529   0.910
  647   1HG   ARG  85          2HG       ARG  85 -13.473  -4.695   0.666
  648   2HG   ARG  85          1HG       ARG  85 -12.986  -6.411   0.525
  649   1HD   ARG  85          2HD       ARG  85 -12.934  -6.211  -1.964
  650   2HD   ARG  85          1HD       ARG  85 -13.624  -4.546  -1.884
  651    HE   ARG  85           HE       ARG  85 -10.807  -5.282  -1.394
  652   1HH1  ARG  85          1HH1      ARG  85 -13.253  -2.728  -0.552
  653   2HH1  ARG  85          2HH1      ARG  85 -12.005  -1.619  -0.170
  654   1HH2  ARG  85          1HH2      ARG  85  -9.390  -3.820  -1.060
  655   2HH2  ARG  85          2HH2      ARG  85  -9.782  -2.141  -0.782
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1  -9.715  -8.277 -11.259
    2   2H    MET   1          2HT       MET   1  -9.987  -7.191 -10.011
    3   3H    MET   1          3HT       MET   1  -8.659  -8.256  -9.952
    4    HA   MET   1           HA       MET   1  -7.618  -7.149 -11.752
    5   1HB   MET   1          2HB       MET   1  -9.938  -5.141 -11.516
    6   2HB   MET   1          1HB       MET   1  -8.546  -5.008 -12.626
    7   1HG   MET   1          2HG       MET   1 -10.813  -7.065 -12.715
    8   2HG   MET   1          1HG       MET   1 -10.519  -5.731 -13.839
    9   1HE   MET   1          1HE       MET   1  -7.606  -6.718 -16.040
   10   2HE   MET   1          2HE       MET   1  -7.499  -5.683 -14.582
   11   3HE   MET   1          3HE       MET   1  -8.943  -5.588 -15.653
   12    H    ALA   2           H        ALA   2  -6.361  -4.996 -11.496
   13    HA   ALA   2           HA       ALA   2  -6.305  -4.292  -8.647
   14   1HB   ALA   2          1HB       ALA   2  -4.146  -5.138  -9.544
   15   2HB   ALA   2          2HB       ALA   2  -4.031  -3.415  -9.085
   16   3HB   ALA   2          3HB       ALA   2  -4.180  -3.870 -10.828
   17    H    TYR   3           H        TYR   3  -5.621  -2.042  -8.192
   18    HA   TYR   3           HA       TYR   3  -6.466  -0.182 -10.254
   19   1HB   TYR   3          2HB       TYR   3  -7.709   1.240  -8.996
   20   2HB   TYR   3          1HB       TYR   3  -8.378  -0.373  -8.617
   21    HD1  TYR   3           1HD      TYR   3  -7.499   2.637  -7.379
   22    HD2  TYR   3           2HD      TYR   3  -7.022  -1.477  -6.387
   23    HE1  TYR   3           1HE      TYR   3  -7.383   3.223  -4.987
   24    HE2  TYR   3           2HE      TYR   3  -6.963  -0.912  -4.043
   25    HH   TYR   3           HH       TYR   3  -7.538   0.805  -2.518
   26    H    SER   4           H        SER   4  -5.420   1.860 -10.151
   27    HA   SER   4           HA       SER   4  -2.952   1.812  -8.557
   28   1HB   SER   4          2HB       SER   4  -2.478   1.257 -10.982
   29   2HB   SER   4          1HB       SER   4  -3.229   2.813 -11.445
   30    HG   SER   4           HG       SER   4  -1.573   3.878 -10.487
   31    H    VAL   5           H        VAL   5  -2.635   3.723  -7.454
   32    HA   VAL   5           HA       VAL   5  -3.897   6.094  -8.486
   33    HB   VAL   5           HB       VAL   5  -5.674   5.610  -7.130
   34   1HG1  VAL   5          1HG1      VAL   5  -5.492   4.921  -4.765
   35   2HG1  VAL   5          2HG1      VAL   5  -3.719   4.613  -5.005
   36   3HG1  VAL   5          3HG1      VAL   5  -4.952   3.676  -5.950
   37   1HG2  VAL   5          1HG2      VAL   5  -5.654   7.315  -5.405
   38   2HG2  VAL   5          2HG2      VAL   5  -4.715   7.934  -6.816
   39   3HG2  VAL   5          3HG2      VAL   5  -3.859   7.342  -5.348
   40    H    THR   6           H        THR   6  -2.757   7.844  -8.217
   41    HA   THR   6           HA       THR   6  -0.172   7.541  -6.866
   42    HB   THR   6           HB       THR   6  -1.016   9.388  -9.105
   43    HG1  THR   6           1HG      THR   6  -0.758   7.276  -9.766
   44   1HG2  THR   6          1HG2      THR   6   0.802  10.389  -7.667
   45   2HG2  THR   6          2HG2      THR   6   1.496   9.833  -9.226
   46   3HG2  THR   6          3HG2      THR   6   1.731   8.843  -7.745
   47    H    LEU   7           H        LEU   7   0.097   8.639  -5.036
   48    HA   LEU   7           HA       LEU   7  -1.912  10.641  -4.316
   49   1HB   LEU   7          2HB       LEU   7  -1.828   8.400  -3.127
   50   2HB   LEU   7          1HB       LEU   7  -0.162   8.768  -2.628
   51    HG   LEU   7           HG       LEU   7  -1.045  10.777  -1.339
   52   1HD1  LEU   7          1HD1      LEU   7  -3.514  10.844  -0.839
   53   2HD1  LEU   7          2HD1      LEU   7  -3.792   9.554  -2.068
   54   3HD1  LEU   7          3HD1      LEU   7  -3.191  11.176  -2.577
   55   1HD2  LEU   7          1HD2      LEU   7  -2.041   9.346   0.503
   56   2HD2  LEU   7          2HD2      LEU   7  -0.558   8.621  -0.213
   57   3HD2  LEU   7          3HD2      LEU   7  -2.167   7.986  -0.679
   58    H    THR   8           H        THR   8  -1.257  12.651  -3.584
   59    HA   THR   8           HA       THR   8   1.619  13.048  -3.192
   60    HB   THR   8           HB       THR   8   1.000  13.942  -5.352
   61    HG1  THR   8           1HG      THR   8   2.485  15.127  -4.468
   62   1HG2  THR   8          1HG2      THR   8  -1.050  15.660  -3.796
   63   2HG2  THR   8          2HG2      THR   8  -1.423  14.376  -5.005
   64   3HG2  THR   8          3HG2      THR   8  -0.568  15.868  -5.521
   65    H    GLY   9           H        GLY   9   2.217  14.440  -1.502
   66   1HA   GLY   9          2HA       GLY   9   1.016  16.380  -0.432
   67   2HA   GLY   9          1HA       GLY   9   0.089  15.060   0.378
   68    HA   PRO  10           HA       PRO  10   3.825  15.440   2.933
   69   1HB   PRO  10          2HB       PRO  10   3.165  17.307   4.821
   70   2HB   PRO  10          1HB       PRO  10   3.810  17.817   3.215
   71   1HG   PRO  10          2HG       PRO  10   0.860  17.681   4.061
   72   2HG   PRO  10          1HG       PRO  10   1.733  19.071   3.290
   73   1HD   PRO  10          2HD       PRO  10   0.255  17.138   1.875
   74   2HD   PRO  10          1HD       PRO  10   1.693  18.004   1.155
   75    H    GLY  11           H        GLY  11   3.779  14.679   5.230
   76   1HA   GLY  11          2HA       GLY  11   2.762  13.903   7.032
   77   2HA   GLY  11          1HA       GLY  11   1.162  13.901   6.220
   78    HA   PRO  12           HA       PRO  12   3.380   9.822   5.757
   79   1HB   PRO  12          2HB       PRO  12   3.376   8.438   8.117
   80   2HB   PRO  12          1HB       PRO  12   4.506   9.808   7.801
   81   1HG   PRO  12          2HG       PRO  12   1.837   9.934   9.323
   82   2HG   PRO  12          1HG       PRO  12   3.465  10.526   9.863
   83   1HD   PRO  12          2HD       PRO  12   1.571  12.164   8.577
   84   2HD   PRO  12          1HD       PRO  12   3.375  12.390   8.406
   85    H    TRP  13           H        TRP  13   1.164  10.186   4.691
   86    HA   TRP  13           HA       TRP  13  -0.710   9.525   3.983
   87   1HB   TRP  13          2HB       TRP  13   0.453   6.716   3.967
   88   2HB   TRP  13          1HB       TRP  13  -0.689   7.393   2.884
   89    HD1  TRP  13           HD       TRP  13   2.886   6.887   3.466
   90    HE1  TRP  13           1HE      TRP  13   4.379   8.213   1.790
   91    HE3  TRP  13           3HE      TRP  13  -0.488  10.399   2.004
   92    HZ2  TRP  13           2HZ      TRP  13   4.107  10.417   0.133
   93    HZ3  TRP  13           3HZ      TRP  13   0.215  12.112   0.448
   94    HH2  TRP  13           HH       TRP  13   2.458  12.122  -0.508
   95    H    GLY  14           H        GLY  14  -0.563   6.730   6.241
   96   1HA   GLY  14          2HA       GLY  14  -1.924   6.955   8.145
   97   2HA   GLY  14          1HA       GLY  14  -3.236   7.613   7.113
   98    H    PHE  15           H        PHE  15  -1.133   4.719   6.889
   99    HA   PHE  15           HA       PHE  15  -3.566   3.075   7.030
  100   1HB   PHE  15          2HB       PHE  15  -2.898   1.945   4.921
  101   2HB   PHE  15          1HB       PHE  15  -2.919   3.697   4.690
  102    HD1  PHE  15           1HD      PHE  15  -0.852   4.958   4.594
  103    HD2  PHE  15           2HD      PHE  15  -0.762   0.724   4.907
  104    HE1  PHE  15           1HE      PHE  15   1.593   4.975   4.269
  105    HE2  PHE  15           2HE      PHE  15   1.595   0.732   4.316
  106    HZ   PHE  15           HZ       PHE  15   2.818   2.847   4.138
  107    H    ARG  16           H        ARG  16  -3.396   0.843   7.358
  108    HA   ARG  16           HA       ARG  16  -1.361   0.372   9.381
  109   1HB   ARG  16          2HB       ARG  16  -4.247  -0.560   8.999
  110   2HB   ARG  16          1HB       ARG  16  -3.136  -1.549   9.980
  111   1HG   ARG  16          2HG       ARG  16  -4.612  -0.207  11.294
  112   2HG   ARG  16          1HG       ARG  16  -2.887   0.122  11.662
  113   1HD   ARG  16          2HD       ARG  16  -3.020   2.346  10.547
  114   2HD   ARG  16          1HD       ARG  16  -4.666   1.956   9.925
  115    HE   ARG  16           HE       ARG  16  -5.573   2.378  12.019
  116   1HH1  ARG  16          1HH1      ARG  16  -1.974   2.294  12.484
  117   2HH1  ARG  16          2HH1      ARG  16  -2.148   3.060  14.041
  118   1HH2  ARG  16          1HH2      ARG  16  -5.585   2.993  14.270
  119   2HH2  ARG  16          2HH2      ARG  16  -4.070   3.380  15.019
  120    H    LEU  17           H        LEU  17  -0.046  -1.499   9.124
  121    HA   LEU  17           HA       LEU  17  -0.519  -2.885   6.590
  122   1HB   LEU  17          2HB       LEU  17   2.094  -2.384   8.103
  123   2HB   LEU  17          1HB       LEU  17   1.922  -3.358   6.609
  124    HG   LEU  17           HG       LEU  17   0.948  -1.191   5.528
  125   1HD1  LEU  17          1HD1      LEU  17   2.131   0.880   6.684
  126   2HD1  LEU  17          2HD1      LEU  17   2.197  -0.183   8.150
  127   3HD1  LEU  17          3HD1      LEU  17   0.602   0.255   7.420
  128   1HD2  LEU  17          1HD2      LEU  17   3.125  -2.184   4.909
  129   2HD2  LEU  17          2HD2      LEU  17   3.900  -1.479   6.373
  130   3HD2  LEU  17          3HD2      LEU  17   3.294  -0.394   5.051
  131    H    GLN  18           H        GLN  18  -1.051  -5.073   6.762
  132    HA   GLN  18           HA       GLN  18   0.460  -6.541   8.806
  133   1HB   GLN  18          2HB       GLN  18  -2.487  -6.963   8.145
  134   2HB   GLN  18          1HB       GLN  18  -1.489  -8.018   9.196
  135   1HG   GLN  18          2HG       GLN  18  -1.086  -6.061  10.744
  136   2HG   GLN  18          1HG       GLN  18  -2.177  -5.047   9.741
  137   1HE2  GLN  18          1HE2      GLN  18  -4.403  -6.061   9.316
  138   2HE2  GLN  18          2HE2      GLN  18  -5.185  -6.836  10.669
  139    H    GLY  19           H        GLY  19   1.004  -8.675   8.352
  140   1HA   GLY  19          2HA       GLY  19   1.360 -10.471   7.099
  141   2HA   GLY  19          1HA       GLY  19   0.303  -9.822   5.811
  142    H    GLY  20           H        GLY  20   2.119 -11.004   4.576
  143   1HA   GLY  20          2HA       GLY  20   3.389  -9.637   2.900
  144   2HA   GLY  20          1HA       GLY  20   4.499  -9.339   4.268
  145    H    LYS  21           H        LYS  21   5.748 -10.445   2.184
  146    HA   LYS  21           HA       LYS  21   5.772 -13.137   2.079
  147   1HB   LYS  21          2HB       LYS  21   6.881 -11.160   0.657
  148   2HB   LYS  21          1HB       LYS  21   8.295 -11.468   1.694
  149   1HG   LYS  21          2HG       LYS  21   8.626 -12.866  -0.223
  150   2HG   LYS  21          1HG       LYS  21   7.953 -14.002   0.971
  151   1HD   LYS  21          2HD       LYS  21   5.609 -13.289  -0.001
  152   2HD   LYS  21          1HD       LYS  21   6.528 -12.620  -1.371
  153   1HE   LYS  21          2HE       LYS  21   7.609 -14.868  -1.805
  154   2HE   LYS  21          1HE       LYS  21   6.676 -15.571  -0.428
  155   1HZ   LYS  21          1HZ       LYS  21   5.609 -14.503  -2.995
  156   2HZ   LYS  21          2HZ       LYS  21   4.640 -14.830  -1.637
  157   3HZ   LYS  21          3HZ       LYS  21   5.515 -16.076  -2.342
  158    H    ASP  22           H        ASP  22   6.749 -11.399   4.785
  159    HA   ASP  22           HA       ASP  22   8.809 -12.945   5.818
  160   1HB   ASP  22          2HB       ASP  22   7.830 -10.670   6.465
  161   2HB   ASP  22          1HB       ASP  22   6.402 -11.518   7.137
  162    H    PHE  23           H        PHE  23   5.261 -13.353   5.899
  163    HA   PHE  23           HA       PHE  23   5.553 -15.992   7.117
  164   1HB   PHE  23          2HB       PHE  23   3.283 -13.943   6.831
  165   2HB   PHE  23          1HB       PHE  23   2.980 -15.648   7.319
  166    HD1  PHE  23           1HD      PHE  23   3.544 -16.450   9.433
  167    HD2  PHE  23           2HD      PHE  23   4.711 -12.525   8.307
  168    HE1  PHE  23           1HE      PHE  23   4.128 -15.957  11.758
  169    HE2  PHE  23           2HE      PHE  23   5.328 -12.040  10.627
  170    HZ   PHE  23           HZ       PHE  23   5.025 -13.757  12.361
  171    H    ASN  24           H        ASN  24   5.317 -14.650   4.065
  172    HA   ASN  24           HA       ASN  24   4.658 -15.250   2.110
  173   1HB   ASN  24          2HB       ASN  24   4.325 -18.093   3.168
  174   2HB   ASN  24          1HB       ASN  24   4.173 -17.605   1.440
  175   1HD2  ASN  24          1HD2      ASN  24   6.133 -19.464   2.441
  176   2HD2  ASN  24          2HD2      ASN  24   7.680 -18.756   2.043
  177    H    MET  25           H        MET  25   2.997 -13.826   3.422
  178    HA   MET  25           HA       MET  25   0.328 -14.763   2.694
  179   1HB   MET  25          2HB       MET  25   1.450 -13.404   4.872
  180   2HB   MET  25          1HB       MET  25   0.688 -12.072   3.962
  181   1HG   MET  25          2HG       MET  25  -1.499 -12.998   4.326
  182   2HG   MET  25          1HG       MET  25  -0.852 -14.621   4.718
  183   1HE   MET  25          1HE       MET  25   0.153 -14.659   8.260
  184   2HE   MET  25          2HE       MET  25   0.889 -14.954   6.647
  185   3HE   MET  25          3HE       MET  25  -0.784 -15.501   6.985
  186    HA   PRO  26           HA       PRO  26   0.859 -11.671  -0.598
  187   1HB   PRO  26          2HB       PRO  26  -1.630 -10.267  -0.545
  188   2HB   PRO  26          1HB       PRO  26  -1.297 -11.796  -1.393
  189   1HG   PRO  26          2HG       PRO  26  -2.952 -11.386   1.018
  190   2HG   PRO  26          1HG       PRO  26  -2.808 -12.810  -0.068
  191   1HD   PRO  26          2HD       PRO  26  -1.378 -12.022   2.490
  192   2HD   PRO  26          1HD       PRO  26  -1.537 -13.727   1.919
  193    H    LEU  27           H        LEU  27   1.280  -9.247  -0.781
  194    HA   LEU  27           HA       LEU  27   1.950  -8.256   1.822
  195   1HB   LEU  27          2HB       LEU  27   3.005  -8.035  -0.711
  196   2HB   LEU  27          1HB       LEU  27   2.224  -6.444  -0.547
  197    HG   LEU  27           HG       LEU  27   4.183  -7.803   1.384
  198   1HD1  LEU  27          1HD1      LEU  27   4.585  -5.412  -0.528
  199   2HD1  LEU  27          2HD1      LEU  27   5.294  -7.069  -0.685
  200   3HD1  LEU  27          3HD1      LEU  27   5.803  -5.995   0.674
  201   1HD2  LEU  27          1HD2      LEU  27   4.322  -5.555   2.574
  202   2HD2  LEU  27          2HD2      LEU  27   2.675  -6.272   2.689
  203   3HD2  LEU  27          3HD2      LEU  27   3.001  -4.941   1.515
  204    H    THR  28           H        THR  28   0.209  -7.700   3.018
  205    HA   THR  28           HA       THR  28  -1.979  -6.395   1.565
  206    HB   THR  28           HB       THR  28  -3.532  -7.188   2.721
  207    HG1  THR  28           1HG      THR  28  -1.785  -7.521   4.919
  208   1HG2  THR  28          1HG2      THR  28  -1.405  -9.334   3.355
  209   2HG2  THR  28          2HG2      THR  28  -1.868  -8.876   1.671
  210   3HG2  THR  28          3HG2      THR  28  -3.124  -9.553   2.801
  211    H    ILE  29           H        ILE  29  -2.974  -4.650   2.168
  212    HA   ILE  29           HA       ILE  29  -1.934  -3.186   4.536
  213    HB   ILE  29           HB       ILE  29  -3.355  -1.998   2.169
  214   1HG1  ILE  29          2HG1      ILE  29  -0.471  -1.967   3.220
  215   2HG1  ILE  29          1HG1      ILE  29  -1.025  -2.594   1.640
  216   1HG2  ILE  29          1HG2      ILE  29  -2.322  -0.935   4.900
  217   2HG2  ILE  29          2HG2      ILE  29  -4.051  -0.971   4.312
  218   3HG2  ILE  29          3HG2      ILE  29  -2.870   0.134   3.585
  219   1HD1  ILE  29          1HD1      ILE  29  -1.796  -0.266   1.007
  220   2HD1  ILE  29          2HD1      ILE  29  -0.013  -0.391   1.269
  221   3HD1  ILE  29          3HD1      ILE  29  -1.054   0.346   2.542
  222    H    SER  30           H        SER  30  -3.601  -2.543   6.024
  223    HA   SER  30           HA       SER  30  -5.861  -4.415   5.876
  224   1HB   SER  30          2HB       SER  30  -4.557  -3.259   8.376
  225   2HB   SER  30          1HB       SER  30  -5.726  -4.642   8.267
  226    HG   SER  30           HG       SER  30  -4.108  -5.587   6.828
  227    H    ARG  31           H        ARG  31  -5.342  -1.223   7.617
  228    HA   ARG  31           HA       ARG  31  -7.747  -0.349   6.281
  229   1HB   ARG  31          2HB       ARG  31  -8.805   0.371   8.449
  230   2HB   ARG  31          1HB       ARG  31  -8.792  -1.382   8.155
  231   1HG   ARG  31          2HG       ARG  31  -6.980  -1.760   9.699
  232   2HG   ARG  31          1HG       ARG  31  -6.708   0.001   9.944
  233   1HD   ARG  31          2HD       ARG  31  -8.818   0.283  11.092
  234   2HD   ARG  31          1HD       ARG  31  -9.379  -1.376  10.631
  235    HE   ARG  31           HE       ARG  31  -7.386  -2.260  11.953
  236   1HH1  ARG  31          1HH1      ARG  31  -9.155   0.687  13.014
  237   2HH1  ARG  31          2HH1      ARG  31  -9.077   0.215  14.666
  238   1HH2  ARG  31          1HH2      ARG  31  -6.949  -2.534  14.146
  239   2HH2  ARG  31          2HH2      ARG  31  -7.896  -1.649  15.313
  240    H    ILE  32           H        ILE  32  -8.276   1.864   6.689
  241    HA   ILE  32           HA       ILE  32  -5.929   3.517   6.619
  242    HB   ILE  32           HB       ILE  32  -8.853   3.769   6.005
  243   1HG1  ILE  32          2HG1      ILE  32  -8.191   4.619   3.885
  244   2HG1  ILE  32          1HG1      ILE  32  -6.498   4.825   4.338
  245   1HG2  ILE  32          1HG2      ILE  32  -6.881   6.118   6.252
  246   2HG2  ILE  32          2HG2      ILE  32  -8.415   5.908   7.219
  247   3HG2  ILE  32          3HG2      ILE  32  -8.494   6.168   5.451
  248   1HD1  ILE  32          1HD1      ILE  32  -6.241   2.302   4.414
  249   2HD1  ILE  32          2HD1      ILE  32  -6.732   2.939   2.813
  250   3HD1  ILE  32          3HD1      ILE  32  -7.966   2.144   3.876
  251    H    THR  33           H        THR  33  -5.413   5.119   8.061
  252    HA   THR  33           HA       THR  33  -6.669   5.189  10.632
  253    HB   THR  33           HB       THR  33  -4.492   6.923   9.420
  254    HG1  THR  33           1HG      THR  33  -3.417   5.738  11.222
  255   1HG2  THR  33          1HG2      THR  33  -4.159   7.754  11.755
  256   2HG2  THR  33          2HG2      THR  33  -5.537   6.731  12.328
  257   3HG2  THR  33          3HG2      THR  33  -5.845   8.128  11.263
  258    HA   PRO  34           HA       PRO  34  -9.422   8.255   9.011
  259   1HB   PRO  34          2HB       PRO  34 -10.570   9.281  11.305
  260   2HB   PRO  34          1HB       PRO  34 -10.726   7.536  10.803
  261   1HG   PRO  34          2HG       PRO  34  -8.598   8.539  12.755
  262   2HG   PRO  34          1HG       PRO  34  -9.939   7.341  13.078
  263   1HD   PRO  34          2HD       PRO  34  -7.545   6.425  12.176
  264   2HD   PRO  34          1HD       PRO  34  -9.051   5.796  11.373
  265    H    GLY  35           H        GLY  35  -9.579  10.336   8.449
  266   1HA   GLY  35          2HA       GLY  35  -9.372  12.519   8.546
  267   2HA   GLY  35          1HA       GLY  35  -8.380  12.383  10.029
  268    H    SER  36           H        SER  36  -7.123  10.565   7.474
  269    HA   SER  36           HA       SER  36  -5.352  12.778   6.657
  270   1HB   SER  36          2HB       SER  36  -4.324  11.040   8.204
  271   2HB   SER  36          1HB       SER  36  -4.564   9.834   6.904
  272    HG   SER  36           HG       SER  36  -2.672  10.558   6.378
  273    H    LYS  37           H        LYS  37  -4.037  11.835   4.647
  274    HA   LYS  37           HA       LYS  37  -5.833  12.065   2.532
  275   1HB   LYS  37          2HB       LYS  37  -2.877  11.726   2.880
  276   2HB   LYS  37          1HB       LYS  37  -3.521  11.232   1.292
  277   1HG   LYS  37          2HG       LYS  37  -2.785  13.531   1.178
  278   2HG   LYS  37          1HG       LYS  37  -4.548  13.415   0.911
  279   1HD   LYS  37          2HD       LYS  37  -4.944  14.119   3.290
  280   2HD   LYS  37          1HD       LYS  37  -3.166  14.225   3.526
  281   1HE   LYS  37          2HE       LYS  37  -2.991  16.158   2.067
  282   2HE   LYS  37          1HE       LYS  37  -4.613  15.846   1.337
  283   1HZ   LYS  37          1HZ       LYS  37  -4.224  16.661   4.195
  284   2HZ   LYS  37          2HZ       LYS  37  -5.671  16.462   3.365
  285   3HZ   LYS  37          3HZ       LYS  37  -4.617  17.667   2.893
  286    H    ALA  38           H        ALA  38  -4.382   9.201   3.957
  287    HA   ALA  38           HA       ALA  38  -5.179   7.275   2.118
  288   1HB   ALA  38          1HB       ALA  38  -5.017   7.088   5.159
  289   2HB   ALA  38          2HB       ALA  38  -3.598   7.044   4.050
  290   3HB   ALA  38          3HB       ALA  38  -4.815   5.751   3.951
  291    H    ALA  39           H        ALA  39  -7.172   9.000   4.506
  292    HA   ALA  39           HA       ALA  39  -9.395   7.276   3.871
  293   1HB   ALA  39          1HB       ALA  39  -9.049   8.208   6.214
  294   2HB   ALA  39          2HB       ALA  39 -10.610   8.757   5.509
  295   3HB   ALA  39          3HB       ALA  39  -9.192   9.868   5.557
  296    H    GLN  40           H        GLN  40  -8.346  10.599   3.281
  297    HA   GLN  40           HA       GLN  40 -10.786  11.439   2.266
  298   1HB   GLN  40          2HB       GLN  40  -8.285  12.528   3.115
  299   2HB   GLN  40          1HB       GLN  40  -8.539  13.186   1.492
  300   1HG   GLN  40          2HG       GLN  40 -10.536  13.310   3.853
  301   2HG   GLN  40          1HG       GLN  40  -9.490  14.653   3.281
  302   1HE2  GLN  40          1HE2      GLN  40  -9.839  15.361   0.940
  303   2HE2  GLN  40          2HE2      GLN  40 -11.483  15.296   0.334
  304    H    SER  41           H        SER  41  -8.014  10.168   0.496
  305    HA   SER  41           HA       SER  41  -8.840  11.657  -1.852
  306   1HB   SER  41          2HB       SER  41  -6.481  11.483  -1.027
  307   2HB   SER  41          1HB       SER  41  -6.469   9.774  -1.525
  308    HG   SER  41           HG       SER  41  -6.538  12.130  -3.041
  309    H    GLN  42           H        GLN  42  -7.757   9.656  -3.735
  310    HA   GLN  42           HA       GLN  42 -10.085   7.886  -3.914
  311   1HB   GLN  42          2HB       GLN  42  -7.894   8.544  -5.943
  312   2HB   GLN  42          1HB       GLN  42  -9.306   7.478  -6.219
  313   1HG   GLN  42          2HG       GLN  42 -10.842   9.449  -5.742
  314   2HG   GLN  42          1HG       GLN  42  -9.397  10.520  -5.639
  315   1HE2  GLN  42          1HE2      GLN  42  -7.820  10.120  -7.670
  316   2HE2  GLN  42          2HE2      GLN  42  -8.658  10.154  -9.207
  317    H    LEU  43           H        LEU  43  -7.444   7.937  -2.255
  318    HA   LEU  43           HA       LEU  43  -6.309   5.352  -2.801
  319   1HB   LEU  43          2HB       LEU  43  -5.204   7.548  -1.754
  320   2HB   LEU  43          1HB       LEU  43  -6.010   7.039  -0.251
  321    HG   LEU  43           HG       LEU  43  -4.828   4.676  -0.848
  322   1HD1  LEU  43          1HD1      LEU  43  -3.004   6.719  -2.275
  323   2HD1  LEU  43          2HD1      LEU  43  -4.077   5.556  -3.111
  324   3HD1  LEU  43          3HD1      LEU  43  -2.717   4.943  -2.089
  325   1HD2  LEU  43          1HD2      LEU  43  -2.614   5.747   0.277
  326   2HD2  LEU  43          2HD2      LEU  43  -4.101   5.512   1.222
  327   3HD2  LEU  43          3HD2      LEU  43  -3.706   7.140   0.549
  328    H    SER  44           H        SER  44  -7.077   3.410  -1.913
  329    HA   SER  44           HA       SER  44  -7.828   3.678   0.860
  330   1HB   SER  44          2HB       SER  44  -9.676   2.008   0.716
  331   2HB   SER  44          1HB       SER  44 -10.053   3.617   0.028
  332    HG   SER  44           HG       SER  44  -9.693   2.769  -2.033
  333    H    GLN  45           H        GLN  45  -5.348   3.091   0.494
  334    HA   GLN  45           HA       GLN  45  -4.489   0.651   0.041
  335   1HB   GLN  45          2HB       GLN  45  -4.112   2.718   2.276
  336   2HB   GLN  45          1HB       GLN  45  -3.034   1.297   2.131
  337   1HG   GLN  45          2HG       GLN  45  -2.365   1.842  -0.083
  338   2HG   GLN  45          1HG       GLN  45  -3.368   3.329  -0.149
  339   1HE2  GLN  45          2HE2      GLN  45  -0.456   2.797  -0.176
  340   2HE2  GLN  45          1HE2      GLN  45   0.309   3.894   1.007
  341    H    GLY  46           H        GLY  46  -5.691  -1.171   0.450
  342   1HA   GLY  46          2HA       GLY  46  -5.507  -2.233   3.047
  343   2HA   GLY  46          1HA       GLY  46  -7.134  -1.554   2.802
  344    H    ASP  47           H        ASP  47  -4.909  -3.146   0.534
  345    HA   ASP  47           HA       ASP  47  -6.628  -5.394   0.051
  346   1HB   ASP  47          2HB       ASP  47  -6.522  -2.826  -1.549
  347   2HB   ASP  47          1HB       ASP  47  -6.477  -4.291  -2.550
  348    H    LEU  48           H        LEU  48  -5.343  -6.409  -2.227
  349    HA   LEU  48           HA       LEU  48  -2.873  -6.996  -0.884
  350   1HB   LEU  48          2HB       LEU  48  -4.215  -8.268  -3.313
  351   2HB   LEU  48          1HB       LEU  48  -2.685  -8.793  -2.550
  352    HG   LEU  48           HG       LEU  48  -4.141 -10.296  -1.626
  353   1HD1  LEU  48          1HD1      LEU  48  -4.525  -9.832   0.723
  354   2HD1  LEU  48          2HD1      LEU  48  -4.531  -8.054   0.460
  355   3HD1  LEU  48          3HD1      LEU  48  -3.005  -8.983   0.196
  356   1HD2  LEU  48          1HD2      LEU  48  -6.238  -9.102  -2.607
  357   2HD2  LEU  48          2HD2      LEU  48  -6.200  -8.078  -1.100
  358   3HD2  LEU  48          3HD2      LEU  48  -6.450  -9.866  -0.946
  359    H    VAL  49           H        VAL  49  -1.051  -5.938  -1.331
  360    HA   VAL  49           HA       VAL  49  -1.050  -4.117  -3.484
  361    HB   VAL  49           HB       VAL  49   0.921  -4.895  -1.325
  362   1HG1  VAL  49          1HG1      VAL  49   2.030  -2.703  -1.858
  363   2HG1  VAL  49          2HG1      VAL  49   1.087  -2.634  -3.407
  364   3HG1  VAL  49          3HG1      VAL  49   2.293  -3.961  -3.119
  365   1HG2  VAL  49          1HG2      VAL  49  -0.961  -2.467  -1.699
  366   2HG2  VAL  49          2HG2      VAL  49   0.194  -2.727  -0.342
  367   3HG2  VAL  49          3HG2      VAL  49  -1.212  -3.824  -0.535
  368    H    VAL  50           H        VAL  50   0.053  -4.224  -5.455
  369    HA   VAL  50           HA       VAL  50   1.494  -6.700  -5.983
  370    HB   VAL  50           HB       VAL  50   0.741  -4.682  -8.117
  371   1HG1  VAL  50          1HG1      VAL  50   2.315  -6.582  -8.645
  372   2HG1  VAL  50          2HG1      VAL  50   0.727  -6.773  -9.473
  373   3HG1  VAL  50          3HG1      VAL  50   1.096  -7.752  -8.006
  374   1HG2  VAL  50          1HG2      VAL  50  -1.362  -4.941  -7.079
  375   2HG2  VAL  50          2HG2      VAL  50  -1.127  -6.727  -6.792
  376   3HG2  VAL  50          3HG2      VAL  50  -1.333  -6.074  -8.469
  377    H    ALA  51           H        ALA  51   1.675  -3.213  -6.565
  378    HA   ALA  51           HA       ALA  51   4.586  -3.369  -6.612
  379   1HB   ALA  51          1HB       ALA  51   4.656  -1.939  -8.686
  380   2HB   ALA  51          2HB       ALA  51   2.858  -1.990  -8.761
  381   3HB   ALA  51          3HB       ALA  51   3.815  -3.495  -8.996
  382    H    ILE  52           H        ILE  52   5.691  -1.416  -6.388
  383    HA   ILE  52           HA       ILE  52   4.205   0.870  -5.360
  384    HB   ILE  52           HB       ILE  52   5.093  -0.898  -3.712
  385   1HG1  ILE  52          2HG1      ILE  52   4.112   1.278  -3.038
  386   2HG1  ILE  52          1HG1      ILE  52   5.405   0.687  -1.961
  387   1HG2  ILE  52          1HG2      ILE  52   7.353  -1.137  -4.625
  388   2HG2  ILE  52          2HG2      ILE  52   7.374  -0.642  -2.891
  389   3HG2  ILE  52          3HG2      ILE  52   7.730   0.567  -4.189
  390   1HD1  ILE  52          1HD1      ILE  52   5.643   3.002  -3.986
  391   2HD1  ILE  52          2HD1      ILE  52   7.032   2.324  -3.056
  392   3HD1  ILE  52          3HD1      ILE  52   5.671   3.087  -2.187
  393    H    ASP  53           H        ASP  53   5.025   2.722  -6.266
  394    HA   ASP  53           HA       ASP  53   6.143   4.015  -7.570
  395   1HB   ASP  53          2HB       ASP  53   7.927   3.403  -5.829
  396   2HB   ASP  53          1HB       ASP  53   8.668   2.360  -7.086
  397    H    GLY  54           H        GLY  54   5.408   1.078  -8.471
  398   1HA   GLY  54          2HA       GLY  54   5.017   0.316 -10.610
  399   2HA   GLY  54          1HA       GLY  54   6.395   1.282 -11.230
  400    H    VAL  55           H        VAL  55   7.170  -0.360  -8.285
  401    HA   VAL  55           HA       VAL  55   8.500  -2.452  -9.847
  402    HB   VAL  55           HB       VAL  55   9.263  -1.292  -7.158
  403   1HG1  VAL  55          1HG1      VAL  55   9.843  -3.724  -7.383
  404   2HG1  VAL  55          2HG1      VAL  55  11.327  -2.735  -7.592
  405   3HG1  VAL  55          3HG1      VAL  55  10.495  -3.435  -9.030
  406   1HG2  VAL  55          1HG2      VAL  55   9.716   0.333  -8.985
  407   2HG2  VAL  55          2HG2      VAL  55  10.475  -0.960  -9.985
  408   3HG2  VAL  55          3HG2      VAL  55  11.252  -0.428  -8.449
  409    H    ASN  56           H        ASN  56   7.710  -4.421  -9.561
  410    HA   ASN  56           HA       ASN  56   5.655  -4.988  -7.821
  411   1HB   ASN  56          2HB       ASN  56   5.952  -7.346  -8.552
  412   2HB   ASN  56          1HB       ASN  56   5.975  -6.127  -9.877
  413   1HD2  ASN  56          1HD2      ASN  56   9.038  -6.462  -8.143
  414   2HD2  ASN  56          2HD2      ASN  56   9.806  -7.240  -9.515
  415    H    THR  57           H        THR  57   5.402  -5.678  -5.716
  416    HA   THR  57           HA       THR  57   7.784  -5.796  -4.155
  417    HB   THR  57           HB       THR  57   6.081  -5.827  -2.303
  418    HG1  THR  57           1HG      THR  57   4.300  -6.640  -3.479
  419   1HG2  THR  57          1HG2      THR  57   5.465  -3.457  -2.689
  420   2HG2  THR  57          2HG2      THR  57   5.847  -3.600  -4.443
  421   3HG2  THR  57          3HG2      THR  57   7.171  -3.760  -3.228
  422    H    ASP  58           H        ASP  58   8.121  -7.889  -5.628
  423    HA   ASP  58           HA       ASP  58   6.493 -10.048  -5.191
  424   1HB   ASP  58          2HB       ASP  58   8.115  -9.539  -7.123
  425   2HB   ASP  58          1HB       ASP  58   9.434 -10.166  -6.085
  426    H    THR  59           H        THR  59   9.731  -9.493  -3.695
  427    HA   THR  59           HA       THR  59   8.962 -11.603  -1.803
  428    HB   THR  59           HB       THR  59  10.900 -11.972  -3.351
  429    HG1  THR  59           1HG      THR  59  12.070 -12.926  -1.755
  430   1HG2  THR  59          1HG2      THR  59  12.334 -10.060  -1.389
  431   2HG2  THR  59          2HG2      THR  59  11.960  -9.677  -3.113
  432   3HG2  THR  59          3HG2      THR  59  13.075 -11.028  -2.704
  433    H    MET  60           H        MET  60   8.385  -8.557  -1.805
  434    HA   MET  60           HA       MET  60   9.895  -7.598   0.368
  435   1HB   MET  60          2HB       MET  60   7.777  -6.716  -1.613
  436   2HB   MET  60          1HB       MET  60   8.123  -5.677  -0.193
  437   1HG   MET  60          2HG       MET  60   9.427  -4.800  -1.928
  438   2HG   MET  60          1HG       MET  60  10.565  -5.659  -0.870
  439   1HE   MET  60          1HE       MET  60  12.280  -5.806  -4.279
  440   2HE   MET  60          2HE       MET  60  12.352  -5.371  -2.538
  441   3HE   MET  60          3HE       MET  60  11.231  -4.497  -3.637
  442    H    THR  61           H        THR  61   9.072  -6.765   2.264
  443    HA   THR  61           HA       THR  61   6.882  -8.345   3.367
  444    HB   THR  61           HB       THR  61   8.053  -8.257   5.445
  445    HG1  THR  61           1HG      THR  61   9.957  -7.165   5.627
  446   1HG2  THR  61          1HG2      THR  61   8.855  -9.874   3.596
  447   2HG2  THR  61          2HG2      THR  61  10.132  -9.432   4.802
  448   3HG2  THR  61          3HG2      THR  61  10.124  -8.676   3.174
  449    H    HIS  62           H        HIS  62   6.006  -7.221   5.465
  450    HA   HIS  62           HA       HIS  62   4.795  -4.854   4.917
  451   1HB   HIS  62          2HB       HIS  62   3.992  -4.790   7.055
  452   2HB   HIS  62          1HB       HIS  62   4.402  -6.520   6.877
  453    HD1  HIS  62           1HD      HIS  62   5.978  -7.476   8.724
  454    HD2  HIS  62           2HD      HIS  62   5.761  -3.287   8.760
  455    HE1  HIS  62           1HE      HIS  62   7.236  -6.661  10.750
  456    H    LEU  63           H        LEU  63   7.822  -5.293   6.655
  457    HA   LEU  63           HA       LEU  63   8.357  -2.636   7.276
  458   1HB   LEU  63          2HB       LEU  63   9.563  -4.583   8.262
  459   2HB   LEU  63          1HB       LEU  63  10.304  -4.919   6.671
  460    HG   LEU  63           HG       LEU  63  11.357  -2.589   6.749
  461   1HD1  LEU  63          1HD1      LEU  63   9.865  -1.499   8.436
  462   2HD1  LEU  63          2HD1      LEU  63  11.580  -1.496   8.974
  463   3HD1  LEU  63          3HD1      LEU  63  10.419  -2.675   9.693
  464   1HD2  LEU  63          1HD2      LEU  63  12.610  -4.617   7.178
  465   2HD2  LEU  63          2HD2      LEU  63  12.110  -4.619   8.922
  466   3HD2  LEU  63          3HD2      LEU  63  13.172  -3.296   8.276
  467    H    GLU  64           H        GLU  64   9.442  -4.565   4.478
  468    HA   GLU  64           HA       GLU  64  10.792  -2.561   3.169
  469   1HB   GLU  64          2HB       GLU  64   9.717  -5.226   2.740
  470   2HB   GLU  64          1HB       GLU  64   9.495  -4.383   1.210
  471   1HG   GLU  64          2HG       GLU  64  12.140  -4.742   2.794
  472   2HG   GLU  64          1HG       GLU  64  11.620  -5.705   1.380
  473    H    ALA  65           H        ALA  65   7.349  -3.495   2.779
  474    HA   ALA  65           HA       ALA  65   6.778  -1.535   0.878
  475   1HB   ALA  65          1HB       ALA  65   5.567  -3.706   1.392
  476   2HB   ALA  65          2HB       ALA  65   4.476  -2.275   1.247
  477   3HB   ALA  65          3HB       ALA  65   4.909  -2.928   2.879
  478    H    GLN  66           H        GLN  66   6.436  -1.398   4.405
  479    HA   GLN  66           HA       GLN  66   5.341   1.088   4.710
  480   1HB   GLN  66          2HB       GLN  66   5.762  -0.527   6.540
  481   2HB   GLN  66          1HB       GLN  66   7.481  -0.525   6.179
  482   1HG   GLN  66          2HG       GLN  66   7.292   0.607   8.202
  483   2HG   GLN  66          1HG       GLN  66   7.692   1.869   7.004
  484   1HE2  GLN  66          1HE2      GLN  66   4.539   0.287   7.913
  485   2HE2  GLN  66          2HE2      GLN  66   3.722   1.790   8.232
  486    H    ASN  67           H        ASN  67   8.786   0.206   4.457
  487    HA   ASN  67           HA       ASN  67   9.785   2.816   4.521
  488   1HB   ASN  67          2HB       ASN  67  10.773   0.020   3.773
  489   2HB   ASN  67          1HB       ASN  67  11.881   1.401   3.591
  490   1HD2  ASN  67          1HD2      ASN  67  12.766  -0.408   5.180
  491   2HD2  ASN  67          2HD2      ASN  67  12.657   0.055   6.870
  492    H    LYS  68           H        LYS  68   8.627   0.886   1.790
  493    HA   LYS  68           HA       LYS  68   9.841   2.581  -0.130
  494   1HB   LYS  68          2HB       LYS  68   7.596   0.532  -0.371
  495   2HB   LYS  68          1HB       LYS  68   8.423   1.320  -1.755
  496   1HG   LYS  68          2HG       LYS  68  10.335   0.062   0.133
  497   2HG   LYS  68          1HG       LYS  68   9.124  -1.087  -0.484
  498   1HD   LYS  68          2HD       LYS  68   9.683  -0.489  -2.825
  499   2HD   LYS  68          1HD       LYS  68  10.906   0.689  -2.261
  500   1HE   LYS  68          2HE       LYS  68  10.923  -2.356  -1.654
  501   2HE   LYS  68          1HE       LYS  68  11.888  -1.536  -2.955
  502   1HZ   LYS  68          1HZ       LYS  68  12.667  -0.102  -0.889
  503   2HZ   LYS  68          2HZ       LYS  68  13.379  -1.586  -1.276
  504   3HZ   LYS  68          3HZ       LYS  68  12.278  -1.532  -0.051
  505    H    ILE  69           H        ILE  69   6.353   2.251   0.996
  506    HA   ILE  69           HA       ILE  69   5.411   4.480  -0.152
  507    HB   ILE  69           HB       ILE  69   4.822   2.996   2.403
  508   1HG1  ILE  69          2HG1      ILE  69   3.325   3.392  -0.245
  509   2HG1  ILE  69          1HG1      ILE  69   4.322   1.981   0.045
  510   1HG2  ILE  69          1HG2      ILE  69   4.024   5.194   2.953
  511   2HG2  ILE  69          2HG2      ILE  69   2.574   4.402   2.245
  512   3HG2  ILE  69          3HG2      ILE  69   3.531   5.548   1.256
  513   1HD1  ILE  69          1HD1      ILE  69   2.954   1.245   1.982
  514   2HD1  ILE  69          2HD1      ILE  69   2.026   1.323   0.439
  515   3HD1  ILE  69          3HD1      ILE  69   1.796   2.591   1.681
  516    H    LYS  70           H        LYS  70   7.071   4.392   3.054
  517    HA   LYS  70           HA       LYS  70   6.700   7.158   3.396
  518   1HB   LYS  70          2HB       LYS  70   8.071   4.934   4.842
  519   2HB   LYS  70          1HB       LYS  70   8.692   6.559   5.172
  520   1HG   LYS  70          2HG       LYS  70   7.084   6.051   6.819
  521   2HG   LYS  70          1HG       LYS  70   6.492   7.398   5.804
  522   1HD   LYS  70          2HD       LYS  70   5.036   5.780   4.549
  523   2HD   LYS  70          1HD       LYS  70   5.574   4.455   5.627
  524   1HE   LYS  70          2HE       LYS  70   4.003   7.003   6.445
  525   2HE   LYS  70          1HE       LYS  70   3.330   5.334   6.260
  526   1HZ   LYS  70          1HZ       LYS  70   3.751   5.759   8.550
  527   2HZ   LYS  70          2HZ       LYS  70   5.334   6.239   8.279
  528   3HZ   LYS  70          3HZ       LYS  70   4.892   4.629   8.014
  529    H    SER  71           H        SER  71   8.575   6.024   0.992
  530    HA   SER  71           HA       SER  71  10.923   7.617   1.595
  531   1HB   SER  71          2HB       SER  71  11.048   5.415   0.355
  532   2HB   SER  71          1HB       SER  71  10.120   6.159  -0.988
  533    HG   SER  71           HG       SER  71  12.348   6.256  -1.343
  534    H    ALA  72           H        ALA  72   8.001   7.692  -0.188
  535    HA   ALA  72           HA       ALA  72   8.715   9.924  -1.874
  536   1HB   ALA  72          1HB       ALA  72   7.561   7.861  -2.703
  537   2HB   ALA  72          2HB       ALA  72   6.478   9.288  -2.930
  538   3HB   ALA  72          3HB       ALA  72   6.236   8.142  -1.539
  539    H    SER  73           H        SER  73   7.344  11.775  -2.154
  540    HA   SER  73           HA       SER  73   5.251  12.239  -0.327
  541   1HB   SER  73          2HB       SER  73   5.861  14.123   0.905
  542   2HB   SER  73          1HB       SER  73   7.125  12.900   1.184
  543    HG   SER  73           HG       SER  73   7.208  15.307  -0.241
  544    H    TYR  74           H        TYR  74   7.339  13.426  -2.917
  545    HA   TYR  74           HA       TYR  74   5.510  15.350  -3.806
  546   1HB   TYR  74          2HB       TYR  74   8.026  15.077  -4.399
  547   2HB   TYR  74          1HB       TYR  74   7.518  13.830  -5.579
  548    HD1  TYR  74           1HD      TYR  74   5.926  14.515  -7.413
  549    HD2  TYR  74           2HD      TYR  74   7.723  17.340  -4.796
  550    HE1  TYR  74           1HE      TYR  74   5.269  16.319  -8.920
  551    HE2  TYR  74           2HE      TYR  74   7.107  19.145  -6.318
  552    HH   TYR  74           HH       TYR  74   4.910  18.598  -9.004
  553    H    ASN  75           H        ASN  75   6.132  11.988  -4.963
  554    HA   ASN  75           HA       ASN  75   3.322  11.701  -5.162
  555   1HB   ASN  75          2HB       ASN  75   3.177  10.887  -7.496
  556   2HB   ASN  75          1HB       ASN  75   3.442  12.644  -7.292
  557   1HD2  ASN  75          1HD2      ASN  75   5.918   9.958  -7.300
  558   2HD2  ASN  75          2HD2      ASN  75   6.576  10.414  -8.850
  559    H    LEU  76           H        LEU  76   2.675   9.888  -4.422
  560    HA   LEU  76           HA       LEU  76   4.520   7.614  -4.362
  561   1HB   LEU  76          2HB       LEU  76   3.690   8.535  -2.177
  562   2HB   LEU  76          1HB       LEU  76   2.022   8.399  -2.756
  563    HG   LEU  76           HG       LEU  76   2.243   5.897  -2.882
  564   1HD1  LEU  76          1HD1      LEU  76   4.986   6.334  -1.534
  565   2HD1  LEU  76          2HD1      LEU  76   4.753   5.741  -3.228
  566   3HD1  LEU  76          3HD1      LEU  76   4.166   4.757  -1.846
  567   1HD2  LEU  76          1HD2      LEU  76   2.162   5.510  -0.454
  568   2HD2  LEU  76          2HD2      LEU  76   1.316   7.054  -0.864
  569   3HD2  LEU  76          3HD2      LEU  76   2.976   7.093  -0.154
  570    H    SER  77           H        SER  77   4.074   6.160  -6.020
  571    HA   SER  77           HA       SER  77   1.260   5.938  -6.845
  572   1HB   SER  77          2HB       SER  77   3.072   6.717  -8.482
  573   2HB   SER  77          1HB       SER  77   3.699   5.042  -8.427
  574    HG   SER  77           HG       SER  77   1.148   6.004  -9.258
  575    H    LEU  78           H        LEU  78   0.132   4.255  -6.206
  576    HA   LEU  78           HA       LEU  78   1.559   1.821  -5.419
  577   1HB   LEU  78          2HB       LEU  78  -1.233   2.741  -4.573
  578   2HB   LEU  78          1HB       LEU  78  -0.258   1.411  -3.898
  579    HG   LEU  78           HG       LEU  78  -0.246   3.050  -2.284
  580   1HD1  LEU  78          1HD1      LEU  78   2.028   3.801  -1.959
  581   2HD1  LEU  78          2HD1      LEU  78   2.427   3.583  -3.706
  582   3HD1  LEU  78          3HD1      LEU  78   2.042   2.153  -2.671
  583   1HD2  LEU  78          1HD2      LEU  78   0.004   5.379  -2.422
  584   2HD2  LEU  78          2HD2      LEU  78  -1.191   4.903  -3.688
  585   3HD2  LEU  78          3HD2      LEU  78   0.489   5.334  -4.166
  586    H    THR  79           H        THR  79   0.748  -0.229  -6.165
  587    HA   THR  79           HA       THR  79  -1.775  -0.170  -7.597
  588    HB   THR  79           HB       THR  79   0.628  -1.787  -8.535
  589    HG1  THR  79           1HG      THR  79  -0.292   0.761  -9.129
  590   1HG2  THR  79          1HG2      THR  79  -2.167  -1.112  -9.681
  591   2HG2  THR  79          2HG2      THR  79  -1.620  -2.722  -9.066
  592   3HG2  THR  79          3HG2      THR  79  -0.878  -2.033 -10.558
  593    H    LEU  80           H        LEU  80  -3.100  -1.446  -6.375
  594    HA   LEU  80           HA       LEU  80  -2.125  -4.031  -5.447
  595   1HB   LEU  80          2HB       LEU  80  -3.214  -3.808  -3.396
  596   2HB   LEU  80          1HB       LEU  80  -2.099  -2.405  -3.638
  597    HG   LEU  80           HG       LEU  80  -5.107  -2.488  -3.889
  598   1HD1  LEU  80          1HD1      LEU  80  -4.099  -2.633  -1.586
  599   2HD1  LEU  80          2HD1      LEU  80  -5.042  -1.066  -1.843
  600   3HD1  LEU  80          3HD1      LEU  80  -3.212  -1.072  -1.917
  601   1HD2  LEU  80          1HD2      LEU  80  -2.917  -0.396  -4.338
  602   2HD2  LEU  80          2HD2      LEU  80  -4.568   0.208  -3.809
  603   3HD2  LEU  80          3HD2      LEU  80  -4.386  -0.697  -5.391
  604    H    GLN  81           H        GLN  81  -3.955  -5.515  -4.933
  605    HA   GLN  81           HA       GLN  81  -5.959  -5.325  -7.065
  606   1HB   GLN  81          2HB       GLN  81  -4.515  -7.680  -5.807
  607   2HB   GLN  81          1HB       GLN  81  -5.985  -7.878  -6.821
  608   1HG   GLN  81          2HG       GLN  81  -4.931  -6.982  -8.784
  609   2HG   GLN  81          1HG       GLN  81  -3.442  -6.536  -7.855
  610   1HE2  GLN  81          1HE2      GLN  81  -2.781  -7.970  -9.904
  611   2HE2  GLN  81          2HE2      GLN  81  -2.546  -9.660  -9.517
  612    H    LYS  82           H        LYS  82  -8.002  -5.740  -6.740
  613    HA   LYS  82           HA       LYS  82  -9.164  -5.896  -4.140
  614   1HB   LYS  82          2HB       LYS  82 -10.116  -6.021  -7.014
  615   2HB   LYS  82          1HB       LYS  82 -11.215  -6.561  -5.709
  616   1HG   LYS  82          2HG       LYS  82 -11.735  -4.338  -6.370
  617   2HG   LYS  82          1HG       LYS  82 -11.310  -4.479  -4.649
  618   1HD   LYS  82          2HD       LYS  82  -8.928  -3.719  -6.245
  619   2HD   LYS  82          1HD       LYS  82 -10.272  -2.616  -6.591
  620   1HE   LYS  82          2HE       LYS  82  -9.627  -3.354  -3.671
  621   2HE   LYS  82          1HE       LYS  82  -8.584  -2.191  -4.562
  622   1HZ   LYS  82          1HZ       LYS  82 -10.173  -0.962  -3.494
  623   2HZ   LYS  82          2HZ       LYS  82 -11.481  -1.932  -3.947
  624   3HZ   LYS  82          3HZ       LYS  82 -10.730  -0.966  -5.102
  625    H    SER  83           H        SER  83 -10.113  -8.091  -6.564
  626    HA   SER  83           HA       SER  83  -9.959 -10.259  -4.611
  627   1HB   SER  83          2HB       SER  83 -12.118  -9.781  -5.726
  628   2HB   SER  83          1HB       SER  83 -11.381 -10.164  -7.307
  629    HG   SER  83           HG       SER  83 -11.567 -11.958  -5.093
  630    H    LYS  84           H        LYS  84  -8.368 -11.711  -4.584
  631    HA   LYS  84           HA       LYS  84  -7.292 -12.616  -7.166
  632   1HB   LYS  84          2HB       LYS  84  -5.623 -11.769  -5.421
  633   2HB   LYS  84          1HB       LYS  84  -6.208 -13.063  -4.346
  634   1HG   LYS  84          2HG       LYS  84  -5.578 -14.599  -6.515
  635   2HG   LYS  84          1HG       LYS  84  -4.514 -13.228  -6.880
  636   1HD   LYS  84          2HD       LYS  84  -3.230 -13.562  -4.896
  637   2HD   LYS  84          1HD       LYS  84  -4.528 -14.466  -4.070
  638   1HE   LYS  84          2HE       LYS  84  -2.938 -15.555  -6.490
  639   2HE   LYS  84          1HE       LYS  84  -2.622 -15.940  -4.756
  640   1HZ   LYS  84          1HZ       LYS  84  -5.012 -16.684  -4.681
  641   2HZ   LYS  84          2HZ       LYS  84  -3.961 -17.653  -5.566
  642   3HZ   LYS  84          3HZ       LYS  84  -5.031 -16.642  -6.365
  643    H    ARG  85           H        ARG  85  -7.483 -14.867  -7.631
  644    HA   ARG  85           HA       ARG  85  -8.414 -16.558  -5.495
  645   1HB   ARG  85          2HB       ARG  85  -9.949 -17.793  -6.904
  646   2HB   ARG  85          1HB       ARG  85 -10.472 -16.098  -6.728
  647   1HG   ARG  85          2HG       ARG  85  -9.601 -15.568  -9.021
  648   2HG   ARG  85          1HG       ARG  85  -8.972 -17.239  -9.166
  649   1HD   ARG  85          2HD       ARG  85 -11.113 -17.055 -10.399
  650   2HD   ARG  85          1HD       ARG  85 -11.290 -18.159  -8.971
  651    HE   ARG  85           HE       ARG  85 -11.970 -15.268  -8.504
  652   1HH1  ARG  85          1HH1      ARG  85 -13.353 -18.476  -9.396
  653   2HH1  ARG  85          2HH1      ARG  85 -14.937 -17.982  -8.923
  654   1HH2  ARG  85          1HH2      ARG  85 -13.975 -14.746  -7.916
  655   2HH2  ARG  85          2HH2      ARG  85 -15.325 -15.836  -8.054
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1  -6.420  -9.005 -12.191
    2   2H    MET   1          2HT       MET   1  -5.984  -8.414 -10.651
    3   3H    MET   1          3HT       MET   1  -5.535  -7.592 -12.034
    4    HA   MET   1           HA       MET   1  -7.594  -6.784 -12.486
    5   1HB   MET   1          2HB       MET   1  -8.735  -9.014 -12.165
    6   2HB   MET   1          1HB       MET   1  -8.750  -8.721 -10.399
    7   1HG   MET   1          2HG       MET   1 -10.141  -6.630 -10.829
    8   2HG   MET   1          1HG       MET   1 -10.113  -7.014 -12.570
    9   1HE   MET   1          1HE       MET   1 -12.531  -7.060 -13.026
   10   2HE   MET   1          2HE       MET   1 -12.646  -6.353 -11.377
   11   3HE   MET   1          3HE       MET   1 -13.764  -7.667 -11.869
   12    H    ALA   2           H        ALA   2  -6.752  -4.831 -11.681
   13    HA   ALA   2           HA       ALA   2  -6.812  -4.486  -8.765
   14   1HB   ALA   2          1HB       ALA   2  -4.617  -5.422  -9.327
   15   2HB   ALA   2          2HB       ALA   2  -4.384  -3.676  -8.986
   16   3HB   ALA   2          3HB       ALA   2  -4.419  -4.259 -10.691
   17    H    TYR   3           H        TYR   3  -5.767  -2.180  -8.322
   18    HA   TYR   3           HA       TYR   3  -6.495  -0.330 -10.403
   19   1HB   TYR   3          2HB       TYR   3  -7.781   1.161  -9.211
   20   2HB   TYR   3          1HB       TYR   3  -8.579  -0.436  -9.035
   21    HD1  TYR   3           1HD      TYR   3  -8.083   2.409  -7.521
   22    HD2  TYR   3           2HD      TYR   3  -7.321  -1.695  -6.697
   23    HE1  TYR   3           1HE      TYR   3  -8.272   2.861  -5.112
   24    HE2  TYR   3           2HE      TYR   3  -7.542  -1.266  -4.320
   25    HH   TYR   3           HH       TYR   3  -7.993   0.309  -2.680
   26    H    SER   4           H        SER   4  -5.466   1.731 -10.204
   27    HA   SER   4           HA       SER   4  -3.190   1.660  -8.357
   28   1HB   SER   4          2HB       SER   4  -2.625   0.908 -10.744
   29   2HB   SER   4          1HB       SER   4  -2.997   2.572 -11.268
   30    HG   SER   4           HG       SER   4  -0.968   1.612  -9.536
   31    H    VAL   5           H        VAL   5  -2.643   3.548  -7.398
   32    HA   VAL   5           HA       VAL   5  -3.672   6.015  -8.468
   33    HB   VAL   5           HB       VAL   5  -5.530   5.687  -7.194
   34   1HG1  VAL   5          1HG1      VAL   5  -5.524   4.859  -4.860
   35   2HG1  VAL   5          2HG1      VAL   5  -3.790   4.382  -5.050
   36   3HG1  VAL   5          3HG1      VAL   5  -5.081   3.630  -6.092
   37   1HG2  VAL   5          1HG2      VAL   5  -5.416   7.260  -5.336
   38   2HG2  VAL   5          2HG2      VAL   5  -4.397   7.886  -6.689
   39   3HG2  VAL   5          3HG2      VAL   5  -3.630   7.132  -5.241
   40    H    THR   6           H        THR   6  -2.290   7.548  -8.387
   41    HA   THR   6           HA       THR   6   0.097   7.273  -6.779
   42    HB   THR   6           HB       THR   6  -0.668   9.428  -8.773
   43    HG1  THR   6           1HG      THR   6  -0.525   7.357  -9.669
   44   1HG2  THR   6          1HG2      THR   6   1.228  10.047  -7.178
   45   2HG2  THR   6          2HG2      THR   6   1.869   9.716  -8.822
   46   3HG2  THR   6          3HG2      THR   6   2.033   8.470  -7.547
   47    H    LEU   7           H        LEU   7   0.119   8.102  -4.761
   48    HA   LEU   7           HA       LEU   7  -1.826  10.157  -4.064
   49   1HB   LEU   7          2HB       LEU   7  -1.738   7.892  -2.931
   50   2HB   LEU   7          1HB       LEU   7  -0.095   8.274  -2.379
   51    HG   LEU   7           HG       LEU   7  -1.056  10.251  -1.087
   52   1HD1  LEU   7          1HD1      LEU   7  -3.505  10.265  -0.601
   53   2HD1  LEU   7          2HD1      LEU   7  -3.762   8.938  -1.796
   54   3HD1  LEU   7          3HD1      LEU   7  -3.206  10.564  -2.354
   55   1HD2  LEU   7          1HD2      LEU   7  -1.932   8.838   0.749
   56   2HD2  LEU   7          2HD2      LEU   7  -0.530   8.024  -0.028
   57   3HD2  LEU   7          3HD2      LEU   7  -2.189   7.460  -0.396
   58    H    THR   8           H        THR   8  -1.198  12.120  -3.119
   59    HA   THR   8           HA       THR   8   1.686  12.706  -3.249
   60    HB   THR   8           HB       THR   8  -0.620  14.676  -3.411
   61    HG1  THR   8           1HG      THR   8  -0.761  13.826  -5.256
   62   1HG2  THR   8          1HG2      THR   8   1.532  15.679  -2.597
   63   2HG2  THR   8          2HG2      THR   8   1.202  16.186  -4.276
   64   3HG2  THR   8          3HG2      THR   8   2.423  14.891  -3.956
   65    H    GLY   9           H        GLY   9   2.641  13.556  -1.373
   66   1HA   GLY   9          2HA       GLY   9   1.353  15.150   0.411
   67   2HA   GLY   9          1HA       GLY   9   1.107  13.478   0.999
   68    HA   PRO  10           HA       PRO  10   5.481  14.402   2.114
   69   1HB   PRO  10          2HB       PRO  10   5.026  17.213   3.118
   70   2HB   PRO  10          1HB       PRO  10   6.513  16.494   2.394
   71   1HG   PRO  10          2HG       PRO  10   4.936  18.211   0.929
   72   2HG   PRO  10          1HG       PRO  10   5.614  16.718   0.149
   73   1HD   PRO  10          2HD       PRO  10   2.804  17.085   1.369
   74   2HD   PRO  10          1HD       PRO  10   3.257  16.402  -0.259
   75    H    GLY  11           H        GLY  11   5.032  12.973   3.733
   76   1HA   GLY  11          2HA       GLY  11   5.244  13.263   6.198
   77   2HA   GLY  11          1HA       GLY  11   3.592  13.982   6.080
   78    HA   PRO  12           HA       PRO  12   3.154   9.539   6.803
   79   1HB   PRO  12          2HB       PRO  12   0.847  10.783   8.416
   80   2HB   PRO  12          1HB       PRO  12   1.792   9.290   8.808
   81   1HG   PRO  12          2HG       PRO  12   2.414  11.630  10.067
   82   2HG   PRO  12          1HG       PRO  12   3.765  10.640   9.363
   83   1HD   PRO  12          2HD       PRO  12   2.417  13.099   8.115
   84   2HD   PRO  12          1HD       PRO  12   4.188  12.679   8.256
   85    H    TRP  13           H        TRP  13   1.472   8.020   6.203
   86    HA   TRP  13           HA       TRP  13  -0.301   9.224   4.201
   87   1HB   TRP  13          2HB       TRP  13   0.755   6.331   4.202
   88   2HB   TRP  13          1HB       TRP  13  -0.187   7.111   2.989
   89    HD1  TRP  13           HD       TRP  13   3.316   6.623   4.118
   90    HE1  TRP  13           1HE      TRP  13   4.921   7.732   2.376
   91    HE3  TRP  13           3HE      TRP  13  -0.006   9.622   1.762
   92    HZ2  TRP  13           2HZ      TRP  13   4.769   9.680   0.410
   93    HZ3  TRP  13           3HZ      TRP  13   0.764  11.047  -0.069
   94    HH2  TRP  13           HH       TRP  13   3.124  11.098  -0.726
   95    H    GLY  14           H        GLY  14  -0.266   6.448   6.451
   96   1HA   GLY  14          2HA       GLY  14  -1.596   6.374   8.266
   97   2HA   GLY  14          1HA       GLY  14  -2.778   7.472   7.507
   98    H    PHE  15           H        PHE  15  -1.467   4.268   6.625
   99    HA   PHE  15           HA       PHE  15  -4.135   3.121   7.095
  100   1HB   PHE  15          2HB       PHE  15  -3.669   1.642   5.011
  101   2HB   PHE  15          1HB       PHE  15  -3.860   3.355   4.687
  102    HD1  PHE  15           1HD      PHE  15  -2.348   4.568   3.721
  103    HD2  PHE  15           2HD      PHE  15  -1.003   0.881   5.407
  104    HE1  PHE  15           1HE      PHE  15  -0.097   4.960   2.835
  105    HE2  PHE  15           2HE      PHE  15   1.237   1.345   4.604
  106    HZ   PHE  15           HZ       PHE  15   1.715   3.410   3.365
  107    H    ARG  16           H        ARG  16  -4.150   0.732   7.369
  108    HA   ARG  16           HA       ARG  16  -2.181   0.282   9.416
  109   1HB   ARG  16          2HB       ARG  16  -4.819   0.130   9.794
  110   2HB   ARG  16          1HB       ARG  16  -4.698  -1.426   8.953
  111   1HG   ARG  16          2HG       ARG  16  -4.662  -1.903  11.250
  112   2HG   ARG  16          1HG       ARG  16  -3.034  -2.237  10.609
  113   1HD   ARG  16          2HD       ARG  16  -2.800  -1.182  12.812
  114   2HD   ARG  16          1HD       ARG  16  -2.265   0.028  11.567
  115    HE   ARG  16           HE       ARG  16  -5.094   0.383  12.007
  116   1HH1  ARG  16          1HH1      ARG  16  -2.026   0.998  13.839
  117   2HH1  ARG  16          2HH1      ARG  16  -2.815   2.233  14.754
  118   1HH2  ARG  16          1HH2      ARG  16  -5.979   1.852  13.371
  119   2HH2  ARG  16          2HH2      ARG  16  -4.973   2.941  14.284
  120    H    LEU  17           H        LEU  17  -0.516  -1.187   8.900
  121    HA   LEU  17           HA       LEU  17  -1.044  -2.910   6.646
  122   1HB   LEU  17          2HB       LEU  17   1.525  -2.532   8.305
  123   2HB   LEU  17          1HB       LEU  17   1.343  -3.581   6.867
  124    HG   LEU  17           HG       LEU  17   2.414  -1.684   6.162
  125   1HD1  LEU  17          1HD1      LEU  17   1.007  -0.777   4.404
  126   2HD1  LEU  17          2HD1      LEU  17  -0.492  -1.205   5.328
  127   3HD1  LEU  17          3HD1      LEU  17   0.601  -2.506   4.724
  128   1HD2  LEU  17          1HD2      LEU  17   1.939   0.632   6.516
  129   2HD2  LEU  17          2HD2      LEU  17   1.988  -0.168   8.105
  130   3HD2  LEU  17          3HD2      LEU  17   0.389   0.289   7.373
  131    H    GLN  18           H        GLN  18  -1.081  -5.145   6.611
  132    HA   GLN  18           HA       GLN  18  -0.822  -6.554   9.143
  133   1HB   GLN  18          2HB       GLN  18  -3.144  -6.652   7.160
  134   2HB   GLN  18          1HB       GLN  18  -2.886  -7.923   8.381
  135   1HG   GLN  18          2HG       GLN  18  -3.490  -4.930   8.996
  136   2HG   GLN  18          1HG       GLN  18  -4.657  -6.280   8.943
  137   1HE2  GLN  18          1HE2      GLN  18  -2.947  -8.295  10.340
  138   2HE2  GLN  18          2HE2      GLN  18  -2.906  -7.739  11.986
  139    H    GLY  19           H        GLY  19  -0.921  -9.033   8.460
  140   1HA   GLY  19          2HA       GLY  19   0.192 -10.657   7.529
  141   2HA   GLY  19          1HA       GLY  19  -0.240  -9.893   5.970
  142    H    GLY  20           H        GLY  20   1.537 -10.402   4.787
  143   1HA   GLY  20          2HA       GLY  20   3.271  -8.875   4.148
  144   2HA   GLY  20          1HA       GLY  20   4.078  -9.227   5.707
  145    H    LYS  21           H        LYS  21   5.316  -9.377   3.243
  146    HA   LYS  21           HA       LYS  21   5.119 -11.887   2.085
  147   1HB   LYS  21          2HB       LYS  21   6.190  -9.380   1.446
  148   2HB   LYS  21          1HB       LYS  21   7.632 -10.418   1.508
  149   1HG   LYS  21          2HG       LYS  21   6.910 -10.544  -0.720
  150   2HG   LYS  21          1HG       LYS  21   6.260 -12.058  -0.019
  151   1HD   LYS  21          2HD       LYS  21   4.048 -10.662   0.380
  152   2HD   LYS  21          1HD       LYS  21   4.825  -9.394  -0.597
  153   1HE   LYS  21          2HE       LYS  21   3.301 -10.636  -2.023
  154   2HE   LYS  21          1HE       LYS  21   4.984 -11.009  -2.561
  155   1HZ   LYS  21          1HZ       LYS  21   4.833 -13.128  -1.623
  156   2HZ   LYS  21          2HZ       LYS  21   3.349 -12.884  -2.339
  157   3HZ   LYS  21          3HZ       LYS  21   3.478 -12.748  -0.661
  158    H    ASP  22           H        ASP  22   7.082 -10.922   4.802
  159    HA   ASP  22           HA       ASP  22   9.111 -12.787   4.583
  160   1HB   ASP  22          2HB       ASP  22   9.081 -10.807   6.055
  161   2HB   ASP  22          1HB       ASP  22   7.701 -11.478   6.977
  162    H    PHE  23           H        PHE  23   5.768 -13.143   5.671
  163    HA   PHE  23           HA       PHE  23   6.238 -15.873   6.567
  164   1HB   PHE  23          2HB       PHE  23   3.965 -13.834   6.702
  165   2HB   PHE  23          1HB       PHE  23   3.633 -15.579   6.936
  166    HD1  PHE  23           1HD      PHE  23   2.751 -15.198   8.993
  167    HD2  PHE  23           2HD      PHE  23   6.817 -14.141   8.299
  168    HE1  PHE  23           1HE      PHE  23   3.135 -15.075  11.400
  169    HE2  PHE  23           2HE      PHE  23   7.191 -14.024  10.680
  170    HZ   PHE  23           HZ       PHE  23   5.367 -14.504  12.258
  171    H    ASN  24           H        ASN  24   5.978 -14.549   3.623
  172    HA   ASN  24           HA       ASN  24   5.261 -15.050   1.693
  173   1HB   ASN  24          2HB       ASN  24   4.806 -17.885   2.759
  174   2HB   ASN  24          1HB       ASN  24   4.727 -17.417   1.020
  175   1HD2  ASN  24          1HD2      ASN  24   6.866 -18.678   3.323
  176   2HD2  ASN  24          2HD2      ASN  24   8.319 -18.291   2.444
  177    H    MET  25           H        MET  25   3.453 -13.731   3.317
  178    HA   MET  25           HA       MET  25   0.878 -14.638   2.353
  179   1HB   MET  25          2HB       MET  25   1.879 -13.428   4.653
  180   2HB   MET  25          1HB       MET  25   1.091 -12.052   3.864
  181   1HG   MET  25          2HG       MET  25  -1.080 -13.156   4.032
  182   2HG   MET  25          1HG       MET  25  -0.327 -14.757   4.292
  183   1HE   MET  25          1HE       MET  25   0.731 -14.989   7.841
  184   2HE   MET  25          2HE       MET  25   1.621 -14.871   6.279
  185   3HE   MET  25          3HE       MET  25   0.108 -15.826   6.381
  186    HA   PRO  26           HA       PRO  26   1.256 -11.230  -0.634
  187   1HB   PRO  26          2HB       PRO  26  -1.386 -10.087  -0.463
  188   2HB   PRO  26          1HB       PRO  26  -0.834 -11.390  -1.541
  189   1HG   PRO  26          2HG       PRO  26  -2.676 -11.654   0.721
  190   2HG   PRO  26          1HG       PRO  26  -2.120 -12.892  -0.457
  191   1HD   PRO  26          2HD       PRO  26  -1.058 -12.059   2.279
  192   2HD   PRO  26          1HD       PRO  26  -0.987 -13.740   1.613
  193    H    LEU  27           H        LEU  27   1.491  -8.780  -0.558
  194    HA   LEU  27           HA       LEU  27   1.896  -7.956   2.166
  195   1HB   LEU  27          2HB       LEU  27   3.044  -7.438  -0.351
  196   2HB   LEU  27          1HB       LEU  27   2.250  -5.906   0.061
  197    HG   LEU  27           HG       LEU  27   4.200  -7.532   1.811
  198   1HD1  LEU  27          1HD1      LEU  27   4.660  -4.922   0.227
  199   2HD1  LEU  27          2HD1      LEU  27   5.288  -6.559  -0.210
  200   3HD1  LEU  27          3HD1      LEU  27   5.870  -5.739   1.285
  201   1HD2  LEU  27          1HD2      LEU  27   4.361  -5.433   3.241
  202   2HD2  LEU  27          2HD2      LEU  27   2.706  -6.150   3.281
  203   3HD2  LEU  27          3HD2      LEU  27   3.041  -4.701   2.257
  204    H    THR  28           H        THR  28   0.104  -7.471   3.291
  205    HA   THR  28           HA       THR  28  -2.152  -6.455   1.730
  206    HB   THR  28           HB       THR  28  -3.662  -7.414   2.905
  207    HG1  THR  28           1HG      THR  28  -3.427  -8.304   4.873
  208   1HG2  THR  28          1HG2      THR  28  -1.304  -9.380   3.300
  209   2HG2  THR  28          2HG2      THR  28  -1.844  -8.839   1.669
  210   3HG2  THR  28          3HG2      THR  28  -2.989  -9.750   2.757
  211    H    ILE  29           H        ILE  29  -3.466  -4.891   2.421
  212    HA   ILE  29           HA       ILE  29  -2.597  -3.348   4.808
  213    HB   ILE  29           HB       ILE  29  -3.773  -2.183   2.309
  214   1HG1  ILE  29          2HG1      ILE  29  -0.959  -2.523   3.379
  215   2HG1  ILE  29          1HG1      ILE  29  -1.580  -2.818   1.742
  216   1HG2  ILE  29          1HG2      ILE  29  -2.781  -1.033   5.029
  217   2HG2  ILE  29          2HG2      ILE  29  -4.496  -1.050   4.429
  218   3HG2  ILE  29          3HG2      ILE  29  -3.284  -0.046   3.614
  219   1HD1  ILE  29          1HD1      ILE  29  -1.767  -0.411   1.283
  220   2HD1  ILE  29          2HD1      ILE  29  -0.113  -0.784   1.901
  221   3HD1  ILE  29          3HD1      ILE  29  -1.315  -0.007   2.991
  222    H    SER  30           H        SER  30  -4.251  -2.819   6.188
  223    HA   SER  30           HA       SER  30  -6.746  -4.321   5.750
  224   1HB   SER  30          2HB       SER  30  -5.725  -5.089   7.656
  225   2HB   SER  30          1HB       SER  30  -5.280  -3.471   8.243
  226    HG   SER  30           HG       SER  30  -7.938  -4.537   8.020
  227    H    ARG  31           H        ARG  31  -6.275  -1.330   7.696
  228    HA   ARG  31           HA       ARG  31  -8.489  -0.233   6.072
  229   1HB   ARG  31          2HB       ARG  31  -7.965   0.020   9.070
  230   2HB   ARG  31          1HB       ARG  31  -9.213   0.934   8.167
  231   1HG   ARG  31          2HG       ARG  31 -10.271  -1.242   7.457
  232   2HG   ARG  31          1HG       ARG  31  -9.148  -2.095   8.575
  233   1HD   ARG  31          2HD       ARG  31 -10.040  -0.711  10.495
  234   2HD   ARG  31          1HD       ARG  31 -11.179   0.114   9.347
  235    HE   ARG  31           HE       ARG  31 -11.607  -2.684   9.001
  236   1HH1  ARG  31          1HH1      ARG  31 -12.169  -0.170  11.479
  237   2HH1  ARG  31          2HH1      ARG  31 -13.415  -1.101  12.261
  238   1HH2  ARG  31          1HH2      ARG  31 -12.957  -3.931  10.182
  239   2HH2  ARG  31          2HH2      ARG  31 -13.836  -3.313  11.563
  240    H    ILE  32           H        ILE  32  -8.778   2.040   6.264
  241    HA   ILE  32           HA       ILE  32  -6.348   3.626   6.167
  242    HB   ILE  32           HB       ILE  32  -9.215   3.744   5.321
  243   1HG1  ILE  32          2HG1      ILE  32  -8.425   4.716   3.301
  244   2HG1  ILE  32          1HG1      ILE  32  -6.867   5.179   4.009
  245   1HG2  ILE  32          1HG2      ILE  32  -7.587   6.295   5.847
  246   2HG2  ILE  32          2HG2      ILE  32  -9.118   5.828   6.722
  247   3HG2  ILE  32          3HG2      ILE  32  -9.153   6.173   4.966
  248   1HD1  ILE  32          1HD1      ILE  32  -6.177   2.726   4.073
  249   2HD1  ILE  32          2HD1      ILE  32  -6.469   3.400   2.451
  250   3HD1  ILE  32          3HD1      ILE  32  -7.719   2.334   3.210
  251    H    THR  33           H        THR  33  -5.931   5.301   7.732
  252    HA   THR  33           HA       THR  33  -7.300   5.054  10.196
  253    HB   THR  33           HB       THR  33  -5.314   7.153   9.319
  254    HG1  THR  33           1HG      THR  33  -4.066   5.910  10.825
  255   1HG2  THR  33          1HG2      THR  33  -5.161   7.631  11.783
  256   2HG2  THR  33          2HG2      THR  33  -6.445   6.420  12.121
  257   3HG2  THR  33          3HG2      THR  33  -6.850   7.932  11.268
  258    HA   PRO  34           HA       PRO  34 -10.610   7.680   9.032
  259   1HB   PRO  34          2HB       PRO  34  -9.930   8.596  11.925
  260   2HB   PRO  34          1HB       PRO  34 -11.585   8.612  11.214
  261   1HG   PRO  34          2HG       PRO  34 -10.793   6.433  12.665
  262   2HG   PRO  34          1HG       PRO  34 -11.539   6.123  11.036
  263   1HD   PRO  34          2HD       PRO  34  -8.599   6.034  11.819
  264   2HD   PRO  34          1HD       PRO  34  -9.498   5.098  10.545
  265    H    GLY  35           H        GLY  35  -7.880   9.498  10.405
  266   1HA   GLY  35          2HA       GLY  35  -8.958  11.894   9.034
  267   2HA   GLY  35          1HA       GLY  35  -8.173  11.871  10.638
  268    H    SER  36           H        SER  36  -7.163  10.196   7.639
  269    HA   SER  36           HA       SER  36  -5.048  12.216   7.388
  270   1HB   SER  36          2HB       SER  36  -4.169  10.047   8.468
  271   2HB   SER  36          1HB       SER  36  -4.449   9.281   6.873
  272    HG   SER  36           HG       SER  36  -2.467  10.046   6.686
  273    H    LYS  37           H        LYS  37  -3.833  11.576   5.225
  274    HA   LYS  37           HA       LYS  37  -5.523  12.366   3.140
  275   1HB   LYS  37          2HB       LYS  37  -2.658  11.403   3.427
  276   2HB   LYS  37          1HB       LYS  37  -3.331  11.616   1.784
  277   1HG   LYS  37          2HG       LYS  37  -3.632  13.899   1.965
  278   2HG   LYS  37          1HG       LYS  37  -3.725  13.903   3.740
  279   1HD   LYS  37          2HD       LYS  37  -1.105  13.209   2.285
  280   2HD   LYS  37          1HD       LYS  37  -1.622  14.894   2.621
  281   1HE   LYS  37          2HE       LYS  37  -1.819  14.361   5.078
  282   2HE   LYS  37          1HE       LYS  37  -1.162  12.705   4.768
  283   1HZ   LYS  37          1HZ       LYS  37   0.452  14.435   5.482
  284   2HZ   LYS  37          2HZ       LYS  37   0.226  15.225   4.016
  285   3HZ   LYS  37          3HZ       LYS  37   0.853  13.635   4.026
  286    H    ALA  38           H        ALA  38  -4.333   9.208   4.124
  287    HA   ALA  38           HA       ALA  38  -5.108   7.524   2.171
  288   1HB   ALA  38          1HB       ALA  38  -5.529   7.140   5.191
  289   2HB   ALA  38          2HB       ALA  38  -3.917   7.151   4.400
  290   3HB   ALA  38          3HB       ALA  38  -5.075   5.899   3.941
  291    H    ALA  39           H        ALA  39  -7.329   9.189   4.404
  292    HA   ALA  39           HA       ALA  39  -9.488   7.558   3.449
  293   1HB   ALA  39          1HB       ALA  39  -9.206   8.352   5.893
  294   2HB   ALA  39          2HB       ALA  39 -10.780   8.877   5.193
  295   3HB   ALA  39          3HB       ALA  39  -9.397  10.032   5.323
  296    H    GLN  40           H        GLN  40  -8.104  10.596   2.561
  297    HA   GLN  40           HA       GLN  40 -10.545  11.903   1.976
  298   1HB   GLN  40          2HB       GLN  40  -7.630  12.519   1.278
  299   2HB   GLN  40          1HB       GLN  40  -8.985  13.616   0.917
  300   1HG   GLN  40          2HG       GLN  40  -9.529  13.675   3.427
  301   2HG   GLN  40          1HG       GLN  40  -8.027  12.721   3.706
  302   1HE2  GLN  40          1HE2      GLN  40  -9.331  15.897   3.182
  303   2HE2  GLN  40          2HE2      GLN  40  -7.865  16.708   2.712
  304    H    SER  41           H        SER  41  -8.106  10.314  -0.104
  305    HA   SER  41           HA       SER  41  -9.099  12.005  -2.209
  306   1HB   SER  41          2HB       SER  41  -6.998  11.594  -3.322
  307   2HB   SER  41          1HB       SER  41  -6.791  12.036  -1.602
  308    HG   SER  41           HG       SER  41  -5.492  10.337  -1.890
  309    H    GLN  42           H        GLN  42  -7.568   9.588  -3.760
  310    HA   GLN  42           HA       GLN  42 -10.047   8.477  -4.874
  311   1HB   GLN  42          2HB       GLN  42  -7.117   8.557  -5.809
  312   2HB   GLN  42          1HB       GLN  42  -8.426   7.748  -6.716
  313   1HG   GLN  42          2HG       GLN  42  -8.351  10.788  -6.075
  314   2HG   GLN  42          1HG       GLN  42  -7.764  10.028  -7.588
  315   1HE2  GLN  42          1HE2      GLN  42 -10.559  11.353  -6.056
  316   2HE2  GLN  42          2HE2      GLN  42 -11.734  10.706  -7.181
  317    H    LEU  43           H        LEU  43  -7.677   7.973  -2.626
  318    HA   LEU  43           HA       LEU  43  -6.858   5.338  -3.169
  319   1HB   LEU  43          2HB       LEU  43  -5.649   7.394  -2.108
  320   2HB   LEU  43          1HB       LEU  43  -6.573   7.048  -0.633
  321    HG   LEU  43           HG       LEU  43  -5.428   4.542  -1.246
  322   1HD1  LEU  43          1HD1      LEU  43  -3.434   6.765  -2.004
  323   2HD1  LEU  43          2HD1      LEU  43  -4.168   5.578  -3.129
  324   3HD1  LEU  43          3HD1      LEU  43  -3.034   5.016  -1.834
  325   1HD2  LEU  43          1HD2      LEU  43  -4.049   4.914   0.762
  326   2HD2  LEU  43          2HD2      LEU  43  -5.637   5.666   0.983
  327   3HD2  LEU  43          3HD2      LEU  43  -4.218   6.696   0.541
  328    H    SER  44           H        SER  44  -7.271   3.445  -2.122
  329    HA   SER  44           HA       SER  44  -7.545   3.848   0.593
  330   1HB   SER  44          2HB       SER  44  -9.189   2.166   1.273
  331   2HB   SER  44          1HB       SER  44  -9.910   3.573   0.441
  332    HG   SER  44           HG       SER  44  -9.467   0.977  -0.563
  333    H    GLN  45           H        GLN  45  -5.227   3.187   0.366
  334    HA   GLN  45           HA       GLN  45  -4.428   0.716  -0.272
  335   1HB   GLN  45          2HB       GLN  45  -3.790   2.785   1.892
  336   2HB   GLN  45          1HB       GLN  45  -2.785   1.328   1.689
  337   1HG   GLN  45          2HG       GLN  45  -2.308   1.883  -0.642
  338   2HG   GLN  45          1HG       GLN  45  -3.354   3.327  -0.602
  339   1HE2  GLN  45          2HE2      GLN  45  -0.417   1.952   0.680
  340   2HE2  GLN  45          1HE2      GLN  45   0.372   3.452   1.213
  341    H    GLY  46           H        GLY  46  -5.481  -1.127   0.237
  342   1HA   GLY  46          2HA       GLY  46  -5.819  -2.069   2.846
  343   2HA   GLY  46          1HA       GLY  46  -7.276  -1.168   2.368
  344    H    ASP  47           H        ASP  47  -4.997  -3.367   0.615
  345    HA   ASP  47           HA       ASP  47  -6.774  -5.470   0.552
  346   1HB   ASP  47          2HB       ASP  47  -7.539  -3.601  -1.335
  347   2HB   ASP  47          1HB       ASP  47  -6.344  -4.484  -2.316
  348    H    LEU  48           H        LEU  48  -5.532  -6.818  -1.739
  349    HA   LEU  48           HA       LEU  48  -2.926  -7.216  -0.628
  350   1HB   LEU  48          2HB       LEU  48  -4.172  -8.437  -3.128
  351   2HB   LEU  48          1HB       LEU  48  -2.624  -8.876  -2.358
  352    HG   LEU  48           HG       LEU  48  -3.978 -10.561  -1.629
  353   1HD1  LEU  48          1HD1      LEU  48  -4.658 -10.308   0.741
  354   2HD1  LEU  48          2HD1      LEU  48  -4.535  -8.512   0.633
  355   3HD1  LEU  48          3HD1      LEU  48  -3.053  -9.539   0.410
  356   1HD2  LEU  48          1HD2      LEU  48  -6.131  -9.346  -2.558
  357   2HD2  LEU  48          2HD2      LEU  48  -6.186  -8.598  -0.890
  358   3HD2  LEU  48          3HD2      LEU  48  -6.343 -10.398  -1.062
  359    H    VAL  49           H        VAL  49  -1.261  -5.826  -1.136
  360    HA   VAL  49           HA       VAL  49  -1.530  -4.178  -3.435
  361    HB   VAL  49           HB       VAL  49   0.675  -4.323  -1.364
  362   1HG1  VAL  49          1HG1      VAL  49   0.961  -1.919  -2.059
  363   2HG1  VAL  49          2HG1      VAL  49  -0.313  -2.123  -3.316
  364   3HG1  VAL  49          3HG1      VAL  49   1.257  -3.013  -3.470
  365   1HG2  VAL  49          1HG2      VAL  49  -1.974  -2.731  -1.415
  366   2HG2  VAL  49          2HG2      VAL  49  -0.588  -2.416  -0.317
  367   3HG2  VAL  49          3HG2      VAL  49  -1.474  -3.970  -0.199
  368    H    VAL  50           H        VAL  50  -0.340  -4.366  -5.352
  369    HA   VAL  50           HA       VAL  50   1.262  -6.783  -5.627
  370    HB   VAL  50           HB       VAL  50   0.511  -4.955  -7.928
  371   1HG1  VAL  50          1HG1      VAL  50   2.132  -6.860  -8.265
  372   2HG1  VAL  50          2HG1      VAL  50   0.572  -7.137  -9.121
  373   3HG1  VAL  50          3HG1      VAL  50   0.917  -8.001  -7.577
  374   1HG2  VAL  50          1HG2      VAL  50  -1.611  -5.167  -6.881
  375   2HG2  VAL  50          2HG2      VAL  50  -1.346  -6.929  -6.502
  376   3HG2  VAL  50          3HG2      VAL  50  -1.545  -6.357  -8.214
  377    H    ALA  51           H        ALA  51   1.331  -3.326  -6.450
  378    HA   ALA  51           HA       ALA  51   4.257  -3.475  -6.592
  379   1HB   ALA  51          1HB       ALA  51   4.219  -2.025  -8.621
  380   2HB   ALA  51          2HB       ALA  51   2.426  -1.997  -8.579
  381   3HB   ALA  51          3HB       ALA  51   3.293  -3.541  -8.930
  382    H    ILE  52           H        ILE  52   5.410  -1.691  -6.159
  383    HA   ILE  52           HA       ILE  52   4.021   0.555  -4.933
  384    HB   ILE  52           HB       ILE  52   4.947  -1.445  -3.511
  385   1HG1  ILE  52          2HG1      ILE  52   5.399   1.454  -2.591
  386   2HG1  ILE  52          1HG1      ILE  52   3.788   0.684  -2.786
  387   1HG2  ILE  52          1HG2      ILE  52   7.277  -1.334  -4.380
  388   2HG2  ILE  52          2HG2      ILE  52   7.194  -1.105  -2.599
  389   3HG2  ILE  52          3HG2      ILE  52   7.457   0.320  -3.678
  390   1HD1  ILE  52          1HD1      ILE  52   6.011  -0.236  -0.854
  391   2HD1  ILE  52          2HD1      ILE  52   4.514  -1.178  -1.206
  392   3HD1  ILE  52          3HD1      ILE  52   4.393   0.437  -0.436
  393    H    ASP  53           H        ASP  53   4.797   2.444  -5.629
  394    HA   ASP  53           HA       ASP  53   5.835   3.880  -6.811
  395   1HB   ASP  53          2HB       ASP  53   7.808   3.023  -5.335
  396   2HB   ASP  53          1HB       ASP  53   8.432   2.260  -6.836
  397    H    GLY  54           H        GLY  54   4.775   1.219  -7.895
  398   1HA   GLY  54          2HA       GLY  54   4.130   0.635  -9.993
  399   2HA   GLY  54          1HA       GLY  54   5.413   1.666 -10.705
  400    H    VAL  55           H        VAL  55   6.534  -0.398  -8.119
  401    HA   VAL  55           HA       VAL  55   7.527  -2.289 -10.124
  402    HB   VAL  55           HB       VAL  55   8.919  -1.267  -7.631
  403   1HG1  VAL  55          1HG1      VAL  55   9.518  -3.643  -8.176
  404   2HG1  VAL  55          2HG1      VAL  55  10.868  -2.556  -8.647
  405   3HG1  VAL  55          3HG1      VAL  55   9.755  -3.204  -9.904
  406   1HG2  VAL  55          1HG2      VAL  55   8.879   0.507  -9.367
  407   2HG2  VAL  55          2HG2      VAL  55   9.371  -0.680 -10.632
  408   3HG2  VAL  55          3HG2      VAL  55  10.513  -0.237  -9.313
  409    H    ASN  56           H        ASN  56   7.223  -4.438  -9.652
  410    HA   ASN  56           HA       ASN  56   5.281  -5.007  -7.757
  411   1HB   ASN  56          2HB       ASN  56   5.534  -7.355  -8.527
  412   2HB   ASN  56          1HB       ASN  56   5.408  -6.167  -9.879
  413   1HD2  ASN  56          1HD2      ASN  56   7.258  -8.816  -8.749
  414   2HD2  ASN  56          2HD2      ASN  56   8.590  -8.542  -9.834
  415    H    THR  57           H        THR  57   5.227  -5.751  -5.714
  416    HA   THR  57           HA       THR  57   7.705  -6.008  -4.332
  417    HB   THR  57           HB       THR  57   6.219  -6.110  -2.315
  418    HG1  THR  57           1HG      THR  57   4.286  -6.681  -3.439
  419   1HG2  THR  57          1HG2      THR  57   5.824  -3.674  -2.410
  420   2HG2  THR  57          2HG2      THR  57   5.877  -3.685  -4.207
  421   3HG2  THR  57          3HG2      THR  57   7.371  -4.017  -3.264
  422    H    ASP  58           H        ASP  58   8.137  -7.945  -5.649
  423    HA   ASP  58           HA       ASP  58   6.895 -10.381  -4.896
  424   1HB   ASP  58          2HB       ASP  58   9.631  -9.709  -6.127
  425   2HB   ASP  58          1HB       ASP  58   9.130 -11.397  -5.770
  426    H    THR  59           H        THR  59  10.115  -9.074  -3.872
  427    HA   THR  59           HA       THR  59   9.951 -10.970  -1.650
  428    HB   THR  59           HB       THR  59  11.877 -11.139  -3.192
  429    HG1  THR  59           1HG      THR  59  12.443 -10.362  -0.546
  430   1HG2  THR  59          1HG2      THR  59  12.743  -8.426  -1.961
  431   2HG2  THR  59          2HG2      THR  59  12.187  -8.670  -3.659
  432   3HG2  THR  59          3HG2      THR  59  13.685  -9.474  -3.078
  433    H    MET  60           H        MET  60   9.508  -7.737  -2.243
  434    HA   MET  60           HA       MET  60  10.541  -6.457  -0.043
  435   1HB   MET  60          2HB       MET  60   8.236  -6.131  -1.978
  436   2HB   MET  60          1HB       MET  60   8.502  -4.882  -0.713
  437   1HG   MET  60          2HG       MET  60   9.582  -3.967  -2.532
  438   2HG   MET  60          1HG       MET  60  10.939  -4.715  -1.646
  439   1HE   MET  60          1HE       MET  60  11.594  -4.697  -5.583
  440   2HE   MET  60          2HE       MET  60  12.027  -3.979  -3.996
  441   3HE   MET  60          3HE       MET  60  10.433  -3.613  -4.754
  442    H    THR  61           H        THR  61   9.954  -6.214   2.034
  443    HA   THR  61           HA       THR  61   7.780  -7.912   2.934
  444    HB   THR  61           HB       THR  61   8.993  -7.983   5.033
  445    HG1  THR  61           1HG      THR  61  10.957  -6.952   5.161
  446   1HG2  THR  61          1HG2      THR  61   9.623  -9.531   3.147
  447   2HG2  THR  61          2HG2      THR  61  10.999  -9.142   4.237
  448   3HG2  THR  61          3HG2      THR  61  10.888  -8.353   2.622
  449    H    HIS  62           H        HIS  62   7.097  -7.229   5.291
  450    HA   HIS  62           HA       HIS  62   5.726  -4.836   5.376
  451   1HB   HIS  62          2HB       HIS  62   5.379  -7.015   6.623
  452   2HB   HIS  62          1HB       HIS  62   6.779  -6.623   7.646
  453    HD1  HIS  62           1HD      HIS  62   6.335  -4.677   9.461
  454    HD2  HIS  62           2HD      HIS  62   2.964  -5.817   7.243
  455    HE1  HIS  62           1HE      HIS  62   4.266  -3.968  10.767
  456    H    LEU  63           H        LEU  63   9.115  -5.336   5.834
  457    HA   LEU  63           HA       LEU  63   9.364  -2.743   7.191
  458   1HB   LEU  63          2HB       LEU  63  10.906  -4.527   7.926
  459   2HB   LEU  63          1HB       LEU  63  11.421  -4.805   6.238
  460    HG   LEU  63           HG       LEU  63  12.369  -2.477   6.145
  461   1HD1  LEU  63          1HD1      LEU  63  11.008  -1.311   7.874
  462   2HD1  LEU  63          2HD1      LEU  63  12.746  -1.255   8.331
  463   3HD1  LEU  63          3HD1      LEU  63  11.647  -2.421   9.148
  464   1HD2  LEU  63          1HD2      LEU  63  13.781  -4.435   6.662
  465   2HD2  LEU  63          2HD2      LEU  63  13.402  -4.250   8.422
  466   3HD2  LEU  63          3HD2      LEU  63  14.345  -2.968   7.561
  467    H    GLU  64           H        GLU  64  10.306  -4.374   4.126
  468    HA   GLU  64           HA       GLU  64  11.484  -2.119   3.091
  469   1HB   GLU  64          2HB       GLU  64  11.158  -4.805   2.390
  470   2HB   GLU  64          1HB       GLU  64  10.334  -3.953   1.034
  471   1HG   GLU  64          2HG       GLU  64  12.371  -2.856   0.376
  472   2HG   GLU  64          1HG       GLU  64  13.039  -2.955   2.051
  473    H    ALA  65           H        ALA  65   8.124  -3.250   2.534
  474    HA   ALA  65           HA       ALA  65   7.530  -1.331   0.600
  475   1HB   ALA  65          1HB       ALA  65   6.332  -3.462   1.023
  476   2HB   ALA  65          2HB       ALA  65   5.176  -2.064   1.087
  477   3HB   ALA  65          3HB       ALA  65   5.763  -2.843   2.611
  478    H    GLN  66           H        GLN  66   7.246  -1.287   4.116
  479    HA   GLN  66           HA       GLN  66   6.073   1.187   4.515
  480   1HB   GLN  66          2HB       GLN  66   7.877  -0.707   6.009
  481   2HB   GLN  66          1HB       GLN  66   7.630   0.910   6.708
  482   1HG   GLN  66          2HG       GLN  66   6.128  -1.127   7.412
  483   2HG   GLN  66          1HG       GLN  66   5.412   0.512   7.247
  484   1HE2  GLN  66          1HE2      GLN  66   3.942   0.955   5.609
  485   2HE2  GLN  66          2HE2      GLN  66   3.180  -0.345   4.723
  486    H    ASN  67           H        ASN  67   9.520   0.278   4.205
  487    HA   ASN  67           HA       ASN  67  10.533   2.878   4.367
  488   1HB   ASN  67          2HB       ASN  67  11.614   0.283   3.124
  489   2HB   ASN  67          1HB       ASN  67  12.594   1.782   3.218
  490   1HD2  ASN  67          1HD2      ASN  67  13.501  -0.490   4.429
  491   2HD2  ASN  67          2HD2      ASN  67  13.390  -0.334   6.168
  492    H    LYS  68           H        LYS  68   9.310   1.090   1.558
  493    HA   LYS  68           HA       LYS  68  10.106   3.054  -0.293
  494   1HB   LYS  68          2HB       LYS  68   7.774   1.111  -0.566
  495   2HB   LYS  68          1HB       LYS  68   8.556   2.057  -1.865
  496   1HG   LYS  68          2HG       LYS  68   9.670  -0.379  -0.379
  497   2HG   LYS  68          1HG       LYS  68   9.260  -0.181  -2.082
  498   1HD   LYS  68          2HD       LYS  68  11.163   1.430  -2.390
  499   2HD   LYS  68          1HD       LYS  68  11.577   1.242  -0.652
  500   1HE   LYS  68          2HE       LYS  68  11.841  -1.244  -0.998
  501   2HE   LYS  68          1HE       LYS  68  11.564  -1.014  -2.768
  502   1HZ   LYS  68          1HZ       LYS  68  13.564   0.272  -2.902
  503   2HZ   LYS  68          2HZ       LYS  68  13.883  -1.156  -2.056
  504   3HZ   LYS  68          3HZ       LYS  68  13.745   0.313  -1.217
  505    H    ILE  69           H        ILE  69   6.754   2.487   1.096
  506    HA   ILE  69           HA       ILE  69   5.550   4.734   0.500
  507    HB   ILE  69           HB       ILE  69   5.704   2.939   2.909
  508   1HG1  ILE  69          2HG1      ILE  69   3.405   3.448   0.975
  509   2HG1  ILE  69          1HG1      ILE  69   4.610   2.339   0.435
  510   1HG2  ILE  69          1HG2      ILE  69   4.832   5.225   3.663
  511   2HG2  ILE  69          2HG2      ILE  69   3.702   3.858   3.852
  512   3HG2  ILE  69          3HG2      ILE  69   3.489   5.004   2.469
  513   1HD1  ILE  69          1HD1      ILE  69   4.202   0.746   2.254
  514   2HD1  ILE  69          2HD1      ILE  69   2.613   1.221   1.560
  515   3HD1  ILE  69          3HD1      ILE  69   3.160   1.911   3.132
  516    H    LYS  70           H        LYS  70   7.722   4.516   3.383
  517    HA   LYS  70           HA       LYS  70   7.330   7.287   3.873
  518   1HB   LYS  70          2HB       LYS  70   8.756   5.009   5.173
  519   2HB   LYS  70          1HB       LYS  70   9.407   6.615   5.528
  520   1HG   LYS  70          2HG       LYS  70   7.841   5.934   7.225
  521   2HG   LYS  70          1HG       LYS  70   7.326   7.439   6.409
  522   1HD   LYS  70          2HD       LYS  70   5.641   6.292   5.110
  523   2HD   LYS  70          1HD       LYS  70   6.213   4.680   5.636
  524   1HE   LYS  70          2HE       LYS  70   4.806   6.810   7.398
  525   2HE   LYS  70          1HE       LYS  70   4.112   5.274   6.733
  526   1HZ   LYS  70          1HZ       LYS  70   5.956   5.669   8.971
  527   2HZ   LYS  70          2HZ       LYS  70   6.250   4.333   8.011
  528   3HZ   LYS  70          3HZ       LYS  70   4.761   4.493   8.743
  529    H    SER  71           H        SER  71   9.125   6.144   1.375
  530    HA   SER  71           HA       SER  71  11.054   8.343   1.759
  531   1HB   SER  71          2HB       SER  71  12.544   7.266   0.131
  532   2HB   SER  71          1HB       SER  71  12.359   6.354   1.653
  533    HG   SER  71           HG       SER  71  10.977   4.958   0.645
  534    H    ALA  72           H        ALA  72   8.158   7.671   0.413
  535    HA   ALA  72           HA       ALA  72   8.699   9.243  -1.996
  536   1HB   ALA  72          1HB       ALA  72   7.488   7.053  -2.200
  537   2HB   ALA  72          2HB       ALA  72   6.441   8.431  -2.697
  538   3HB   ALA  72          3HB       ALA  72   6.240   7.650  -1.066
  539    H    SER  73           H        SER  73   6.992  10.902  -2.465
  540    HA   SER  73           HA       SER  73   5.362  11.897  -0.415
  541   1HB   SER  73          2HB       SER  73   6.537  14.244  -0.284
  542   2HB   SER  73          1HB       SER  73   6.994  12.908   0.793
  543    HG   SER  73           HG       SER  73   8.410  13.153  -1.621
  544    H    TYR  74           H        TYR  74   7.229  12.961  -3.319
  545    HA   TYR  74           HA       TYR  74   5.237  14.730  -4.177
  546   1HB   TYR  74          2HB       TYR  74   7.268  13.187  -5.886
  547   2HB   TYR  74          1HB       TYR  74   6.428  14.703  -6.340
  548    HD1  TYR  74           1HD      TYR  74   7.021  16.019  -3.447
  549    HD2  TYR  74           2HD      TYR  74   9.278  14.077  -6.481
  550    HE1  TYR  74           1HE      TYR  74   8.992  17.268  -2.778
  551    HE2  TYR  74           2HE      TYR  74  11.255  15.349  -5.834
  552    HH   TYR  74           HH       TYR  74  12.071  16.995  -4.538
  553    H    ASN  75           H        ASN  75   5.997  11.349  -4.878
  554    HA   ASN  75           HA       ASN  75   3.216  10.882  -5.433
  555   1HB   ASN  75          2HB       ASN  75   3.879   9.505  -7.551
  556   2HB   ASN  75          1HB       ASN  75   3.715  11.292  -7.680
  557   1HD2  ASN  75          1HD2      ASN  75   6.137   8.651  -7.226
  558   2HD2  ASN  75          2HD2      ASN  75   7.215   9.352  -8.400
  559    H    LEU  76           H        LEU  76   2.608   9.242  -4.281
  560    HA   LEU  76           HA       LEU  76   4.423   6.961  -3.929
  561   1HB   LEU  76          2HB       LEU  76   3.660   8.015  -1.823
  562   2HB   LEU  76          1HB       LEU  76   1.977   7.935  -2.354
  563    HG   LEU  76           HG       LEU  76   2.010   5.446  -2.244
  564   1HD1  LEU  76          1HD1      LEU  76   4.913   5.809  -1.263
  565   2HD1  LEU  76          2HD1      LEU  76   4.378   4.926  -2.759
  566   3HD1  LEU  76          3HD1      LEU  76   3.957   4.288  -1.131
  567   1HD2  LEU  76          1HD2      LEU  76   2.100   5.217   0.192
  568   2HD2  LEU  76          2HD2      LEU  76   1.432   6.843  -0.200
  569   3HD2  LEU  76          3HD2      LEU  76   3.142   6.668   0.346
  570    H    SER  77           H        SER  77   3.997   5.576  -5.651
  571    HA   SER  77           HA       SER  77   1.214   5.473  -6.603
  572   1HB   SER  77          2HB       SER  77   3.025   6.012  -8.262
  573   2HB   SER  77          1HB       SER  77   3.669   4.355  -8.014
  574    HG   SER  77           HG       SER  77   2.254   4.158  -9.662
  575    H    LEU  78           H        LEU  78  -0.034   3.897  -5.811
  576    HA   LEU  78           HA       LEU  78   1.246   1.325  -5.193
  577   1HB   LEU  78          2HB       LEU  78  -1.468   2.261  -4.180
  578   2HB   LEU  78          1HB       LEU  78  -0.461   0.908  -3.604
  579    HG   LEU  78           HG       LEU  78  -0.396   2.496  -1.931
  580   1HD1  LEU  78          1HD1      LEU  78   1.887   3.126  -1.610
  581   2HD1  LEU  78          2HD1      LEU  78   2.227   3.139  -3.377
  582   3HD1  LEU  78          3HD1      LEU  78   1.872   1.579  -2.546
  583   1HD2  LEU  78          1HD2      LEU  78  -0.124   4.858  -2.035
  584   2HD2  LEU  78          2HD2      LEU  78  -1.393   4.387  -3.226
  585   3HD2  LEU  78          3HD2      LEU  78   0.257   4.820  -3.796
  586    H    THR  79           H        THR  79   0.470  -0.517  -6.168
  587    HA   THR  79           HA       THR  79  -2.103  -0.348  -7.566
  588    HB   THR  79           HB       THR  79   0.334  -2.006  -8.371
  589    HG1  THR  79           1HG      THR  79   0.626  -0.621  -9.892
  590   1HG2  THR  79          1HG2      THR  79  -2.479  -1.626  -9.594
  591   2HG2  THR  79          2HG2      THR  79  -1.829  -3.142  -8.850
  592   3HG2  THR  79          3HG2      THR  79  -1.114  -2.523 -10.378
  593    H    LEU  80           H        LEU  80  -3.507  -1.659  -6.366
  594    HA   LEU  80           HA       LEU  80  -2.489  -4.186  -5.310
  595   1HB   LEU  80          2HB       LEU  80  -3.776  -3.933  -3.348
  596   2HB   LEU  80          1HB       LEU  80  -2.654  -2.525  -3.520
  597    HG   LEU  80           HG       LEU  80  -5.611  -2.624  -4.128
  598   1HD1  LEU  80          1HD1      LEU  80  -4.866  -2.843  -1.725
  599   2HD1  LEU  80          2HD1      LEU  80  -5.863  -1.320  -2.025
  600   3HD1  LEU  80          3HD1      LEU  80  -4.036  -1.227  -1.873
  601   1HD2  LEU  80          1HD2      LEU  80  -3.372  -0.556  -4.277
  602   2HD2  LEU  80          2HD2      LEU  80  -5.045   0.082  -3.857
  603   3HD2  LEU  80          3HD2      LEU  80  -4.746  -0.766  -5.455
  604    H    GLN  81           H        GLN  81  -4.293  -5.759  -4.956
  605    HA   GLN  81           HA       GLN  81  -5.803  -5.775  -7.420
  606   1HB   GLN  81          2HB       GLN  81  -5.673  -7.873  -5.237
  607   2HB   GLN  81          1HB       GLN  81  -6.401  -8.075  -6.860
  608   1HG   GLN  81          2HG       GLN  81  -3.414  -7.518  -6.425
  609   2HG   GLN  81          1HG       GLN  81  -4.139  -9.155  -6.419
  610   1HE2  GLN  81          1HE2      GLN  81  -2.184  -8.783  -8.173
  611   2HE2  GLN  81          2HE2      GLN  81  -2.810  -8.694  -9.792
  612    H    LYS  82           H        LYS  82  -8.070  -5.891  -7.599
  613    HA   LYS  82           HA       LYS  82  -9.576  -5.749  -5.091
  614   1HB   LYS  82          2HB       LYS  82  -9.906  -4.440  -7.644
  615   2HB   LYS  82          1HB       LYS  82 -11.261  -5.580  -7.464
  616   1HG   LYS  82          2HG       LYS  82 -11.982  -3.500  -6.486
  617   2HG   LYS  82          1HG       LYS  82 -11.670  -4.649  -5.145
  618   1HD   LYS  82          2HD       LYS  82  -9.202  -3.521  -5.275
  619   2HD   LYS  82          1HD       LYS  82 -10.103  -2.168  -6.002
  620   1HE   LYS  82          2HE       LYS  82 -10.636  -3.493  -3.245
  621   2HE   LYS  82          1HE       LYS  82  -9.782  -1.923  -3.507
  622   1HZ   LYS  82          1HZ       LYS  82 -12.015  -1.548  -2.888
  623   2HZ   LYS  82          2HZ       LYS  82 -12.644  -2.517  -4.104
  624   3HZ   LYS  82          3HZ       LYS  82 -11.871  -1.054  -4.485
  625    H    SER  83           H        SER  83  -8.484  -7.797  -7.376
  626    HA   SER  83           HA       SER  83  -8.505  -9.966  -7.568
  627   1HB   SER  83          2HB       SER  83 -10.216 -10.087  -5.057
  628   2HB   SER  83          1HB       SER  83  -9.431 -11.494  -5.843
  629    HG   SER  83           HG       SER  83  -8.385  -9.544  -4.281
  630    H    LYS  84           H        LYS  84  -9.537 -11.880  -8.293
  631    HA   LYS  84           HA       LYS  84 -11.981 -11.221  -9.694
  632   1HB   LYS  84          2HB       LYS  84 -10.120 -13.617  -9.906
  633   2HB   LYS  84          1HB       LYS  84 -11.625 -13.383 -10.854
  634   1HG   LYS  84          2HG       LYS  84 -10.674 -11.219 -11.770
  635   2HG   LYS  84          1HG       LYS  84  -9.170 -11.534 -10.859
  636   1HD   LYS  84          2HD       LYS  84  -8.725 -12.218 -13.095
  637   2HD   LYS  84          1HD       LYS  84  -8.884 -13.699 -12.116
  638   1HE   LYS  84          2HE       LYS  84  -9.972 -14.052 -14.267
  639   2HE   LYS  84          1HE       LYS  84 -11.267 -13.988 -13.015
  640   1HZ   LYS  84          1HZ       LYS  84 -11.739 -11.703 -13.699
  641   2HZ   LYS  84          2HZ       LYS  84 -11.772 -12.727 -15.005
  642   3HZ   LYS  84          3HZ       LYS  84 -10.443 -11.725 -14.798
  643    H    ARG  85           H        ARG  85 -13.628 -11.248  -8.273
  644    HA   ARG  85           HA       ARG  85 -14.581 -13.916  -7.725
  645   1HB   ARG  85          2HB       ARG  85 -14.190 -11.692  -5.701
  646   2HB   ARG  85          1HB       ARG  85 -15.741 -12.574  -5.640
  647   1HG   ARG  85          2HG       ARG  85 -14.551 -14.745  -5.520
  648   2HG   ARG  85          1HG       ARG  85 -12.978 -13.896  -5.418
  649   1HD   ARG  85          2HD       ARG  85 -13.552 -12.911  -3.240
  650   2HD   ARG  85          1HD       ARG  85 -15.287 -13.418  -3.429
  651    HE   ARG  85           HE       ARG  85 -13.415 -15.679  -3.662
  652   1HH1  ARG  85          1HH1      ARG  85 -15.290 -13.825  -1.234
  653   2HH1  ARG  85          2HH1      ARG  85 -15.891 -15.307  -0.515
  654   1HH2  ARG  85          1HH2      ARG  85 -13.710 -17.423  -2.260
  655   2HH2  ARG  85          2HH2      ARG  85 -14.736 -17.273  -0.900
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1  -7.163  -8.720 -12.518
    2   2H    MET   1          2HT       MET   1  -7.071  -9.098 -10.912
    3   3H    MET   1          3HT       MET   1  -5.999  -7.985 -11.546
    4    HA   MET   1           HA       MET   1  -8.037  -6.638 -12.226
    5   1HB   MET   1          2HB       MET   1  -9.557  -8.614 -11.762
    6   2HB   MET   1          1HB       MET   1  -9.290  -8.355 -10.018
    7   1HG   MET   1          2HG       MET   1 -10.209  -5.968 -10.371
    8   2HG   MET   1          1HG       MET   1 -10.639  -6.452 -12.029
    9   1HE   MET   1          1HE       MET   1 -11.703  -9.432 -11.855
   10   2HE   MET   1          2HE       MET   1 -12.395  -8.020 -12.727
   11   3HE   MET   1          3HE       MET   1 -13.443  -9.026 -11.684
   12    H    ALA   2           H        ALA   2  -6.691  -4.935 -11.560
   13    HA   ALA   2           HA       ALA   2  -6.845  -4.336  -8.712
   14   1HB   ALA   2          1HB       ALA   2  -4.665  -5.385  -9.057
   15   2HB   ALA   2          2HB       ALA   2  -4.367  -3.619  -8.941
   16   3HB   ALA   2          3HB       ALA   2  -4.375  -4.418 -10.556
   17    H    TYR   3           H        TYR   3  -5.766  -2.068  -8.400
   18    HA   TYR   3           HA       TYR   3  -6.487  -0.300 -10.556
   19   1HB   TYR   3          2HB       TYR   3  -7.815   1.192  -9.385
   20   2HB   TYR   3          1HB       TYR   3  -8.547  -0.415  -9.126
   21    HD1  TYR   3           1HD      TYR   3  -7.767   2.538  -7.735
   22    HD2  TYR   3           2HD      TYR   3  -7.417  -1.591  -6.766
   23    HE1  TYR   3           1HE      TYR   3  -7.847   3.092  -5.339
   24    HE2  TYR   3           2HE      TYR   3  -7.563  -1.064  -4.416
   25    HH   TYR   3           HH       TYR   3  -7.614   0.599  -2.844
   26    H    SER   4           H        SER   4  -5.550   1.847 -10.340
   27    HA   SER   4           HA       SER   4  -3.191   1.844  -8.610
   28   1HB   SER   4          2HB       SER   4  -2.093   3.256 -10.406
   29   2HB   SER   4          1HB       SER   4  -2.408   1.555 -10.852
   30    HG   SER   4           HG       SER   4  -3.713   3.871 -11.773
   31    H    VAL   5           H        VAL   5  -2.721   3.715  -7.492
   32    HA   VAL   5           HA       VAL   5  -4.047   6.130  -8.228
   33    HB   VAL   5           HB       VAL   5  -5.830   5.513  -6.991
   34   1HG1  VAL   5          1HG1      VAL   5  -5.740   4.493  -4.740
   35   2HG1  VAL   5          2HG1      VAL   5  -3.959   4.203  -4.954
   36   3HG1  VAL   5          3HG1      VAL   5  -5.163   3.420  -6.060
   37   1HG2  VAL   5          1HG2      VAL   5  -5.862   6.913  -4.994
   38   2HG2  VAL   5          2HG2      VAL   5  -4.944   7.757  -6.298
   39   3HG2  VAL   5          3HG2      VAL   5  -4.070   6.976  -4.927
   40    H    THR   6           H        THR   6  -2.965   7.865  -7.791
   41    HA   THR   6           HA       THR   6  -0.397   7.601  -6.420
   42    HB   THR   6           HB       THR   6  -1.453   9.734  -8.317
   43    HG1  THR   6           1HG      THR   6  -0.387   8.729  -9.822
   44   1HG2  THR   6          1HG2      THR   6   0.383  10.587  -6.809
   45   2HG2  THR   6          2HG2      THR   6   1.014  10.344  -8.467
   46   3HG2  THR   6          3HG2      THR   6   1.387   9.134  -7.192
   47    H    LEU   7           H        LEU   7  -0.088   8.681  -4.462
   48    HA   LEU   7           HA       LEU   7  -2.214  10.554  -3.688
   49   1HB   LEU   7          2HB       LEU   7  -2.101   8.288  -2.580
   50   2HB   LEU   7          1HB       LEU   7  -0.447   8.665  -2.040
   51    HG   LEU   7           HG       LEU   7  -1.343  10.536  -0.626
   52   1HD1  LEU   7          1HD1      LEU   7  -3.844  10.695  -0.254
   53   2HD1  LEU   7          2HD1      LEU   7  -4.101   9.554  -1.623
   54   3HD1  LEU   7          3HD1      LEU   7  -3.386  11.182  -1.924
   55   1HD2  LEU   7          1HD2      LEU   7  -2.461   9.027   1.049
   56   2HD2  LEU   7          2HD2      LEU   7  -1.098   8.159   0.232
   57   3HD2  LEU   7          3HD2      LEU   7  -2.794   7.846  -0.276
   58    H    THR   8           H        THR   8  -1.612  12.536  -2.773
   59    HA   THR   8           HA       THR   8   1.225  13.185  -2.990
   60    HB   THR   8           HB       THR   8  -1.160  15.028  -2.649
   61    HG1  THR   8           1HG      THR   8  -0.717  15.459  -4.827
   62   1HG2  THR   8          1HG2      THR   8   1.051  16.040  -1.953
   63   2HG2  THR   8          2HG2      THR   8   0.506  16.739  -3.505
   64   3HG2  THR   8          3HG2      THR   8   1.794  15.481  -3.500
   65    H    GLY   9           H        GLY   9   2.434  13.426  -1.095
   66   1HA   GLY   9          2HA       GLY   9   1.494  14.866   1.029
   67   2HA   GLY   9          1HA       GLY   9   1.156  13.117   1.371
   68    HA   PRO  10           HA       PRO  10   5.380  13.053   2.543
   69   1HB   PRO  10          2HB       PRO  10   5.563  13.990   5.102
   70   2HB   PRO  10          1HB       PRO  10   5.569  15.124   3.700
   71   1HG   PRO  10          2HG       PRO  10   3.167  14.357   5.445
   72   2HG   PRO  10          1HG       PRO  10   3.739  16.022   5.014
   73   1HD   PRO  10          2HD       PRO  10   1.740  14.659   3.569
   74   2HD   PRO  10          1HD       PRO  10   2.880  15.844   2.803
   75    H    GLY  11           H        GLY  11   6.204  11.708   4.301
   76   1HA   GLY  11          2HA       GLY  11   5.610   9.341   4.325
   77   2HA   GLY  11          1HA       GLY  11   6.206  10.119   5.806
   78    HA   PRO  12           HA       PRO  12   2.597   8.424   7.652
   79   1HB   PRO  12          2HB       PRO  12   1.286  11.138   8.168
   80   2HB   PRO  12          1HB       PRO  12   1.477   9.736   9.289
   81   1HG   PRO  12          2HG       PRO  12   3.169  11.869   9.465
   82   2HG   PRO  12          1HG       PRO  12   3.881  10.193   9.480
   83   1HD   PRO  12          2HD       PRO  12   3.635  12.098   7.064
   84   2HD   PRO  12          1HD       PRO  12   5.080  11.158   7.641
   85    H    TRP  13           H        TRP  13   2.032   7.648   5.414
   86    HA   TRP  13           HA       TRP  13   0.134   9.087   3.961
   87   1HB   TRP  13          2HB       TRP  13   1.074   6.228   3.492
   88   2HB   TRP  13          1HB       TRP  13   0.144   7.162   2.362
   89    HD1  TRP  13           HD       TRP  13   3.581   6.707   3.738
   90    HE1  TRP  13           1HE      TRP  13   5.241   7.781   2.066
   91    HE3  TRP  13           3HE      TRP  13   0.361   9.520   1.034
   92    HZ2  TRP  13           2HZ      TRP  13   5.233   9.837   0.172
   93    HZ3  TRP  13           3HZ      TRP  13   1.232  10.879  -0.798
   94    HH2  TRP  13           HH       TRP  13   3.662  11.029  -1.229
   95    H    GLY  14           H        GLY  14  -0.388   6.687   6.458
   96   1HA   GLY  14          2HA       GLY  14  -2.074   7.534   7.760
   97   2HA   GLY  14          1HA       GLY  14  -3.115   7.764   6.328
   98    H    PHE  15           H        PHE  15  -1.763   4.829   5.946
   99    HA   PHE  15           HA       PHE  15  -4.044   3.425   7.174
  100   1HB   PHE  15          2HB       PHE  15  -3.482   1.649   5.315
  101   2HB   PHE  15          1HB       PHE  15  -4.068   3.187   4.718
  102    HD1  PHE  15           1HD      PHE  15  -2.857   4.637   3.519
  103    HD2  PHE  15           2HD      PHE  15  -0.866   1.326   5.331
  104    HE1  PHE  15           1HE      PHE  15  -0.783   5.299   2.443
  105    HE2  PHE  15           2HE      PHE  15   1.236   2.042   4.321
  106    HZ   PHE  15           HZ       PHE  15   1.297   4.065   2.914
  107    H    ARG  16           H        ARG  16  -3.564   1.008   7.423
  108    HA   ARG  16           HA       ARG  16  -1.287   0.943   9.228
  109   1HB   ARG  16          2HB       ARG  16  -4.062  -0.369   9.365
  110   2HB   ARG  16          1HB       ARG  16  -2.724  -0.858  10.439
  111   1HG   ARG  16          2HG       ARG  16  -3.923   1.974  10.244
  112   2HG   ARG  16          1HG       ARG  16  -4.338   0.750  11.477
  113   1HD   ARG  16          2HD       ARG  16  -2.055   0.761  12.397
  114   2HD   ARG  16          1HD       ARG  16  -1.462   1.876  11.118
  115    HE   ARG  16           HE       ARG  16  -3.268   2.554  13.401
  116   1HH1  ARG  16          1HH1      ARG  16  -1.835   3.775  10.314
  117   2HH1  ARG  16          2HH1      ARG  16  -1.977   5.431  10.890
  118   1HH2  ARG  16          1HH2      ARG  16  -3.168   4.754  14.055
  119   2HH2  ARG  16          2HH2      ARG  16  -2.735   5.968  12.910
  120    H    LEU  17           H        LEU  17   0.227  -0.608   8.902
  121    HA   LEU  17           HA       LEU  17  -0.199  -2.203   6.525
  122   1HB   LEU  17          2HB       LEU  17   2.382  -1.512   8.013
  123   2HB   LEU  17          1HB       LEU  17   2.253  -2.449   6.501
  124    HG   LEU  17           HG       LEU  17   1.053  -0.378   5.489
  125   1HD1  LEU  17          1HD1      LEU  17   1.996   1.812   6.491
  126   2HD1  LEU  17          2HD1      LEU  17   2.372   0.842   7.977
  127   3HD1  LEU  17          3HD1      LEU  17   0.659   1.017   7.404
  128   1HD2  LEU  17          1HD2      LEU  17   3.294  -1.204   4.804
  129   2HD2  LEU  17          2HD2      LEU  17   4.058  -0.273   6.152
  130   3HD2  LEU  17          3HD2      LEU  17   3.207   0.598   4.813
  131    H    GLN  18           H        GLN  18  -0.230  -4.480   6.590
  132    HA   GLN  18           HA       GLN  18   0.894  -5.825   8.850
  133   1HB   GLN  18          2HB       GLN  18  -2.120  -6.012   8.288
  134   2HB   GLN  18          1HB       GLN  18  -1.185  -7.177   9.281
  135   1HG   GLN  18          2HG       GLN  18  -0.528  -5.131  10.763
  136   2HG   GLN  18          1HG       GLN  18  -1.840  -4.247   9.913
  137   1HE2  GLN  18          1HE2      GLN  18  -1.023  -6.761  12.226
  138   2HE2  GLN  18          2HE2      GLN  18  -2.651  -6.950  12.848
  139    H    GLY  19           H        GLY  19   1.727  -7.779   8.222
  140   1HA   GLY  19          2HA       GLY  19   1.681  -9.720   7.099
  141   2HA   GLY  19          1HA       GLY  19   0.533  -9.067   5.893
  142    H    GLY  20           H        GLY  20   2.609 -10.665   5.118
  143   1HA   GLY  20          2HA       GLY  20   3.610  -9.500   2.994
  144   2HA   GLY  20          1HA       GLY  20   4.842  -9.117   4.263
  145    H    LYS  21           H        LYS  21   5.586 -10.688   2.109
  146    HA   LYS  21           HA       LYS  21   5.031 -13.298   2.239
  147   1HB   LYS  21          2HB       LYS  21   6.485 -11.769   0.543
  148   2HB   LYS  21          1HB       LYS  21   7.831 -12.580   1.365
  149   1HG   LYS  21          2HG       LYS  21   7.365 -14.078  -0.400
  150   2HG   LYS  21          1HG       LYS  21   6.374 -14.786   0.909
  151   1HD   LYS  21          2HD       LYS  21   4.533 -13.018  -0.102
  152   2HD   LYS  21          1HD       LYS  21   5.578 -13.189  -1.543
  153   1HE   LYS  21          2HE       LYS  21   5.216 -15.839  -1.068
  154   2HE   LYS  21          1HE       LYS  21   3.795 -15.253  -0.116
  155   1HZ   LYS  21          1HZ       LYS  21   4.365 -15.135  -2.980
  156   2HZ   LYS  21          2HZ       LYS  21   3.441 -13.865  -2.341
  157   3HZ   LYS  21          3HZ       LYS  21   2.894 -15.445  -2.208
  158    H    ASP  22           H        ASP  22   7.500 -11.701   4.137
  159    HA   ASP  22           HA       ASP  22   8.858 -13.939   5.027
  160   1HB   ASP  22          2HB       ASP  22   9.447 -11.437   5.082
  161   2HB   ASP  22          1HB       ASP  22   8.281 -11.277   6.447
  162    H    PHE  23           H        PHE  23   5.632 -12.980   5.811
  163    HA   PHE  23           HA       PHE  23   5.609 -14.530   8.273
  164   1HB   PHE  23          2HB       PHE  23   3.486 -12.843   6.788
  165   2HB   PHE  23          1HB       PHE  23   3.174 -13.805   8.271
  166    HD1  PHE  23           1HD      PHE  23   4.241 -13.203  10.374
  167    HD2  PHE  23           2HD      PHE  23   4.660 -10.782   6.915
  168    HE1  PHE  23           1HE      PHE  23   4.958 -11.329  11.779
  169    HE2  PHE  23           2HE      PHE  23   5.385  -8.894   8.320
  170    HZ   PHE  23           HZ       PHE  23   5.538  -9.176  10.750
  171    H    ASN  24           H        ASN  24   4.119 -14.353   5.066
  172    HA   ASN  24           HA       ASN  24   3.935 -16.860   4.327
  173   1HB   ASN  24          2HB       ASN  24   2.727 -17.547   6.429
  174   2HB   ASN  24          1HB       ASN  24   1.561 -16.212   6.204
  175   1HD2  ASN  24          1HD2      ASN  24   2.796 -19.140   4.381
  176   2HD2  ASN  24          2HD2      ASN  24   1.206 -19.614   3.839
  177    H    MET  25           H        MET  25   2.401 -13.852   4.769
  178    HA   MET  25           HA       MET  25   0.205 -14.329   3.030
  179   1HB   MET  25          2HB       MET  25   0.368 -13.412   5.363
  180   2HB   MET  25          1HB       MET  25   1.199 -11.949   4.699
  181   1HG   MET  25          2HG       MET  25  -0.874 -11.176   3.752
  182   2HG   MET  25          1HG       MET  25  -1.686 -12.757   4.052
  183   1HE   MET  25          1HE       MET  25  -3.664 -10.338   6.230
  184   2HE   MET  25          2HE       MET  25  -3.627 -11.521   4.885
  185   3HE   MET  25          3HE       MET  25  -2.831  -9.920   4.694
  186    HA   PRO  26           HA       PRO  26   1.949 -11.582  -0.127
  187   1HB   PRO  26          2HB       PRO  26  -0.407 -10.174  -0.918
  188   2HB   PRO  26          1HB       PRO  26   0.210 -11.684  -1.658
  189   1HG   PRO  26          2HG       PRO  26  -2.191 -11.369   0.009
  190   2HG   PRO  26          1HG       PRO  26  -1.609 -12.819  -0.867
  191   1HD   PRO  26          2HD       PRO  26  -1.324 -11.797   1.903
  192   2HD   PRO  26          1HD       PRO  26  -1.122 -13.560   1.534
  193    H    LEU  27           H        LEU  27   2.306  -9.172  -0.483
  194    HA   LEU  27           HA       LEU  27   2.273  -7.812   1.995
  195   1HB   LEU  27          2HB       LEU  27   3.577  -7.653  -0.465
  196   2HB   LEU  27          1HB       LEU  27   2.609  -6.166  -0.475
  197    HG   LEU  27           HG       LEU  27   4.510  -7.125   1.763
  198   1HD1  LEU  27          1HD1      LEU  27   4.973  -4.913  -0.337
  199   2HD1  LEU  27          2HD1      LEU  27   5.624  -6.594  -0.441
  200   3HD1  LEU  27          3HD1      LEU  27   6.139  -5.521   0.908
  201   1HD2  LEU  27          1HD2      LEU  27   4.346  -4.816   2.688
  202   2HD2  LEU  27          2HD2      LEU  27   2.734  -5.595   2.669
  203   3HD2  LEU  27          3HD2      LEU  27   3.147  -4.367   1.414
  204    H    THR  28           H        THR  28   0.347  -7.343   2.896
  205    HA   THR  28           HA       THR  28  -1.448  -5.757   1.241
  206    HB   THR  28           HB       THR  28  -3.231  -6.825   1.400
  207    HG1  THR  28           1HG      THR  28  -4.047  -7.767   3.159
  208   1HG2  THR  28          1HG2      THR  28  -1.542  -9.147   2.470
  209   2HG2  THR  28          2HG2      THR  28  -1.631  -8.635   0.735
  210   3HG2  THR  28          3HG2      THR  28  -3.108  -9.237   1.571
  211    H    ILE  29           H        ILE  29  -3.039  -4.582   2.344
  212    HA   ILE  29           HA       ILE  29  -1.848  -3.133   4.653
  213    HB   ILE  29           HB       ILE  29  -3.443  -2.146   2.323
  214   1HG1  ILE  29          2HG1      ILE  29  -0.810  -2.724   2.170
  215   2HG1  ILE  29          1HG1      ILE  29  -1.584  -1.365   1.355
  216   1HG2  ILE  29          1HG2      ILE  29  -2.383  -0.748   4.892
  217   2HG2  ILE  29          2HG2      ILE  29  -4.103  -0.907   4.376
  218   3HG2  ILE  29          3HG2      ILE  29  -2.995   0.125   3.443
  219   1HD1  ILE  29          1HD1      ILE  29  -0.837   0.193   3.169
  220   2HD1  ILE  29          2HD1      ILE  29   0.555  -0.731   2.499
  221   3HD1  ILE  29          3HD1      ILE  29  -0.162  -1.206   4.091
  222    H    SER  30           H        SER  30  -3.316  -2.584   6.308
  223    HA   SER  30           HA       SER  30  -5.576  -4.397   6.423
  224   1HB   SER  30          2HB       SER  30  -4.016  -4.461   8.274
  225   2HB   SER  30          1HB       SER  30  -4.189  -2.711   8.557
  226    HG   SER  30           HG       SER  30  -5.915  -4.828   9.116
  227    H    ARG  31           H        ARG  31  -5.389  -1.082   7.863
  228    HA   ARG  31           HA       ARG  31  -7.893  -0.516   6.441
  229   1HB   ARG  31          2HB       ARG  31  -7.271  -0.271   9.424
  230   2HB   ARG  31          1HB       ARG  31  -8.656   0.556   8.667
  231   1HG   ARG  31          2HG       ARG  31  -8.246  -2.485   8.729
  232   2HG   ARG  31          1HG       ARG  31  -9.271  -1.541   9.844
  233   1HD   ARG  31          2HD       ARG  31  -9.690  -1.779   6.802
  234   2HD   ARG  31          1HD       ARG  31 -10.631  -2.652   8.070
  235    HE   ARG  31           HE       ARG  31 -11.183  -0.266   8.978
  236   1HH1  ARG  31          1HH1      ARG  31 -11.252  -1.216   5.524
  237   2HH1  ARG  31          2HH1      ARG  31 -11.907   0.307   5.028
  238   1HH2  ARG  31          1HH2      ARG  31 -12.246   1.659   8.253
  239   2HH2  ARG  31          2HH2      ARG  31 -12.810   1.711   6.617
  240    H    ILE  32           H        ILE  32  -8.557   1.650   6.476
  241    HA   ILE  32           HA       ILE  32  -6.417   3.581   6.240
  242    HB   ILE  32           HB       ILE  32  -9.314   3.298   5.493
  243   1HG1  ILE  32          2HG1      ILE  32  -8.590   4.303   3.367
  244   2HG1  ILE  32          1HG1      ILE  32  -6.925   4.475   3.932
  245   1HG2  ILE  32          1HG2      ILE  32  -7.855   5.992   5.685
  246   2HG2  ILE  32          2HG2      ILE  32  -9.345   5.515   6.616
  247   3HG2  ILE  32          3HG2      ILE  32  -9.420   5.684   4.839
  248   1HD1  ILE  32          1HD1      ILE  32  -6.811   1.889   4.077
  249   2HD1  ILE  32          2HD1      ILE  32  -7.066   2.569   2.452
  250   3HD1  ILE  32          3HD1      ILE  32  -8.480   1.876   3.345
  251    H    THR  33           H        THR  33  -6.183   5.356   7.708
  252    HA   THR  33           HA       THR  33  -7.777   5.218  10.096
  253    HB   THR  33           HB       THR  33  -5.702   7.283   9.375
  254    HG1  THR  33           1HG      THR  33  -4.648   5.500   9.656
  255   1HG2  THR  33          1HG2      THR  33  -5.803   7.692  11.855
  256   2HG2  THR  33          2HG2      THR  33  -7.163   6.513  12.002
  257   3HG2  THR  33          3HG2      THR  33  -7.405   8.047  11.118
  258    HA   PRO  34           HA       PRO  34 -10.707   8.179   8.406
  259   1HB   PRO  34          2HB       PRO  34 -10.497   8.749  11.452
  260   2HB   PRO  34          1HB       PRO  34 -11.970   8.981  10.439
  261   1HG   PRO  34          2HG       PRO  34 -11.683   6.651  11.829
  262   2HG   PRO  34          1HG       PRO  34 -12.103   6.519  10.064
  263   1HD   PRO  34          2HD       PRO  34  -9.357   6.194  11.402
  264   2HD   PRO  34          1HD       PRO  34 -10.063   5.275  10.003
  265    H    GLY  35           H        GLY  35 -10.820  10.282   7.772
  266   1HA   GLY  35          2HA       GLY  35 -10.425  12.448   7.675
  267   2HA   GLY  35          1HA       GLY  35  -9.456  12.334   9.175
  268    H    SER  36           H        SER  36  -7.801  10.264   7.629
  269    HA   SER  36           HA       SER  36  -5.846  12.230   6.905
  270   1HB   SER  36          2HB       SER  36  -5.503  10.146   8.371
  271   2HB   SER  36          1HB       SER  36  -5.510   9.191   6.860
  272    HG   SER  36           HG       SER  36  -3.770  11.282   7.679
  273    H    LYS  37           H        LYS  37  -4.256  11.269   5.119
  274    HA   LYS  37           HA       LYS  37  -5.273  11.949   2.651
  275   1HB   LYS  37          2HB       LYS  37  -2.881  10.196   3.435
  276   2HB   LYS  37          1HB       LYS  37  -3.073  10.960   1.834
  277   1HG   LYS  37          2HG       LYS  37  -2.599  13.139   2.712
  278   2HG   LYS  37          1HG       LYS  37  -3.038  12.677   4.376
  279   1HD   LYS  37          2HD       LYS  37  -1.115  11.006   4.346
  280   2HD   LYS  37          1HD       LYS  37  -0.503  11.823   2.871
  281   1HE   LYS  37          2HE       LYS  37  -0.243  13.966   4.160
  282   2HE   LYS  37          1HE       LYS  37  -1.129  13.231   5.558
  283   1HZ   LYS  37          1HZ       LYS  37   0.598  11.596   5.754
  284   2HZ   LYS  37          2HZ       LYS  37   1.162  13.146   6.025
  285   3HZ   LYS  37          3HZ       LYS  37   1.563  12.323   4.592
  286    H    ALA  38           H        ALA  38  -4.530   8.833   4.051
  287    HA   ALA  38           HA       ALA  38  -5.272   7.028   2.176
  288   1HB   ALA  38          1HB       ALA  38  -5.662   6.857   5.218
  289   2HB   ALA  38          2HB       ALA  38  -4.071   6.729   4.388
  290   3HB   ALA  38          3HB       ALA  38  -5.309   5.494   4.074
  291    H    ALA  39           H        ALA  39  -7.481   8.909   4.231
  292    HA   ALA  39           HA       ALA  39  -9.671   7.205   3.420
  293   1HB   ALA  39          1HB       ALA  39  -9.480   7.991   5.820
  294   2HB   ALA  39          2HB       ALA  39 -10.970   8.631   5.047
  295   3HB   ALA  39          3HB       ALA  39  -9.527   9.693   5.256
  296    H    GLN  40           H        GLN  40  -8.542  10.555   3.088
  297    HA   GLN  40           HA       GLN  40 -10.755  11.693   1.981
  298   1HB   GLN  40          2HB       GLN  40  -7.769  12.274   1.805
  299   2HB   GLN  40          1HB       GLN  40  -8.931  13.289   0.925
  300   1HG   GLN  40          2HG       GLN  40 -10.163  13.741   3.101
  301   2HG   GLN  40          1HG       GLN  40  -8.842  12.879   3.978
  302   1HE2  GLN  40          1HE2      GLN  40  -8.959  15.216   4.907
  303   2HE2  GLN  40          2HE2      GLN  40  -7.949  16.424   4.156
  304    H    SER  41           H        SER  41  -8.086  10.146   0.226
  305    HA   SER  41           HA       SER  41  -8.915  11.526  -2.150
  306   1HB   SER  41          2HB       SER  41  -6.598  11.335  -1.229
  307   2HB   SER  41          1HB       SER  41  -6.565   9.618  -1.724
  308    HG   SER  41           HG       SER  41  -6.358  11.950  -3.148
  309    H    GLN  42           H        GLN  42  -7.743   9.470  -3.970
  310    HA   GLN  42           HA       GLN  42 -10.127   7.888  -4.444
  311   1HB   GLN  42          2HB       GLN  42  -7.433   8.297  -5.832
  312   2HB   GLN  42          1HB       GLN  42  -8.591   7.072  -6.402
  313   1HG   GLN  42          2HG       GLN  42  -9.388  10.049  -6.128
  314   2HG   GLN  42          1HG       GLN  42  -8.537   9.392  -7.558
  315   1HE2  GLN  42          1HE2      GLN  42 -11.672   9.639  -6.002
  316   2HE2  GLN  42          2HE2      GLN  42 -12.521   8.805  -7.281
  317    H    LEU  43           H        LEU  43  -7.251   7.745  -2.702
  318    HA   LEU  43           HA       LEU  43  -6.521   5.076  -2.930
  319   1HB   LEU  43          2HB       LEU  43  -5.284   7.182  -1.915
  320   2HB   LEU  43          1HB       LEU  43  -6.137   6.757  -0.415
  321    HG   LEU  43           HG       LEU  43  -5.070   4.292  -1.174
  322   1HD1  LEU  43          1HD1      LEU  43  -2.995   6.401  -2.020
  323   2HD1  LEU  43          2HD1      LEU  43  -3.955   5.380  -3.146
  324   3HD1  LEU  43          3HD1      LEU  43  -2.787   4.611  -2.009
  325   1HD2  LEU  43          1HD2      LEU  43  -3.146   4.902   0.500
  326   2HD2  LEU  43          2HD2      LEU  43  -4.828   5.023   1.109
  327   3HD2  LEU  43          3HD2      LEU  43  -3.937   6.506   0.637
  328    H    SER  44           H        SER  44  -7.516   3.247  -2.246
  329    HA   SER  44           HA       SER  44  -8.153   3.357   0.609
  330   1HB   SER  44          2HB       SER  44  -9.616   1.559  -1.411
  331   2HB   SER  44          1HB       SER  44  -9.692   1.408   0.379
  332    HG   SER  44           HG       SER  44 -10.664   3.429  -1.300
  333    H    GLN  45           H        GLN  45  -5.675   3.115   0.478
  334    HA   GLN  45           HA       GLN  45  -4.652   0.691  -0.517
  335   1HB   GLN  45          2HB       GLN  45  -3.305   2.722  -0.433
  336   2HB   GLN  45          1HB       GLN  45  -3.733   2.953   1.319
  337   1HG   GLN  45          2HG       GLN  45  -2.278   1.508   2.120
  338   2HG   GLN  45          1HG       GLN  45  -2.538   0.403   0.746
  339   1HE2  GLN  45          2HE2      GLN  45  -1.152   3.796   0.800
  340   2HE2  GLN  45          1HE2      GLN  45   0.493   3.319   0.650
  341    H    GLY  46           H        GLY  46  -5.487  -1.053   0.320
  342   1HA   GLY  46          2HA       GLY  46  -5.411  -1.966   2.952
  343   2HA   GLY  46          1HA       GLY  46  -6.955  -1.070   2.668
  344    H    ASP  47           H        ASP  47  -4.943  -2.990   0.464
  345    HA   ASP  47           HA       ASP  47  -6.713  -5.212   0.518
  346   1HB   ASP  47          2HB       ASP  47  -7.490  -3.374  -1.321
  347   2HB   ASP  47          1HB       ASP  47  -6.154  -4.045  -2.289
  348    H    LEU  48           H        LEU  48  -5.488  -6.607  -1.671
  349    HA   LEU  48           HA       LEU  48  -2.857  -7.017  -0.672
  350   1HB   LEU  48          2HB       LEU  48  -4.816  -8.625  -1.107
  351   2HB   LEU  48          1HB       LEU  48  -4.645  -8.262  -2.842
  352    HG   LEU  48           HG       LEU  48  -2.525  -9.643  -1.052
  353   1HD1  LEU  48          1HD1      LEU  48  -4.527 -10.694  -3.126
  354   2HD1  LEU  48          2HD1      LEU  48  -4.558 -10.947  -1.335
  355   3HD1  LEU  48          3HD1      LEU  48  -3.218 -11.675  -2.311
  356   1HD2  LEU  48          1HD2      LEU  48  -1.532 -10.150  -3.431
  357   2HD2  LEU  48          2HD2      LEU  48  -1.379  -8.454  -2.796
  358   3HD2  LEU  48          3HD2      LEU  48  -2.659  -8.833  -4.005
  359    H    VAL  49           H        VAL  49  -1.141  -5.897  -1.504
  360    HA   VAL  49           HA       VAL  49  -1.623  -4.105  -3.626
  361    HB   VAL  49           HB       VAL  49   0.788  -4.616  -1.852
  362   1HG1  VAL  49          1HG1      VAL  49   1.197  -2.181  -2.285
  363   2HG1  VAL  49          2HG1      VAL  49  -0.166  -2.152  -3.472
  364   3HG1  VAL  49          3HG1      VAL  49   1.314  -3.142  -3.795
  365   1HG2  VAL  49          1HG2      VAL  49  -1.796  -2.992  -1.398
  366   2HG2  VAL  49          2HG2      VAL  49  -0.260  -2.718  -0.480
  367   3HG2  VAL  49          3HG2      VAL  49  -1.100  -4.282  -0.359
  368    H    VAL  50           H        VAL  50  -0.374  -4.045  -5.599
  369    HA   VAL  50           HA       VAL  50   1.046  -6.503  -6.267
  370    HB   VAL  50           HB       VAL  50   0.288  -4.310  -8.219
  371   1HG1  VAL  50          1HG1      VAL  50   2.022  -6.032  -8.881
  372   2HG1  VAL  50          2HG1      VAL  50   0.481  -6.223  -9.788
  373   3HG1  VAL  50          3HG1      VAL  50   0.859  -7.340  -8.430
  374   1HG2  VAL  50          1HG2      VAL  50  -1.804  -4.850  -7.218
  375   2HG2  VAL  50          2HG2      VAL  50  -1.446  -6.632  -7.203
  376   3HG2  VAL  50          3HG2      VAL  50  -1.691  -5.753  -8.766
  377    H    ALA  51           H        ALA  51   1.285  -3.031  -6.941
  378    HA   ALA  51           HA       ALA  51   4.202  -3.219  -6.758
  379   1HB   ALA  51          1HB       ALA  51   4.360  -1.766  -8.786
  380   2HB   ALA  51          2HB       ALA  51   2.560  -1.733  -8.896
  381   3HB   ALA  51          3HB       ALA  51   3.445  -3.272  -9.151
  382    H    ILE  52           H        ILE  52   5.359  -1.456  -6.267
  383    HA   ILE  52           HA       ILE  52   3.986   0.827  -5.082
  384    HB   ILE  52           HB       ILE  52   5.022  -0.960  -3.632
  385   1HG1  ILE  52          2HG1      ILE  52   4.265   1.277  -2.808
  386   2HG1  ILE  52          1HG1      ILE  52   5.580   0.517  -1.887
  387   1HG2  ILE  52          1HG2      ILE  52   7.141  -1.298  -4.792
  388   2HG2  ILE  52          2HG2      ILE  52   7.444  -0.726  -3.091
  389   3HG2  ILE  52          3HG2      ILE  52   7.613   0.413  -4.478
  390   1HD1  ILE  52          1HD1      ILE  52   5.885   2.898  -3.823
  391   2HD1  ILE  52          2HD1      ILE  52   7.264   2.040  -3.041
  392   3HD1  ILE  52          3HD1      ILE  52   6.058   2.887  -2.029
  393    H    ASP  53           H        ASP  53   4.480   2.643  -6.086
  394    HA   ASP  53           HA       ASP  53   5.207   4.008  -7.582
  395   1HB   ASP  53          2HB       ASP  53   6.986   3.962  -5.709
  396   2HB   ASP  53          1HB       ASP  53   8.045   3.118  -6.891
  397    H    GLY  54           H        GLY  54   4.769   1.230  -8.572
  398   1HA   GLY  54          2HA       GLY  54   4.667   0.446 -10.681
  399   2HA   GLY  54          1HA       GLY  54   5.973   1.552 -11.200
  400    H    VAL  55           H        VAL  55   6.724  -0.201  -8.288
  401    HA   VAL  55           HA       VAL  55   8.172  -2.202  -9.858
  402    HB   VAL  55           HB       VAL  55   8.860  -0.994  -7.154
  403   1HG1  VAL  55          1HG1      VAL  55   9.628  -3.369  -7.376
  404   2HG1  VAL  55          2HG1      VAL  55  11.022  -2.250  -7.531
  405   3HG1  VAL  55          3HG1      VAL  55  10.323  -3.007  -9.004
  406   1HG2  VAL  55          1HG2      VAL  55   9.230   0.680  -8.958
  407   2HG2  VAL  55          2HG2      VAL  55  10.083  -0.556  -9.958
  408   3HG2  VAL  55          3HG2      VAL  55  10.803   0.007  -8.407
  409    H    ASN  56           H        ASN  56   7.630  -4.275  -9.392
  410    HA   ASN  56           HA       ASN  56   5.345  -4.779  -7.917
  411   1HB   ASN  56          2HB       ASN  56   5.748  -7.122  -8.552
  412   2HB   ASN  56          1HB       ASN  56   6.179  -6.052  -9.917
  413   1HD2  ASN  56          1HD2      ASN  56   8.480  -5.839 -10.505
  414   2HD2  ASN  56          2HD2      ASN  56   9.704  -6.763  -9.673
  415    H    THR  57           H        THR  57   5.251  -6.807  -6.364
  416    HA   THR  57           HA       THR  57   7.248  -6.404  -4.270
  417    HB   THR  57           HB       THR  57   5.468  -6.933  -2.630
  418    HG1  THR  57           1HG      THR  57   3.744  -6.284  -4.743
  419   1HG2  THR  57          1HG2      THR  57   4.429  -4.691  -2.712
  420   2HG2  THR  57          2HG2      THR  57   4.909  -4.473  -4.432
  421   3HG2  THR  57          3HG2      THR  57   6.171  -4.571  -3.159
  422    H    ASP  58           H        ASP  58   7.803  -8.304  -6.178
  423    HA   ASP  58           HA       ASP  58   7.036 -10.836  -5.245
  424   1HB   ASP  58          2HB       ASP  58   9.155  -9.735  -7.083
  425   2HB   ASP  58          1HB       ASP  58   9.540 -11.329  -6.359
  426    H    THR  59           H        THR  59  10.041  -9.027  -4.520
  427    HA   THR  59           HA       THR  59  10.517 -10.981  -2.400
  428    HB   THR  59           HB       THR  59  12.317 -10.741  -3.968
  429    HG1  THR  59           1HG      THR  59  13.097  -9.410  -1.638
  430   1HG2  THR  59          1HG2      THR  59  12.438  -7.768  -3.109
  431   2HG2  THR  59          2HG2      THR  59  11.991  -8.389  -4.737
  432   3HG2  THR  59          3HG2      THR  59  13.647  -8.640  -4.111
  433    H    MET  60           H        MET  60   9.821  -7.601  -2.822
  434    HA   MET  60           HA       MET  60  10.353  -6.431  -0.548
  435   1HB   MET  60          2HB       MET  60   7.992  -6.495  -2.434
  436   2HB   MET  60          1HB       MET  60   8.040  -5.266  -1.127
  437   1HG   MET  60          2HG       MET  60   8.882  -4.126  -2.996
  438   2HG   MET  60          1HG       MET  60  10.327  -4.532  -2.025
  439   1HE   MET  60          1HE       MET  60  11.704  -4.409  -5.607
  440   2HE   MET  60          2HE       MET  60  11.909  -3.925  -3.888
  441   3HE   MET  60          3HE       MET  60  10.461  -3.380  -4.824
  442    H    THR  61           H        THR  61   9.919  -6.510   1.498
  443    HA   THR  61           HA       THR  61   7.902  -8.340   2.530
  444    HB   THR  61           HB       THR  61   9.319  -8.263   4.538
  445    HG1  THR  61           1HG      THR  61  11.476  -7.316   3.899
  446   1HG2  THR  61          1HG2      THR  61   9.713  -9.849   2.536
  447   2HG2  THR  61          2HG2      THR  61  11.177  -9.516   3.528
  448   3HG2  THR  61          3HG2      THR  61  10.952  -8.687   1.946
  449    H    HIS  62           H        HIS  62   7.089  -7.589   4.767
  450    HA   HIS  62           HA       HIS  62   5.751  -5.253   4.910
  451   1HB   HIS  62          2HB       HIS  62   5.436  -7.075   6.478
  452   2HB   HIS  62          1HB       HIS  62   7.118  -6.941   7.062
  453    HD1  HIS  62           1HD      HIS  62   7.368  -5.630   9.237
  454    HD2  HIS  62           2HD      HIS  62   3.814  -4.638   7.227
  455    HE1  HIS  62           1HE      HIS  62   6.045  -4.078  10.724
  456    H    LEU  63           H        LEU  63   9.085  -5.756   6.123
  457    HA   LEU  63           HA       LEU  63   9.503  -3.176   7.037
  458   1HB   LEU  63          2HB       LEU  63  10.903  -5.156   7.593
  459   2HB   LEU  63          1HB       LEU  63  11.480  -5.219   5.902
  460    HG   LEU  63           HG       LEU  63  12.444  -2.875   6.236
  461   1HD1  LEU  63          1HD1      LEU  63  11.088  -2.106   8.189
  462   2HD1  LEU  63          2HD1      LEU  63  12.834  -2.134   8.622
  463   3HD1  LEU  63          3HD1      LEU  63  11.749  -3.452   9.193
  464   1HD2  LEU  63          1HD2      LEU  63  13.801  -4.927   6.302
  465   2HD2  LEU  63          2HD2      LEU  63  13.454  -5.122   8.069
  466   3HD2  LEU  63          3HD2      LEU  63  14.423  -3.706   7.482
  467    H    GLU  64           H        GLU  64  10.435  -4.620   3.840
  468    HA   GLU  64           HA       GLU  64  11.555  -2.288   2.935
  469   1HB   GLU  64          2HB       GLU  64  11.408  -4.840   2.001
  470   2HB   GLU  64          1HB       GLU  64  10.269  -4.069   0.848
  471   1HG   GLU  64          2HG       GLU  64  12.031  -2.365   0.270
  472   2HG   GLU  64          1HG       GLU  64  13.083  -3.048   1.571
  473    H    ALA  65           H        ALA  65   8.178  -3.425   2.474
  474    HA   ALA  65           HA       ALA  65   7.414  -1.326   0.810
  475   1HB   ALA  65          1HB       ALA  65   6.262  -3.474   1.078
  476   2HB   ALA  65          2HB       ALA  65   5.105  -2.110   1.399
  477   3HB   ALA  65          3HB       ALA  65   5.811  -3.063   2.774
  478    H    GLN  66           H        GLN  66   7.194  -1.599   4.349
  479    HA   GLN  66           HA       GLN  66   6.075   0.822   4.973
  480   1HB   GLN  66          2HB       GLN  66   6.461  -0.940   6.601
  481   2HB   GLN  66          1HB       GLN  66   8.163  -1.044   6.163
  482   1HG   GLN  66          2HG       GLN  66   8.107  -0.133   8.334
  483   2HG   GLN  66          1HG       GLN  66   8.650   1.172   7.248
  484   1HE2  GLN  66          1HE2      GLN  66   5.434  -0.126   8.407
  485   2HE2  GLN  66          2HE2      GLN  66   4.950   1.401   9.107
  486    H    ASN  67           H        ASN  67   9.523   0.052   4.458
  487    HA   ASN  67           HA       ASN  67  10.396   2.705   4.696
  488   1HB   ASN  67          2HB       ASN  67  11.550   0.100   3.580
  489   2HB   ASN  67          1HB       ASN  67  12.498   1.614   3.452
  490   1HD2  ASN  67          1HD2      ASN  67  13.334  -0.638   4.891
  491   2HD2  ASN  67          2HD2      ASN  67  13.410  -0.235   6.591
  492    H    LYS  68           H        LYS  68   9.290   0.956   1.787
  493    HA   LYS  68           HA       LYS  68  10.234   2.983   0.073
  494   1HB   LYS  68          2HB       LYS  68   8.151   0.803  -0.437
  495   2HB   LYS  68          1HB       LYS  68   8.908   1.879  -1.663
  496   1HG   LYS  68          2HG       LYS  68  11.133   0.889  -0.376
  497   2HG   LYS  68          1HG       LYS  68  10.044  -0.533  -0.309
  498   1HD   LYS  68          2HD       LYS  68   9.723  -0.496  -2.738
  499   2HD   LYS  68          1HD       LYS  68  10.676   1.008  -2.895
  500   1HE   LYS  68          2HE       LYS  68  11.762  -1.671  -1.810
  501   2HE   LYS  68          1HE       LYS  68  12.009  -1.048  -3.498
  502   1HZ   LYS  68          1HZ       LYS  68  13.022   0.973  -2.399
  503   2HZ   LYS  68          2HZ       LYS  68  13.905  -0.470  -2.249
  504   3HZ   LYS  68          3HZ       LYS  68  13.034   0.113  -0.951
  505    H    ILE  69           H        ILE  69   6.853   2.268   1.258
  506    HA   ILE  69           HA       ILE  69   5.631   4.491   0.425
  507    HB   ILE  69           HB       ILE  69   5.458   2.696   2.824
  508   1HG1  ILE  69          2HG1      ILE  69   3.707   3.272   0.363
  509   2HG1  ILE  69          1HG1      ILE  69   4.749   1.881   0.438
  510   1HG2  ILE  69          1HG2      ILE  69   4.583   4.935   3.568
  511   2HG2  ILE  69          2HG2      ILE  69   3.340   3.667   3.490
  512   3HG2  ILE  69          3HG2      ILE  69   3.431   4.908   2.170
  513   1HD1  ILE  69          1HD1      ILE  69   3.521   0.953   2.429
  514   2HD1  ILE  69          2HD1      ILE  69   2.539   1.092   0.928
  515   3HD1  ILE  69          3HD1      ILE  69   2.305   2.282   2.249
  516    H    LYS  70           H        LYS  70   7.393   4.348   3.615
  517    HA   LYS  70           HA       LYS  70   6.756   7.013   4.109
  518   1HB   LYS  70          2HB       LYS  70   8.494   4.919   5.344
  519   2HB   LYS  70          1HB       LYS  70   8.901   6.596   5.757
  520   1HG   LYS  70          2HG       LYS  70   7.468   5.716   7.440
  521   2HG   LYS  70          1HG       LYS  70   6.662   7.067   6.587
  522   1HD   LYS  70          2HD       LYS  70   5.320   5.480   5.258
  523   2HD   LYS  70          1HD       LYS  70   6.111   4.080   6.056
  524   1HE   LYS  70          2HE       LYS  70   4.252   6.198   7.353
  525   2HE   LYS  70          1HE       LYS  70   3.856   4.479   6.957
  526   1HZ   LYS  70          1HZ       LYS  70   5.688   5.530   9.042
  527   2HZ   LYS  70          2HZ       LYS  70   5.790   3.932   8.517
  528   3HZ   LYS  70          3HZ       LYS  70   4.354   4.504   9.199
  529    H    SER  71           H        SER  71   9.142   5.919   1.925
  530    HA   SER  71           HA       SER  71  10.922   8.153   2.556
  531   1HB   SER  71          2HB       SER  71  11.832   5.831   2.293
  532   2HB   SER  71          1HB       SER  71  11.254   5.804   0.601
  533    HG   SER  71           HG       SER  71  12.720   7.357   0.115
  534    H    ALA  72           H        ALA  72   8.303   7.411   0.598
  535    HA   ALA  72           HA       ALA  72   9.260   8.192  -1.875
  536   1HB   ALA  72          1HB       ALA  72   7.360   6.669  -1.478
  537   2HB   ALA  72          2HB       ALA  72   6.873   8.019  -2.593
  538   3HB   ALA  72          3HB       ALA  72   6.366   8.029  -0.868
  539    H    SER  73           H        SER  73  10.089  10.156  -2.210
  540    HA   SER  73           HA       SER  73   9.838  12.046  -3.319
  541   1HB   SER  73          2HB       SER  73   8.597  10.015  -4.356
  542   2HB   SER  73          1HB       SER  73   7.097  10.803  -3.808
  543    HG   SER  73           HG       SER  73   9.077  11.684  -5.675
  544    H    TYR  74           H        TYR  74   7.424  13.157  -4.282
  545    HA   TYR  74           HA       TYR  74   6.075  14.359  -1.967
  546   1HB   TYR  74          2HB       TYR  74   4.971  15.803  -3.930
  547   2HB   TYR  74          1HB       TYR  74   6.519  16.245  -3.164
  548    HD1  TYR  74           1HD      TYR  74   5.096  14.537  -6.154
  549    HD2  TYR  74           2HD      TYR  74   8.448  16.437  -4.362
  550    HE1  TYR  74           1HE      TYR  74   6.210  14.637  -8.337
  551    HE2  TYR  74           2HE      TYR  74   9.553  16.552  -6.536
  552    HH   TYR  74           HH       TYR  74   9.225  16.418  -8.755
  553    H    ASN  75           H        ASN  75   5.839  12.222  -4.724
  554    HA   ASN  75           HA       ASN  75   3.092  11.649  -3.937
  555   1HB   ASN  75          2HB       ASN  75   2.629  11.009  -6.305
  556   2HB   ASN  75          1HB       ASN  75   2.924  12.745  -6.008
  557   1HD2  ASN  75          1HD2      ASN  75   5.597  10.290  -6.327
  558   2HD2  ASN  75          2HD2      ASN  75   6.096  10.879  -7.890
  559    H    LEU  76           H        LEU  76   2.323   9.646  -3.802
  560    HA   LEU  76           HA       LEU  76   4.273   7.447  -4.064
  561   1HB   LEU  76          2HB       LEU  76   3.763   8.167  -1.748
  562   2HB   LEU  76          1HB       LEU  76   2.035   8.030  -2.041
  563    HG   LEU  76           HG       LEU  76   2.247   5.570  -2.363
  564   1HD1  LEU  76          1HD1      LEU  76   5.172   5.971  -1.421
  565   2HD1  LEU  76          2HD1      LEU  76   4.695   5.430  -3.082
  566   3HD1  LEU  76          3HD1      LEU  76   4.359   4.390  -1.650
  567   1HD2  LEU  76          1HD2      LEU  76   2.499   4.993  -0.001
  568   2HD2  LEU  76          2HD2      LEU  76   1.721   6.617  -0.117
  569   3HD2  LEU  76          3HD2      LEU  76   3.468   6.471   0.311
  570    H    SER  77           H        SER  77   3.675   6.113  -5.754
  571    HA   SER  77           HA       SER  77   0.799   5.996  -6.359
  572   1HB   SER  77          2HB       SER  77   2.430   7.068  -8.044
  573   2HB   SER  77          1HB       SER  77   3.057   5.423  -8.325
  574    HG   SER  77           HG       SER  77   0.570   6.580  -8.864
  575    H    LEU  78           H        LEU  78  -0.186   4.184  -5.759
  576    HA   LEU  78           HA       LEU  78   1.401   1.700  -5.708
  577   1HB   LEU  78          2HB       LEU  78  -0.891   2.759  -4.036
  578   2HB   LEU  78          1HB       LEU  78  -0.583   1.014  -4.106
  579    HG   LEU  78           HG       LEU  78   0.336   2.396  -2.137
  580   1HD1  LEU  78          1HD1      LEU  78   2.168   0.792  -1.803
  581   2HD1  LEU  78          2HD1      LEU  78   2.158   0.348  -3.559
  582   3HD1  LEU  78          3HD1      LEU  78   0.737  -0.038  -2.511
  583   1HD2  LEU  78          1HD2      LEU  78   2.624   3.187  -2.258
  584   2HD2  LEU  78          2HD2      LEU  78   1.634   4.083  -3.487
  585   3HD2  LEU  78          3HD2      LEU  78   2.759   2.764  -4.005
  586    H    THR  79           H        THR  79   0.424  -0.207  -6.331
  587    HA   THR  79           HA       THR  79  -2.139  -0.030  -7.722
  588    HB   THR  79           HB       THR  79   0.315  -1.630  -8.593
  589    HG1  THR  79           1HG      THR  79   0.440   0.561  -9.171
  590   1HG2  THR  79          1HG2      THR  79  -2.525  -1.311  -9.772
  591   2HG2  THR  79          2HG2      THR  79  -1.837  -2.814  -9.030
  592   3HG2  THR  79          3HG2      THR  79  -1.146  -2.178 -10.567
  593    H    LEU  80           H        LEU  80  -3.505  -1.319  -6.452
  594    HA   LEU  80           HA       LEU  80  -2.546  -3.882  -5.458
  595   1HB   LEU  80          2HB       LEU  80  -3.744  -3.607  -3.431
  596   2HB   LEU  80          1HB       LEU  80  -2.599  -2.225  -3.613
  597    HG   LEU  80           HG       LEU  80  -5.585  -2.284  -4.161
  598   1HD1  LEU  80          1HD1      LEU  80  -4.778  -2.459  -1.741
  599   2HD1  LEU  80          2HD1      LEU  80  -5.839  -0.997  -2.104
  600   3HD1  LEU  80          3HD1      LEU  80  -4.018  -0.819  -1.968
  601   1HD2  LEU  80          1HD2      LEU  80  -3.325  -0.248  -4.385
  602   2HD2  LEU  80          2HD2      LEU  80  -4.976   0.428  -3.952
  603   3HD2  LEU  80          3HD2      LEU  80  -4.727  -0.460  -5.532
  604    H    GLN  81           H        GLN  81  -4.486  -5.308  -4.900
  605    HA   GLN  81           HA       GLN  81  -6.069  -5.407  -7.232
  606   1HB   GLN  81          2HB       GLN  81  -6.241  -7.136  -4.762
  607   2HB   GLN  81          1HB       GLN  81  -6.955  -7.466  -6.392
  608   1HG   GLN  81          2HG       GLN  81  -4.681  -7.574  -7.396
  609   2HG   GLN  81          1HG       GLN  81  -3.942  -7.343  -5.768
  610   1HE2  GLN  81          1HE2      GLN  81  -3.117  -9.577  -6.860
  611   2HE2  GLN  81          2HE2      GLN  81  -4.012 -10.983  -6.360
  612    H    LYS  82           H        LYS  82  -8.350  -5.824  -7.332
  613    HA   LYS  82           HA       LYS  82  -9.988  -4.301  -5.501
  614   1HB   LYS  82          2HB       LYS  82 -10.697  -5.996  -7.954
  615   2HB   LYS  82          1HB       LYS  82 -11.804  -4.882  -7.110
  616   1HG   LYS  82          2HG       LYS  82  -9.302  -4.147  -8.731
  617   2HG   LYS  82          1HG       LYS  82 -10.997  -3.929  -9.224
  618   1HD   LYS  82          2HD       LYS  82  -9.589  -2.563  -6.858
  619   2HD   LYS  82          1HD       LYS  82  -9.895  -1.822  -8.457
  620   1HE   LYS  82          2HE       LYS  82 -12.075  -2.655  -6.420
  621   2HE   LYS  82          1HE       LYS  82 -11.499  -0.980  -6.788
  622   1HZ   LYS  82          1HZ       LYS  82 -12.993  -2.829  -8.576
  623   2HZ   LYS  82          2HZ       LYS  82 -12.189  -1.434  -9.124
  624   3HZ   LYS  82          3HZ       LYS  82 -13.441  -1.315  -7.998
  625    H    SER  83           H        SER  83  -9.015  -6.214  -3.905
  626    HA   SER  83           HA       SER  83  -9.438  -7.869  -2.633
  627   1HB   SER  83          2HB       SER  83 -11.341  -6.223  -2.262
  628   2HB   SER  83          1HB       SER  83 -12.406  -7.410  -3.074
  629    HG   SER  83           HG       SER  83 -12.305  -7.587  -0.783
  630    H    LYS  84           H        LYS  84 -11.253  -9.795  -2.210
  631    HA   LYS  84           HA       LYS  84 -11.966 -10.956  -4.767
  632   1HB   LYS  84          2HB       LYS  84 -10.206 -12.469  -3.618
  633   2HB   LYS  84          1HB       LYS  84 -11.472 -12.768  -2.379
  634   1HG   LYS  84          2HG       LYS  84 -13.034 -13.515  -4.252
  635   2HG   LYS  84          1HG       LYS  84 -11.696 -13.283  -5.416
  636   1HD   LYS  84          2HD       LYS  84 -10.352 -15.009  -4.171
  637   2HD   LYS  84          1HD       LYS  84 -11.717 -15.207  -3.014
  638   1HE   LYS  84          2HE       LYS  84 -13.213 -15.925  -4.949
  639   2HE   LYS  84          1HE       LYS  84 -11.781 -15.824  -6.053
  640   1HZ   LYS  84          1HZ       LYS  84 -12.090 -17.584  -3.662
  641   2HZ   LYS  84          2HZ       LYS  84 -10.668 -17.419  -4.552
  642   3HZ   LYS  84          3HZ       LYS  84 -12.014 -18.069  -5.288
  643    H    ARG  85           H        ARG  85 -14.162 -11.262  -4.940
  644    HA   ARG  85           HA       ARG  85 -15.677 -11.519  -2.507
  645   1HB   ARG  85          2HB       ARG  85 -16.094  -9.447  -4.721
  646   2HB   ARG  85          1HB       ARG  85 -17.471 -10.027  -3.737
  647   1HG   ARG  85          2HG       ARG  85 -16.609  -9.174  -1.708
  648   2HG   ARG  85          1HG       ARG  85 -14.991  -8.857  -2.373
  649   1HD   ARG  85          2HD       ARG  85 -17.484  -7.381  -3.446
  650   2HD   ARG  85          1HD       ARG  85 -16.554  -6.818  -2.002
  651    HE   ARG  85           HE       ARG  85 -15.175  -7.354  -4.670
  652   1HH1  ARG  85          1HH1      ARG  85 -15.680  -5.073  -1.948
  653   2HH1  ARG  85          2HH1      ARG  85 -14.862  -3.813  -2.815
  654   1HH2  ARG  85          1HH2      ARG  85 -13.724  -5.955  -5.376
  655   2HH2  ARG  85          2HH2      ARG  85 -13.338  -4.507  -4.481
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1  -7.829  -8.725  -9.958
    2   2H    MET   1          2HT       MET   1  -6.389  -8.461 -10.779
    3   3H    MET   1          3HT       MET   1  -7.681  -9.215 -11.543
    4    HA   MET   1           HA       MET   1  -7.298  -6.902 -12.240
    5   1HB   MET   1          2HB       MET   1  -9.502  -8.102 -12.439
    6   2HB   MET   1          1HB       MET   1 -10.005  -7.386 -10.878
    7   1HG   MET   1          2HG       MET   1  -9.856  -5.110 -11.894
    8   2HG   MET   1          1HG       MET   1  -9.202  -5.811 -13.400
    9   1HE   MET   1          1HE       MET   1 -10.868  -4.518 -14.782
   10   2HE   MET   1          2HE       MET   1 -11.417  -3.793 -13.238
   11   3HE   MET   1          3HE       MET   1 -12.623  -4.406 -14.415
   12    H    ALA   2           H        ALA   2  -6.942  -4.719 -11.731
   13    HA   ALA   2           HA       ALA   2  -6.894  -4.126  -8.864
   14   1HB   ALA   2          1HB       ALA   2  -4.746  -5.187  -9.445
   15   2HB   ALA   2          2HB       ALA   2  -4.452  -3.437  -9.194
   16   3HB   ALA   2          3HB       ALA   2  -4.558  -4.086 -10.867
   17    H    TYR   3           H        TYR   3  -5.675  -1.900  -8.619
   18    HA   TYR   3           HA       TYR   3  -6.449  -0.089 -10.695
   19   1HB   TYR   3          2HB       TYR   3  -7.617   1.496  -9.497
   20   2HB   TYR   3          1HB       TYR   3  -8.453  -0.057  -9.190
   21    HD1  TYR   3           1HD      TYR   3  -7.695   2.859  -7.868
   22    HD2  TYR   3           2HD      TYR   3  -7.068  -1.230  -6.858
   23    HE1  TYR   3           1HE      TYR   3  -7.642   3.442  -5.474
   24    HE2  TYR   3           2HE      TYR   3  -7.167  -0.682  -4.509
   25    HH   TYR   3           HH       TYR   3  -7.323   0.983  -2.967
   26    H    SER   4           H        SER   4  -5.494   2.063 -10.427
   27    HA   SER   4           HA       SER   4  -3.031   1.950  -8.844
   28   1HB   SER   4          2HB       SER   4  -3.212   2.813 -11.786
   29   2HB   SER   4          1HB       SER   4  -1.760   2.942 -10.729
   30    HG   SER   4           HG       SER   4  -3.028   0.653 -11.771
   31    H    VAL   5           H        VAL   5  -2.967   3.678  -7.547
   32    HA   VAL   5           HA       VAL   5  -3.987   6.210  -8.546
   33    HB   VAL   5           HB       VAL   5  -5.783   5.610  -7.214
   34   1HG1  VAL   5          1HG1      VAL   5  -5.589   4.899  -4.874
   35   2HG1  VAL   5          2HG1      VAL   5  -3.821   4.616  -5.098
   36   3HG1  VAL   5          3HG1      VAL   5  -5.033   3.674  -6.078
   37   1HG2  VAL   5          1HG2      VAL   5  -5.804   7.273  -5.469
   38   2HG2  VAL   5          2HG2      VAL   5  -4.883   7.936  -6.871
   39   3HG2  VAL   5          3HG2      VAL   5  -4.001   7.350  -5.416
   40    H    THR   6           H        THR   6  -2.814   7.924  -8.147
   41    HA   THR   6           HA       THR   6  -0.309   7.519  -6.694
   42    HB   THR   6           HB       THR   6  -1.018   9.548  -8.818
   43    HG1  THR   6           1HG      THR   6   0.952   7.574  -8.980
   44   1HG2  THR   6          1HG2      THR   6   0.741  10.444  -7.239
   45   2HG2  THR   6          2HG2      THR   6   1.511   9.967  -8.787
   46   3HG2  THR   6          3HG2      THR   6   1.662   8.891  -7.359
   47    H    LEU   7           H        LEU   7  -0.008   8.622  -4.818
   48    HA   LEU   7           HA       LEU   7  -2.063  10.582  -4.101
   49   1HB   LEU   7          2HB       LEU   7  -1.996   8.317  -2.959
   50   2HB   LEU   7          1HB       LEU   7  -0.366   8.729  -2.349
   51    HG   LEU   7           HG       LEU   7  -1.364  10.670  -1.092
   52   1HD1  LEU   7          1HD1      LEU   7  -3.865  10.756  -0.778
   53   2HD1  LEU   7          2HD1      LEU   7  -4.064   9.519  -2.064
   54   3HD1  LEU   7          3HD1      LEU   7  -3.402  11.146  -2.471
   55   1HD2  LEU   7          1HD2      LEU   7  -2.508   9.248   0.634
   56   2HD2  LEU   7          2HD2      LEU   7  -1.035   8.424  -0.026
   57   3HD2  LEU   7          3HD2      LEU   7  -2.670   7.929  -0.594
   58    H    THR   8           H        THR   8  -1.485  12.518  -3.105
   59    HA   THR   8           HA       THR   8   1.369  13.133  -3.023
   60    HB   THR   8           HB       THR   8   0.705  15.467  -3.676
   61    HG1  THR   8           1HG      THR   8  -1.504  14.192  -4.837
   62   1HG2  THR   8          1HG2      THR   8   0.669  14.926  -6.102
   63   2HG2  THR   8          2HG2      THR   8   0.240  13.209  -5.746
   64   3HG2  THR   8          3HG2      THR   8   1.830  13.852  -5.231
   65    H    GLY   9           H        GLY   9   2.073  14.502  -1.308
   66   1HA   GLY   9          2HA       GLY   9   0.594  16.218   0.021
   67   2HA   GLY   9          1HA       GLY   9   0.249  14.658   0.872
   68    HA   PRO  10           HA       PRO  10   4.307  16.361   2.237
   69   1HB   PRO  10          2HB       PRO  10   3.802  18.116   4.284
   70   2HB   PRO  10          1HB       PRO  10   3.551  18.563   2.550
   71   1HG   PRO  10          2HG       PRO  10   1.361  17.540   4.459
   72   2HG   PRO  10          1HG       PRO  10   1.373  19.091   3.510
   73   1HD   PRO  10          2HD       PRO  10   0.216  16.784   2.492
   74   2HD   PRO  10          1HD       PRO  10   1.152  17.927   1.426
   75    H    GLY  11           H        GLY  11   1.682  14.938   3.694
   76   1HA   GLY  11          2HA       GLY  11   3.140  13.980   6.086
   77   2HA   GLY  11          1HA       GLY  11   1.378  14.071   5.839
   78    HA   PRO  12           HA       PRO  12   2.956  10.316   3.521
   79   1HB   PRO  12          2HB       PRO  12   4.828   9.375   5.750
   80   2HB   PRO  12          1HB       PRO  12   4.865   8.953   3.984
   81   1HG   PRO  12          2HG       PRO  12   6.499  10.927   4.909
   82   2HG   PRO  12          1HG       PRO  12   5.516  11.243   3.413
   83   1HD   PRO  12          2HD       PRO  12   4.855  12.054   6.317
   84   2HD   PRO  12          1HD       PRO  12   4.815  13.061   4.795
   85    H    TRP  13           H        TRP  13   0.800   9.987   4.018
   86    HA   TRP  13           HA       TRP  13  -0.789   8.475   4.312
   87   1HB   TRP  13          2HB       TRP  13   0.899   6.295   3.304
   88   2HB   TRP  13          1HB       TRP  13  -0.392   7.144   2.539
   89    HD1  TRP  13           HD       TRP  13   3.290   6.799   2.867
   90    HE1  TRP  13           1HE      TRP  13   4.583   8.355   1.246
   91    HE3  TRP  13           3HE      TRP  13  -0.441  10.009   1.817
   92    HZ2  TRP  13           2HZ      TRP  13   4.004  10.617  -0.300
   93    HZ3  TRP  13           3HZ      TRP  13   0.070  12.023   0.528
   94    HH2  TRP  13           HH       TRP  13   2.309  12.336  -0.480
   95    H    GLY  14           H        GLY  14  -1.682   7.923   6.247
   96   1HA   GLY  14          2HA       GLY  14  -0.408   5.713   7.682
   97   2HA   GLY  14          1HA       GLY  14  -1.573   6.922   8.288
   98    H    PHE  15           H        PHE  15  -1.261   4.137   6.131
   99    HA   PHE  15           HA       PHE  15  -3.904   3.233   7.074
  100   1HB   PHE  15          2HB       PHE  15  -3.550   1.444   5.086
  101   2HB   PHE  15          1HB       PHE  15  -4.021   3.067   4.663
  102    HD1  PHE  15           1HD      PHE  15  -2.867   4.437   3.461
  103    HD2  PHE  15           2HD      PHE  15  -0.836   1.062   5.146
  104    HE1  PHE  15           1HE      PHE  15  -0.799   5.127   2.371
  105    HE2  PHE  15           2HE      PHE  15   1.238   1.833   4.157
  106    HZ   PHE  15           HZ       PHE  15   1.255   3.855   2.717
  107    H    ARG  16           H        ARG  16  -3.869   0.690   7.038
  108    HA   ARG  16           HA       ARG  16  -2.113   0.207   9.306
  109   1HB   ARG  16          2HB       ARG  16  -4.822  -0.898   8.426
  110   2HB   ARG  16          1HB       ARG  16  -3.824  -1.748   9.639
  111   1HG   ARG  16          2HG       ARG  16  -5.527  -0.554  10.724
  112   2HG   ARG  16          1HG       ARG  16  -3.938   0.119  11.195
  113   1HD   ARG  16          2HD       ARG  16  -4.363   2.178   9.852
  114   2HD   ARG  16          1HD       ARG  16  -5.846   1.430   9.153
  115    HE   ARG  16           HE       ARG  16  -6.998   1.748  11.205
  116   1HH1  ARG  16          1HH1      ARG  16  -3.566   2.725  11.778
  117   2HH1  ARG  16          2HH1      ARG  16  -4.027   3.519  13.250
  118   1HH2  ARG  16          1HH2      ARG  16  -7.393   2.652  13.171
  119   2HH2  ARG  16          2HH2      ARG  16  -6.087   3.404  14.069
  120    H    LEU  17           H        LEU  17  -0.275  -0.891   8.637
  121    HA   LEU  17           HA       LEU  17  -0.471  -2.646   6.372
  122   1HB   LEU  17          2HB       LEU  17   1.882  -1.875   8.211
  123   2HB   LEU  17          1HB       LEU  17   2.021  -2.914   6.773
  124    HG   LEU  17           HG       LEU  17   2.887  -0.808   6.217
  125   1HD1  LEU  17          1HD1      LEU  17   1.649  -0.271   4.213
  126   2HD1  LEU  17          2HD1      LEU  17   0.122  -0.950   4.917
  127   3HD1  LEU  17          3HD1      LEU  17   1.516  -2.038   4.535
  128   1HD2  LEU  17          1HD2      LEU  17   1.834   1.346   6.322
  129   2HD2  LEU  17          2HD2      LEU  17   1.822   0.615   7.966
  130   3HD2  LEU  17          3HD2      LEU  17   0.310   0.658   6.986
  131    H    GLN  18           H        GLN  18  -0.842  -4.908   6.629
  132    HA   GLN  18           HA       GLN  18   0.151  -6.041   9.143
  133   1HB   GLN  18          2HB       GLN  18  -2.710  -6.265   8.129
  134   2HB   GLN  18          1HB       GLN  18  -1.982  -7.367   9.343
  135   1HG   GLN  18          2HG       GLN  18  -1.471  -5.430  10.833
  136   2HG   GLN  18          1HG       GLN  18  -2.266  -4.321   9.670
  137   1HE2  GLN  18          1HE2      GLN  18  -3.118  -4.271  12.209
  138   2HE2  GLN  18          2HE2      GLN  18  -4.707  -4.961  12.337
  139    H    GLY  19           H        GLY  19   1.113  -7.919   8.998
  140   1HA   GLY  19          2HA       GLY  19   1.401 -10.022   8.270
  141   2HA   GLY  19          1HA       GLY  19   0.489  -9.672   6.765
  142    H    GLY  20           H        GLY  20   1.840 -10.252   5.173
  143   1HA   GLY  20          2HA       GLY  20   3.415  -9.244   3.766
  144   2HA   GLY  20          1HA       GLY  20   4.507  -8.997   5.152
  145    H    LYS  21           H        LYS  21   5.529 -10.057   2.932
  146    HA   LYS  21           HA       LYS  21   5.091 -12.691   2.488
  147   1HB   LYS  21          2HB       LYS  21   6.305 -10.703   1.132
  148   2HB   LYS  21          1HB       LYS  21   7.768 -11.510   1.741
  149   1HG   LYS  21          2HG       LYS  21   7.344 -12.537  -0.364
  150   2HG   LYS  21          1HG       LYS  21   6.677 -13.715   0.798
  151   1HD   LYS  21          2HD       LYS  21   4.481 -12.010   0.343
  152   2HD   LYS  21          1HD       LYS  21   5.343 -11.899  -1.207
  153   1HE   LYS  21          2HE       LYS  21   3.689 -13.622  -1.457
  154   2HE   LYS  21          1HE       LYS  21   5.271 -14.488  -1.351
  155   1HZ   LYS  21          1HZ       LYS  21   4.754 -15.197   0.814
  156   2HZ   LYS  21          2HZ       LYS  21   3.258 -15.270   0.026
  157   3HZ   LYS  21          3HZ       LYS  21   3.598 -13.994   1.060
  158    H    ASP  22           H        ASP  22   7.442 -11.383   4.781
  159    HA   ASP  22           HA       ASP  22   8.971 -13.746   4.801
  160   1HB   ASP  22          2HB       ASP  22   9.720 -11.367   5.357
  161   2HB   ASP  22          1HB       ASP  22   8.817 -11.508   6.910
  162    H    PHE  23           H        PHE  23   5.905 -13.098   6.190
  163    HA   PHE  23           HA       PHE  23   6.235 -15.085   8.278
  164   1HB   PHE  23          2HB       PHE  23   3.852 -13.362   7.304
  165   2HB   PHE  23          1HB       PHE  23   3.805 -14.496   8.697
  166    HD1  PHE  23           1HD      PHE  23   5.857 -14.107  10.393
  167    HD2  PHE  23           2HD      PHE  23   4.114 -11.186   7.856
  168    HE1  PHE  23           1HE      PHE  23   6.550 -12.342  11.949
  169    HE2  PHE  23           2HE      PHE  23   4.780  -9.420   9.419
  170    HZ   PHE  23           HZ       PHE  23   6.003 -10.003  11.474
  171    H    ASN  24           H        ASN  24   4.280 -14.446   5.389
  172    HA   ASN  24           HA       ASN  24   4.371 -16.900   4.317
  173   1HB   ASN  24          2HB       ASN  24   3.135 -17.725   6.451
  174   2HB   ASN  24          1HB       ASN  24   1.802 -16.606   6.059
  175   1HD2  ASN  24          1HD2      ASN  24   3.788 -19.203   4.416
  176   2HD2  ASN  24          2HD2      ASN  24   2.446 -19.866   3.538
  177    H    MET  25           H        MET  25   2.596 -14.034   4.930
  178    HA   MET  25           HA       MET  25   0.456 -14.600   3.154
  179   1HB   MET  25          2HB       MET  25   0.517 -13.740   5.490
  180   2HB   MET  25          1HB       MET  25   1.315 -12.230   4.908
  181   1HG   MET  25          2HG       MET  25  -0.745 -11.464   3.950
  182   2HG   MET  25          1HG       MET  25  -1.535 -13.075   4.152
  183   1HE   MET  25          1HE       MET  25  -3.295 -10.374   6.505
  184   2HE   MET  25          2HE       MET  25  -3.424 -11.356   5.012
  185   3HE   MET  25          3HE       MET  25  -2.305  -9.947   5.065
  186    HA   PRO  26           HA       PRO  26   2.126 -11.817   0.023
  187   1HB   PRO  26          2HB       PRO  26  -0.160 -10.493  -0.942
  188   2HB   PRO  26          1HB       PRO  26   0.429 -12.099  -1.501
  189   1HG   PRO  26          2HG       PRO  26  -1.969 -11.523   0.142
  190   2HG   PRO  26          1HG       PRO  26  -1.508 -13.021  -0.719
  191   1HD   PRO  26          2HD       PRO  26  -1.189 -12.033   2.027
  192   2HD   PRO  26          1HD       PRO  26  -0.943 -13.785   1.658
  193    H    LEU  27           H        LEU  27   2.425  -9.432  -0.436
  194    HA   LEU  27           HA       LEU  27   2.422  -7.991   2.015
  195   1HB   LEU  27          2HB       LEU  27   3.788  -8.002  -0.421
  196   2HB   LEU  27          1HB       LEU  27   2.879  -6.480  -0.522
  197    HG   LEU  27           HG       LEU  27   4.749  -7.415   1.739
  198   1HD1  LEU  27          1HD1      LEU  27   5.116  -5.271  -0.461
  199   2HD1  LEU  27          2HD1      LEU  27   5.862  -6.912  -0.445
  200   3HD1  LEU  27          3HD1      LEU  27   6.326  -5.708   0.812
  201   1HD2  LEU  27          1HD2      LEU  27   4.616  -5.086   2.631
  202   2HD2  LEU  27          2HD2      LEU  27   3.007  -5.874   2.682
  203   3HD2  LEU  27          3HD2      LEU  27   3.370  -4.665   1.392
  204    H    THR  28           H        THR  28   0.501  -7.472   2.835
  205    HA   THR  28           HA       THR  28  -1.339  -6.045   1.072
  206    HB   THR  28           HB       THR  28  -3.191  -7.055   1.589
  207    HG1  THR  28           1HG      THR  28  -3.353  -8.557   3.329
  208   1HG2  THR  28          1HG2      THR  28  -1.305  -9.438   1.979
  209   2HG2  THR  28          2HG2      THR  28  -1.539  -8.591   0.401
  210   3HG2  THR  28          3HG2      THR  28  -2.941  -9.389   1.224
  211    H    ILE  29           H        ILE  29  -2.852  -4.706   1.905
  212    HA   ILE  29           HA       ILE  29  -2.041  -3.354   4.423
  213    HB   ILE  29           HB       ILE  29  -3.105  -2.149   1.881
  214   1HG1  ILE  29          2HG1      ILE  29  -0.423  -2.414   3.312
  215   2HG1  ILE  29          1HG1      ILE  29  -0.797  -2.758   1.603
  216   1HG2  ILE  29          1HG2      ILE  29  -2.355  -0.897   4.623
  217   2HG2  ILE  29          2HG2      ILE  29  -4.039  -1.055   3.973
  218   3HG2  ILE  29          3HG2      ILE  29  -2.892  -0.011   3.144
  219   1HD1  ILE  29          1HD1      ILE  29  -0.848  -0.468   1.004
  220   2HD1  ILE  29          2HD1      ILE  29   0.596  -0.645   2.055
  221   3HD1  ILE  29          3HD1      ILE  29  -0.895   0.115   2.724
  222    H    SER  30           H        SER  30  -3.867  -2.772   5.752
  223    HA   SER  30           HA       SER  30  -6.234  -4.423   5.116
  224   1HB   SER  30          2HB       SER  30  -5.191  -5.043   7.182
  225   2HB   SER  30          1HB       SER  30  -5.260  -3.375   7.796
  226    HG   SER  30           HG       SER  30  -7.023  -4.698   8.506
  227    H    ARG  31           H        ARG  31  -5.867  -1.347   6.989
  228    HA   ARG  31           HA       ARG  31  -8.146  -0.356   5.412
  229   1HB   ARG  31          2HB       ARG  31  -8.639  -1.576   7.685
  230   2HB   ARG  31          1HB       ARG  31  -7.899  -0.152   8.449
  231   1HG   ARG  31          2HG       ARG  31  -9.664   1.261   7.132
  232   2HG   ARG  31          1HG       ARG  31 -10.410  -0.300   6.660
  233   1HD   ARG  31          2HD       ARG  31 -10.784  -0.852   9.079
  234   2HD   ARG  31          1HD       ARG  31  -9.990   0.695   9.572
  235    HE   ARG  31           HE       ARG  31 -12.690   0.369   8.404
  236   1HH1  ARG  31          1HH1      ARG  31 -10.022   2.775   8.654
  237   2HH1  ARG  31          2HH1      ARG  31 -11.107   4.060   8.427
  238   1HH2  ARG  31          1HH2      ARG  31 -14.019   2.187   8.213
  239   2HH2  ARG  31          2HH2      ARG  31 -13.388   3.782   8.521
  240    H    ILE  32           H        ILE  32  -8.454   1.933   5.538
  241    HA   ILE  32           HA       ILE  32  -6.136   3.551   5.897
  242    HB   ILE  32           HB       ILE  32  -9.003   3.774   5.096
  243   1HG1  ILE  32          2HG1      ILE  32  -8.181   4.892   3.144
  244   2HG1  ILE  32          1HG1      ILE  32  -6.565   5.116   3.831
  245   1HG2  ILE  32          1HG2      ILE  32  -7.338   6.267   5.790
  246   2HG2  ILE  32          2HG2      ILE  32  -8.849   5.711   6.646
  247   3HG2  ILE  32          3HG2      ILE  32  -8.918   6.206   4.930
  248   1HD1  ILE  32          1HD1      ILE  32  -6.137   2.620   3.645
  249   2HD1  ILE  32          2HD1      ILE  32  -6.508   3.420   2.092
  250   3HD1  ILE  32          3HD1      ILE  32  -7.781   2.432   2.921
  251    H    THR  33           H        THR  33  -5.822   5.155   7.591
  252    HA   THR  33           HA       THR  33  -7.057   4.475  10.057
  253    HB   THR  33           HB       THR  33  -5.238   6.799   9.410
  254    HG1  THR  33           1HG      THR  33  -4.019   5.140   9.279
  255   1HG2  THR  33          1HG2      THR  33  -4.913   6.880  11.877
  256   2HG2  THR  33          2HG2      THR  33  -6.112   5.564  12.118
  257   3HG2  THR  33          3HG2      THR  33  -6.650   7.168  11.533
  258    HA   PRO  34           HA       PRO  34 -10.558   7.015   9.476
  259   1HB   PRO  34          2HB       PRO  34  -9.642   7.720  12.353
  260   2HB   PRO  34          1HB       PRO  34 -11.358   7.737  11.792
  261   1HG   PRO  34          2HG       PRO  34 -10.377   5.452  12.929
  262   2HG   PRO  34          1HG       PRO  34 -11.263   5.292  11.349
  263   1HD   PRO  34          2HD       PRO  34  -8.272   5.199  11.863
  264   2HD   PRO  34          1HD       PRO  34  -9.250   4.410  10.550
  265    H    GLY  35           H        GLY  35  -7.808   9.016  10.582
  266   1HA   GLY  35          2HA       GLY  35  -9.191  11.224   9.176
  267   2HA   GLY  35          1HA       GLY  35  -8.419  11.424  10.778
  268    H    SER  36           H        SER  36  -7.079   9.390   8.253
  269    HA   SER  36           HA       SER  36  -4.729  11.136   8.251
  270   1HB   SER  36          2HB       SER  36  -4.480   8.750   8.857
  271   2HB   SER  36          1HB       SER  36  -5.070   8.277   7.235
  272    HG   SER  36           HG       SER  36  -2.629   9.194   8.088
  273    H    LYS  37           H        LYS  37  -3.487  11.083   6.193
  274    HA   LYS  37           HA       LYS  37  -4.769  12.326   4.082
  275   1HB   LYS  37          2HB       LYS  37  -2.127  11.719   4.923
  276   2HB   LYS  37          1HB       LYS  37  -2.243  10.931   3.334
  277   1HG   LYS  37          2HG       LYS  37  -2.794  13.872   4.014
  278   2HG   LYS  37          1HG       LYS  37  -1.336  13.220   3.212
  279   1HD   LYS  37          2HD       LYS  37  -2.698  12.552   1.219
  280   2HD   LYS  37          1HD       LYS  37  -4.188  13.085   2.058
  281   1HE   LYS  37          2HE       LYS  37  -3.087  15.432   2.255
  282   2HE   LYS  37          1HE       LYS  37  -1.872  14.858   1.056
  283   1HZ   LYS  37          1HZ       LYS  37  -3.792  14.386  -0.461
  284   2HZ   LYS  37          2HZ       LYS  37  -3.658  16.002   0.025
  285   3HZ   LYS  37          3HZ       LYS  37  -4.821  15.017   0.737
  286    H    ALA  38           H        ALA  38  -4.041   9.039   4.763
  287    HA   ALA  38           HA       ALA  38  -4.560   7.614   2.452
  288   1HB   ALA  38          1HB       ALA  38  -5.189   6.881   5.354
  289   2HB   ALA  38          2HB       ALA  38  -3.529   6.917   4.665
  290   3HB   ALA  38          3HB       ALA  38  -4.726   5.781   3.991
  291    H    ALA  39           H        ALA  39  -6.995   9.199   4.548
  292    HA   ALA  39           HA       ALA  39  -9.033   7.641   3.234
  293   1HB   ALA  39          1HB       ALA  39  -9.142   8.310   5.708
  294   2HB   ALA  39          2HB       ALA  39 -10.555   8.902   4.771
  295   3HB   ALA  39          3HB       ALA  39  -9.212  10.023   5.195
  296    H    GLN  40           H        GLN  40  -7.602  10.789   2.805
  297    HA   GLN  40           HA       GLN  40  -9.762  12.275   2.263
  298   1HB   GLN  40          2HB       GLN  40  -6.902  12.509   1.239
  299   2HB   GLN  40          1HB       GLN  40  -8.122  13.805   1.051
  300   1HG   GLN  40          2HG       GLN  40  -8.408  13.908   3.551
  301   2HG   GLN  40          1HG       GLN  40  -7.146  12.651   3.746
  302   1HE2  GLN  40          1HE2      GLN  40  -6.163  14.482   5.097
  303   2HE2  GLN  40          2HE2      GLN  40  -5.143  15.594   4.253
  304    H    SER  41           H        SER  41  -7.929  10.548  -0.286
  305    HA   SER  41           HA       SER  41  -9.779  11.811  -2.195
  306   1HB   SER  41          2HB       SER  41  -8.092  11.798  -3.861
  307   2HB   SER  41          1HB       SER  41  -7.497  12.573  -2.361
  308    HG   SER  41           HG       SER  41  -5.970  11.207  -3.222
  309    H    GLN  42           H        GLN  42  -8.055   9.499  -3.832
  310    HA   GLN  42           HA       GLN  42 -10.438   7.779  -3.863
  311   1HB   GLN  42          2HB       GLN  42  -8.333   8.257  -6.024
  312   2HB   GLN  42          1HB       GLN  42  -9.679   7.075  -6.084
  313   1HG   GLN  42          2HG       GLN  42 -11.304   9.039  -5.734
  314   2HG   GLN  42          1HG       GLN  42  -9.932  10.133  -6.120
  315   1HE2  GLN  42          1HE2      GLN  42  -9.036  10.027  -8.313
  316   2HE2  GLN  42          2HE2      GLN  42 -10.001   9.326  -9.603
  317    H    LEU  43           H        LEU  43  -7.676   7.887  -2.255
  318    HA   LEU  43           HA       LEU  43  -6.653   5.305  -2.755
  319   1HB   LEU  43          2HB       LEU  43  -5.518   7.405  -1.642
  320   2HB   LEU  43          1HB       LEU  43  -6.353   6.868  -0.158
  321    HG   LEU  43           HG       LEU  43  -5.255   4.510  -0.820
  322   1HD1  LEU  43          1HD1      LEU  43  -3.326   6.530  -2.146
  323   2HD1  LEU  43          2HD1      LEU  43  -4.388   5.398  -3.027
  324   3HD1  LEU  43          3HD1      LEU  43  -3.065   4.751  -1.990
  325   1HD2  LEU  43          1HD2      LEU  43  -3.220   5.044   0.588
  326   2HD2  LEU  43          2HD2      LEU  43  -4.800   5.409   1.318
  327   3HD2  LEU  43          3HD2      LEU  43  -3.798   6.752   0.645
  328    H    SER  44           H        SER  44  -7.678   3.457  -2.308
  329    HA   SER  44           HA       SER  44  -8.414   3.125   0.518
  330   1HB   SER  44          2HB       SER  44  -9.674   1.691  -1.891
  331   2HB   SER  44          1HB       SER  44  -9.740   1.065  -0.206
  332    HG   SER  44           HG       SER  44 -10.770   3.527  -1.142
  333    H    GLN  45           H        GLN  45  -5.858   3.059   0.345
  334    HA   GLN  45           HA       GLN  45  -4.730   0.783  -0.849
  335   1HB   GLN  45          2HB       GLN  45  -3.585   2.946  -0.602
  336   2HB   GLN  45          1HB       GLN  45  -3.905   2.922   1.190
  337   1HG   GLN  45          2HG       GLN  45  -2.293   1.476   1.679
  338   2HG   GLN  45          1HG       GLN  45  -2.540   0.575   0.140
  339   1HE2  GLN  45          2HE2      GLN  45  -1.429   4.020   0.673
  340   2HE2  GLN  45          1HE2      GLN  45   0.233   3.673   0.348
  341    H    GLY  46           H        GLY  46  -5.384  -1.155  -0.095
  342   1HA   GLY  46          2HA       GLY  46  -5.335  -2.079   2.517
  343   2HA   GLY  46          1HA       GLY  46  -6.891  -1.215   2.238
  344    H    ASP  47           H        ASP  47  -4.753  -3.321   0.314
  345    HA   ASP  47           HA       ASP  47  -6.425  -5.516   0.503
  346   1HB   ASP  47          2HB       ASP  47  -7.540  -4.026  -1.437
  347   2HB   ASP  47          1HB       ASP  47  -6.147  -4.511  -2.410
  348    H    LEU  48           H        LEU  48  -5.223  -6.874  -1.892
  349    HA   LEU  48           HA       LEU  48  -2.593  -7.190  -0.894
  350   1HB   LEU  48          2HB       LEU  48  -4.547  -8.837  -1.429
  351   2HB   LEU  48          1HB       LEU  48  -4.212  -8.511  -3.145
  352    HG   LEU  48           HG       LEU  48  -2.313  -9.839  -1.077
  353   1HD1  LEU  48          1HD1      LEU  48  -3.770 -10.966  -3.519
  354   2HD1  LEU  48          2HD1      LEU  48  -4.260 -11.128  -1.781
  355   3HD1  LEU  48          3HD1      LEU  48  -2.701 -11.851  -2.324
  356   1HD2  LEU  48          1HD2      LEU  48  -0.866 -10.177  -3.224
  357   2HD2  LEU  48          2HD2      LEU  48  -0.959  -8.501  -2.524
  358   3HD2  LEU  48          3HD2      LEU  48  -1.952  -8.907  -3.976
  359    H    VAL  49           H        VAL  49  -0.959  -5.957  -1.670
  360    HA   VAL  49           HA       VAL  49  -1.443  -4.175  -3.786
  361    HB   VAL  49           HB       VAL  49   0.965  -4.676  -2.004
  362   1HG1  VAL  49          1HG1      VAL  49   1.373  -2.221  -2.467
  363   2HG1  VAL  49          2HG1      VAL  49   0.064  -2.260  -3.719
  364   3HG1  VAL  49          3HG1      VAL  49   1.564  -3.244  -3.941
  365   1HG2  VAL  49          1HG2      VAL  49  -1.550  -2.932  -1.621
  366   2HG2  VAL  49          2HG2      VAL  49  -0.035  -2.759  -0.669
  367   3HG2  VAL  49          3HG2      VAL  49  -0.980  -4.273  -0.562
  368    H    VAL  50           H        VAL  50  -0.351  -4.164  -5.818
  369    HA   VAL  50           HA       VAL  50   1.016  -6.629  -6.537
  370    HB   VAL  50           HB       VAL  50   0.272  -4.424  -8.475
  371   1HG1  VAL  50          1HG1      VAL  50   1.859  -6.244  -9.200
  372   2HG1  VAL  50          2HG1      VAL  50   0.261  -6.387 -10.013
  373   3HG1  VAL  50          3HG1      VAL  50   0.673  -7.483  -8.648
  374   1HG2  VAL  50          1HG2      VAL  50  -1.805  -4.797  -7.404
  375   2HG2  VAL  50          2HG2      VAL  50  -1.561  -6.601  -7.326
  376   3HG2  VAL  50          3HG2      VAL  50  -1.811  -5.763  -8.914
  377    H    ALA  51           H        ALA  51   1.333  -3.139  -7.137
  378    HA   ALA  51           HA       ALA  51   4.239  -3.388  -6.979
  379   1HB   ALA  51          1HB       ALA  51   4.484  -1.902  -8.996
  380   2HB   ALA  51          2HB       ALA  51   2.699  -1.925  -9.211
  381   3HB   ALA  51          3HB       ALA  51   3.646  -3.437  -9.416
  382    H    ILE  52           H        ILE  52   5.355  -1.587  -6.338
  383    HA   ILE  52           HA       ILE  52   3.795   0.727  -5.491
  384    HB   ILE  52           HB       ILE  52   4.087  -1.255  -3.859
  385   1HG1  ILE  52          2HG1      ILE  52   4.657   1.621  -2.920
  386   2HG1  ILE  52          1HG1      ILE  52   3.064   0.975  -3.441
  387   1HG2  ILE  52          1HG2      ILE  52   6.543  -1.498  -4.107
  388   2HG2  ILE  52          2HG2      ILE  52   6.067  -1.155  -2.405
  389   3HG2  ILE  52          3HG2      ILE  52   6.771   0.162  -3.433
  390   1HD1  ILE  52          1HD1      ILE  52   4.712   0.067  -0.996
  391   2HD1  ILE  52          2HD1      ILE  52   3.318  -0.873  -1.656
  392   3HD1  ILE  52          3HD1      ILE  52   3.057   0.794  -1.047
  393    H    ASP  53           H        ASP  53   4.793   2.548  -5.979
  394    HA   ASP  53           HA       ASP  53   6.019   3.789  -7.235
  395   1HB   ASP  53          2HB       ASP  53   7.395   3.637  -5.071
  396   2HB   ASP  53          1HB       ASP  53   8.511   2.569  -5.976
  397    H    GLY  54           H        GLY  54   5.360   1.106  -8.267
  398   1HA   GLY  54          2HA       GLY  54   5.491   0.348 -10.385
  399   2HA   GLY  54          1HA       GLY  54   7.032   1.221 -10.637
  400    H    VAL  55           H        VAL  55   7.139  -0.591  -7.702
  401    HA   VAL  55           HA       VAL  55   8.521  -2.725  -9.142
  402    HB   VAL  55           HB       VAL  55   9.040  -1.686  -6.345
  403   1HG1  VAL  55          1HG1      VAL  55   9.619  -4.108  -6.632
  404   2HG1  VAL  55          2HG1      VAL  55  11.122  -3.128  -6.629
  405   3HG1  VAL  55          3HG1      VAL  55  10.453  -3.742  -8.183
  406   1HG2  VAL  55          1HG2      VAL  55   9.711   0.034  -7.999
  407   2HG2  VAL  55          2HG2      VAL  55  10.539  -1.221  -9.006
  408   3HG2  VAL  55          3HG2      VAL  55  11.172  -0.806  -7.373
  409    H    ASN  56           H        ASN  56   7.908  -4.836  -8.733
  410    HA   ASN  56           HA       ASN  56   5.441  -5.078  -7.375
  411   1HB   ASN  56          2HB       ASN  56   5.263  -7.251  -8.338
  412   2HB   ASN  56          1HB       ASN  56   5.865  -6.077  -9.557
  413   1HD2  ASN  56          1HD2      ASN  56   6.344  -9.198  -8.413
  414   2HD2  ASN  56          2HD2      ASN  56   7.852  -9.418  -9.260
  415    H    THR  57           H        THR  57   4.778  -6.394  -5.741
  416    HA   THR  57           HA       THR  57   6.486  -6.308  -3.580
  417    HB   THR  57           HB       THR  57   4.461  -7.153  -2.364
  418    HG1  THR  57           1HG      THR  57   2.580  -6.958  -3.863
  419   1HG2  THR  57          1HG2      THR  57   3.225  -5.048  -2.781
  420   2HG2  THR  57          2HG2      THR  57   4.070  -4.806  -4.355
  421   3HG2  THR  57          3HG2      THR  57   5.002  -4.735  -2.817
  422    H    ASP  58           H        ASP  58   6.139  -8.958  -5.722
  423    HA   ASP  58           HA       ASP  58   5.825 -11.104  -4.212
  424   1HB   ASP  58          2HB       ASP  58   7.758 -10.659  -6.567
  425   2HB   ASP  58          1HB       ASP  58   7.281 -12.283  -5.958
  426    H    THR  59           H        THR  59   8.840  -9.322  -4.434
  427    HA   THR  59           HA       THR  59  10.070 -11.285  -2.629
  428    HB   THR  59           HB       THR  59  11.111 -10.907  -4.869
  429    HG1  THR  59           1HG      THR  59  12.592 -10.221  -2.575
  430   1HG2  THR  59          1HG2      THR  59  11.864  -8.130  -3.706
  431   2HG2  THR  59          2HG2      THR  59  10.703  -8.419  -5.062
  432   3HG2  THR  59          3HG2      THR  59  12.434  -8.858  -5.243
  433    H    MET  60           H        MET  60   8.378  -8.487  -2.141
  434    HA   MET  60           HA       MET  60  10.316  -7.250  -0.410
  435   1HB   MET  60          2HB       MET  60   7.816  -6.654  -2.008
  436   2HB   MET  60          1HB       MET  60   8.241  -5.571  -0.626
  437   1HG   MET  60          2HG       MET  60  10.447  -5.099  -1.707
  438   2HG   MET  60          1HG       MET  60  10.072  -6.245  -3.018
  439   1HE   MET  60          1HE       MET  60   7.855  -2.260  -2.175
  440   2HE   MET  60          2HE       MET  60   9.098  -3.033  -1.137
  441   3HE   MET  60          3HE       MET  60   7.448  -3.753  -1.288
  442    H    THR  61           H        THR  61   9.792  -6.696   1.664
  443    HA   THR  61           HA       THR  61   7.839  -8.408   2.960
  444    HB   THR  61           HB       THR  61   9.228  -8.246   4.896
  445    HG1  THR  61           1HG      THR  61  11.211  -7.089   4.658
  446   1HG2  THR  61          1HG2      THR  61   9.900  -9.747   2.876
  447   2HG2  THR  61          2HG2      THR  61  11.249  -9.307   3.981
  448   3HG2  THR  61          3HG2      THR  61  11.062  -8.456   2.407
  449    H    HIS  62           H        HIS  62   7.095  -7.418   5.163
  450    HA   HIS  62           HA       HIS  62   5.566  -5.181   4.808
  451   1HB   HIS  62          2HB       HIS  62   5.321  -6.972   6.498
  452   2HB   HIS  62          1HB       HIS  62   6.741  -6.356   7.387
  453    HD1  HIS  62           1HD      HIS  62   3.451  -6.603   7.978
  454    HD2  HIS  62           2HD      HIS  62   5.988  -3.270   8.021
  455    HE1  HIS  62           1HE      HIS  62   2.461  -4.884   9.597
  456    H    LEU  63           H        LEU  63   8.820  -5.355   6.281
  457    HA   LEU  63           HA       LEU  63   9.119  -2.650   6.838
  458   1HB   LEU  63          2HB       LEU  63  10.584  -4.450   7.714
  459   2HB   LEU  63          1HB       LEU  63  11.176  -4.771   6.051
  460    HG   LEU  63           HG       LEU  63  12.087  -2.394   5.986
  461   1HD1  LEU  63          1HD1      LEU  63  10.713  -1.323   7.773
  462   2HD1  LEU  63          2HD1      LEU  63  12.466  -1.215   8.161
  463   3HD1  LEU  63          3HD1      LEU  63  11.434  -2.423   9.006
  464   1HD2  LEU  63          1HD2      LEU  63  13.480  -4.347   6.364
  465   2HD2  LEU  63          2HD2      LEU  63  13.149  -4.281   8.152
  466   3HD2  LEU  63          3HD2      LEU  63  14.076  -2.946   7.347
  467    H    GLU  64           H        GLU  64  10.077  -4.480   3.911
  468    HA   GLU  64           HA       GLU  64  11.269  -2.438   2.532
  469   1HB   GLU  64          2HB       GLU  64   9.873  -5.013   2.039
  470   2HB   GLU  64          1HB       GLU  64   9.993  -4.121   0.548
  471   1HG   GLU  64          2HG       GLU  64  12.279  -5.047   2.430
  472   2HG   GLU  64          1HG       GLU  64  11.926  -5.675   0.782
  473    H    ALA  65           H        ALA  65   7.833  -3.437   2.314
  474    HA   ALA  65           HA       ALA  65   7.164  -1.404   0.495
  475   1HB   ALA  65          1HB       ALA  65   6.001  -3.557   0.816
  476   2HB   ALA  65          2HB       ALA  65   4.830  -2.179   0.992
  477   3HB   ALA  65          3HB       ALA  65   5.465  -3.048   2.456
  478    H    GLN  66           H        GLN  66   6.994  -1.507   4.054
  479    HA   GLN  66           HA       GLN  66   5.753   0.922   4.483
  480   1HB   GLN  66          2HB       GLN  66   6.172  -0.794   6.218
  481   2HB   GLN  66          1HB       GLN  66   7.911  -0.658   5.952
  482   1HG   GLN  66          2HG       GLN  66   7.497   0.374   8.007
  483   2HG   GLN  66          1HG       GLN  66   7.915   1.688   6.884
  484   1HE2  GLN  66          1HE2      GLN  66   4.637   0.532   6.414
  485   2HE2  GLN  66          2HE2      GLN  66   3.861   1.772   7.372
  486    H    ASN  67           H        ASN  67   9.214   0.162   4.035
  487    HA   ASN  67           HA       ASN  67  10.096   2.816   4.103
  488   1HB   ASN  67          2HB       ASN  67  11.174   0.110   3.220
  489   2HB   ASN  67          1HB       ASN  67  12.114   1.562   2.760
  490   1HD2  ASN  67          1HD2      ASN  67  13.339  -0.233   4.386
  491   2HD2  ASN  67          2HD2      ASN  67  13.437   0.385   6.015
  492    H    LYS  68           H        LYS  68   8.910   0.916   1.319
  493    HA   LYS  68           HA       LYS  68   9.667   2.871  -0.542
  494   1HB   LYS  68          2HB       LYS  68   7.263   0.984  -0.678
  495   2HB   LYS  68          1HB       LYS  68   7.955   1.919  -2.035
  496   1HG   LYS  68          2HG       LYS  68   9.201  -0.505  -0.627
  497   2HG   LYS  68          1HG       LYS  68   8.570  -0.340  -2.276
  498   1HD   LYS  68          2HD       LYS  68  10.400   1.270  -2.854
  499   2HD   LYS  68          1HD       LYS  68  11.062   1.049  -1.196
  500   1HE   LYS  68          2HE       LYS  68  11.233  -1.443  -1.637
  501   2HE   LYS  68          1HE       LYS  68  10.705  -1.166  -3.340
  502   1HZ   LYS  68          1HZ       LYS  68  12.723   0.008  -3.776
  503   2HZ   LYS  68          2HZ       LYS  68  13.126  -1.346  -2.890
  504   3HZ   LYS  68          3HZ       LYS  68  13.078   0.173  -2.131
  505    H    ILE  69           H        ILE  69   6.420   2.376   1.035
  506    HA   ILE  69           HA       ILE  69   5.214   4.635   0.294
  507    HB   ILE  69           HB       ILE  69   5.236   2.770   2.655
  508   1HG1  ILE  69          2HG1      ILE  69   3.169   3.395   0.484
  509   2HG1  ILE  69          1HG1      ILE  69   4.384   2.198   0.148
  510   1HG2  ILE  69          1HG2      ILE  69   4.321   5.065   3.432
  511   2HG2  ILE  69          2HG2      ILE  69   3.187   3.689   3.535
  512   3HG2  ILE  69          3HG2      ILE  69   3.065   4.862   2.148
  513   1HD1  ILE  69          1HD1      ILE  69   3.629   0.717   1.970
  514   2HD1  ILE  69          2HD1      ILE  69   2.204   1.185   0.959
  515   3HD1  ILE  69          3HD1      ILE  69   2.477   1.965   2.556
  516    H    LYS  70           H        LYS  70   7.067   4.403   3.420
  517    HA   LYS  70           HA       LYS  70   6.422   7.098   3.915
  518   1HB   LYS  70          2HB       LYS  70   7.692   4.842   5.343
  519   2HB   LYS  70          1HB       LYS  70   8.325   6.422   5.816
  520   1HG   LYS  70          2HG       LYS  70   6.596   5.742   7.294
  521   2HG   LYS  70          1HG       LYS  70   6.140   7.259   6.462
  522   1HD   LYS  70          2HD       LYS  70   4.465   6.140   5.138
  523   2HD   LYS  70          1HD       LYS  70   5.199   4.532   5.448
  524   1HE   LYS  70          2HE       LYS  70   3.109   4.651   6.635
  525   2HE   LYS  70          1HE       LYS  70   4.442   4.635   7.848
  526   1HZ   LYS  70          1HZ       LYS  70   2.953   7.064   6.924
  527   2HZ   LYS  70          2HZ       LYS  70   4.190   7.028   8.069
  528   3HZ   LYS  70          3HZ       LYS  70   2.727   6.288   8.389
  529    H    SER  71           H        SER  71   8.598   6.246   1.669
  530    HA   SER  71           HA       SER  71  10.412   8.443   2.409
  531   1HB   SER  71          2HB       SER  71  12.060   7.489   0.853
  532   2HB   SER  71          1HB       SER  71  11.701   6.399   2.215
  533    HG   SER  71           HG       SER  71  10.714   5.048   0.928
  534    H    ALA  72           H        ALA  72   7.636   7.992   0.841
  535    HA   ALA  72           HA       ALA  72   8.393   9.775  -1.368
  536   1HB   ALA  72          1HB       ALA  72   7.361   7.556  -1.977
  537   2HB   ALA  72          2HB       ALA  72   6.319   8.948  -2.464
  538   3HB   ALA  72          3HB       ALA  72   5.939   7.973  -0.977
  539    H    SER  73           H        SER  73   7.435  11.743  -1.533
  540    HA   SER  73           HA       SER  73   5.129  12.302   0.155
  541   1HB   SER  73          2HB       SER  73   5.846  14.457   0.879
  542   2HB   SER  73          1HB       SER  73   6.874  13.164   1.566
  543    HG   SER  73           HG       SER  73   8.010  14.999   0.800
  544    H    TYR  74           H        TYR  74   7.321  13.549  -2.359
  545    HA   TYR  74           HA       TYR  74   5.486  15.338  -3.395
  546   1HB   TYR  74          2HB       TYR  74   8.148  14.333  -4.070
  547   2HB   TYR  74          1HB       TYR  74   7.197  14.442  -5.574
  548    HD1  TYR  74           1HD      TYR  74   5.535  16.717  -5.356
  549    HD2  TYR  74           2HD      TYR  74   9.505  16.160  -3.955
  550    HE1  TYR  74           1HE      TYR  74   5.930  19.115  -5.540
  551    HE2  TYR  74           2HE      TYR  74   9.916  18.559  -4.141
  552    HH   TYR  74           HH       TYR  74   9.078  20.558  -4.776
  553    H    ASN  75           H        ASN  75   5.994  11.918  -4.296
  554    HA   ASN  75           HA       ASN  75   3.254  11.750  -4.547
  555   1HB   ASN  75          2HB       ASN  75   3.148  10.837  -6.977
  556   2HB   ASN  75          1HB       ASN  75   3.185  12.610  -6.725
  557   1HD2  ASN  75          1HD2      ASN  75   5.902  10.174  -6.746
  558   2HD2  ASN  75          2HD2      ASN  75   6.579  10.785  -8.239
  559    H    LEU  76           H        LEU  76   2.499   9.716  -4.263
  560    HA   LEU  76           HA       LEU  76   4.464   7.523  -4.350
  561   1HB   LEU  76          2HB       LEU  76   3.663   8.174  -2.066
  562   2HB   LEU  76          1HB       LEU  76   1.985   8.043  -2.609
  563    HG   LEU  76           HG       LEU  76   2.183   5.603  -2.892
  564   1HD1  LEU  76          1HD1      LEU  76   5.086   5.923  -1.877
  565   2HD1  LEU  76          2HD1      LEU  76   4.601   5.344  -3.520
  566   3HD1  LEU  76          3HD1      LEU  76   4.203   4.369  -2.059
  567   1HD2  LEU  76          1HD2      LEU  76   2.251   5.022  -0.542
  568   2HD2  LEU  76          2HD2      LEU  76   1.627   6.714  -0.646
  569   3HD2  LEU  76          3HD2      LEU  76   3.337   6.403  -0.169
  570    H    SER  77           H        SER  77   3.993   6.085  -6.037
  571    HA   SER  77           HA       SER  77   1.189   5.943  -6.903
  572   1HB   SER  77          2HB       SER  77   3.705   4.990  -8.338
  573   2HB   SER  77          1HB       SER  77   2.020   4.708  -8.891
  574    HG   SER  77           HG       SER  77   2.859   6.498  -9.890
  575    H    LEU  78           H        LEU  78  -0.030   4.265  -6.398
  576    HA   LEU  78           HA       LEU  78   1.258   1.801  -5.501
  577   1HB   LEU  78          2HB       LEU  78  -1.541   2.863  -4.840
  578   2HB   LEU  78          1HB       LEU  78  -0.703   1.472  -4.109
  579    HG   LEU  78           HG       LEU  78  -0.749   3.138  -2.496
  580   1HD1  LEU  78          1HD1      LEU  78   1.582   3.560  -1.940
  581   2HD1  LEU  78          2HD1      LEU  78   2.098   3.255  -3.642
  582   3HD1  LEU  78          3HD1      LEU  78   1.377   1.928  -2.648
  583   1HD2  LEU  78          1HD2      LEU  78  -0.144   5.437  -2.597
  584   2HD2  LEU  78          2HD2      LEU  78  -1.339   5.086  -3.901
  585   3HD2  LEU  78          3HD2      LEU  78   0.399   5.304  -4.307
  586    H    THR  79           H        THR  79   0.490  -0.164  -6.380
  587    HA   THR  79           HA       THR  79  -2.063  -0.067  -7.757
  588    HB   THR  79           HB       THR  79   0.400  -1.628  -8.665
  589    HG1  THR  79           1HG      THR  79  -1.078   0.349 -10.047
  590   1HG2  THR  79          1HG2      THR  79  -2.473  -1.444  -9.792
  591   2HG2  THR  79          2HG2      THR  79  -1.717  -2.893  -9.027
  592   3HG2  THR  79          3HG2      THR  79  -1.077  -2.277 -10.593
  593    H    LEU  80           H        LEU  80  -3.369  -1.351  -6.465
  594    HA   LEU  80           HA       LEU  80  -2.403  -3.953  -5.588
  595   1HB   LEU  80          2HB       LEU  80  -3.688  -3.790  -3.569
  596   2HB   LEU  80          1HB       LEU  80  -2.511  -2.418  -3.628
  597    HG   LEU  80           HG       LEU  80  -5.477  -2.411  -4.249
  598   1HD1  LEU  80          1HD1      LEU  80  -4.784  -2.720  -1.849
  599   2HD1  LEU  80          2HD1      LEU  80  -5.700  -1.149  -2.140
  600   3HD1  LEU  80          3HD1      LEU  80  -3.866  -1.145  -1.955
  601   1HD2  LEU  80          1HD2      LEU  80  -3.204  -0.379  -4.341
  602   2HD2  LEU  80          2HD2      LEU  80  -4.868   0.268  -3.899
  603   3HD2  LEU  80          3HD2      LEU  80  -4.594  -0.551  -5.515
  604    H    GLN  81           H        GLN  81  -4.395  -5.382  -5.148
  605    HA   GLN  81           HA       GLN  81  -6.004  -5.220  -7.471
  606   1HB   GLN  81          2HB       GLN  81  -6.274  -7.178  -5.190
  607   2HB   GLN  81          1HB       GLN  81  -6.959  -7.282  -6.855
  608   1HG   GLN  81          2HG       GLN  81  -4.580  -7.243  -7.769
  609   2HG   GLN  81          1HG       GLN  81  -3.974  -7.381  -6.069
  610   1HE2  GLN  81          1HE2      GLN  81  -3.027  -9.386  -7.335
  611   2HE2  GLN  81          2HE2      GLN  81  -4.002 -10.824  -7.304
  612    H    LYS  82           H        LYS  82  -8.351  -5.239  -7.600
  613    HA   LYS  82           HA       LYS  82  -9.499  -3.339  -5.829
  614   1HB   LYS  82          2HB       LYS  82  -9.677  -3.766  -8.494
  615   2HB   LYS  82          1HB       LYS  82 -11.049  -4.781  -8.006
  616   1HG   LYS  82          2HG       LYS  82 -11.927  -2.565  -8.480
  617   2HG   LYS  82          1HG       LYS  82 -11.905  -2.700  -6.693
  618   1HD   LYS  82          2HD       LYS  82  -9.391  -1.768  -7.095
  619   2HD   LYS  82          1HD       LYS  82 -10.118  -1.101  -8.575
  620   1HE   LYS  82          2HE       LYS  82 -11.226  -0.637  -5.715
  621   2HE   LYS  82          1HE       LYS  82 -10.072   0.490  -6.526
  622   1HZ   LYS  82          1HZ       LYS  82 -12.810  -0.187  -7.493
  623   2HZ   LYS  82          2HZ       LYS  82 -11.698   0.835  -8.283
  624   3HZ   LYS  82          3HZ       LYS  82 -12.321   1.233  -6.770
  625    H    SER  83           H        SER  83  -8.908  -5.986  -4.775
  626    HA   SER  83           HA       SER  83  -9.679  -7.507  -3.450
  627   1HB   SER  83          2HB       SER  83 -10.471  -5.245  -2.418
  628   2HB   SER  83          1HB       SER  83 -12.122  -5.832  -2.755
  629    HG   SER  83           HG       SER  83 -10.044  -6.914  -1.183
  630    H    LYS  84           H        LYS  84 -10.013  -8.958  -5.244
  631    HA   LYS  84           HA       LYS  84 -12.835  -9.584  -5.749
  632   1HB   LYS  84          2HB       LYS  84 -10.263 -10.090  -7.292
  633   2HB   LYS  84          1HB       LYS  84 -11.750 -11.018  -7.645
  634   1HG   LYS  84          2HG       LYS  84 -11.709  -7.954  -7.716
  635   2HG   LYS  84          1HG       LYS  84 -11.259  -8.978  -9.121
  636   1HD   LYS  84          2HD       LYS  84 -13.431 -10.097  -9.117
  637   2HD   LYS  84          1HD       LYS  84 -13.937  -9.218  -7.641
  638   1HE   LYS  84          2HE       LYS  84 -13.953  -7.064  -8.835
  639   2HE   LYS  84          1HE       LYS  84 -13.338  -7.847 -10.350
  640   1HZ   LYS  84          1HZ       LYS  84 -15.782  -8.869  -9.039
  641   2HZ   LYS  84          2HZ       LYS  84 -15.339  -8.963 -10.642
  642   3HZ   LYS  84          3HZ       LYS  84 -15.882  -7.496 -10.029
  643    H    ARG  85           H        ARG  85 -13.668 -11.522  -5.148
  644    HA   ARG  85           HA       ARG  85 -11.881 -13.660  -4.490
  645   1HB   ARG  85          2HB       ARG  85 -12.369 -12.087  -2.350
  646   2HB   ARG  85          1HB       ARG  85 -13.926 -12.944  -2.366
  647   1HG   ARG  85          2HG       ARG  85 -12.837 -14.495  -1.094
  648   2HG   ARG  85          1HG       ARG  85 -12.164 -15.079  -2.638
  649   1HD   ARG  85          2HD       ARG  85 -10.849 -13.234  -0.546
  650   2HD   ARG  85          1HD       ARG  85 -10.331 -14.891  -1.058
  651    HE   ARG  85           HE       ARG  85 -10.432 -12.941  -3.279
  652   1HH1  ARG  85          1HH1      ARG  85  -8.264 -14.023  -0.696
  653   2HH1  ARG  85          2HH1      ARG  85  -6.959 -13.112  -1.265
  654   1HH2  ARG  85          1HH2      ARG  85  -8.839 -11.663  -3.903
  655   2HH2  ARG  85          2HH2      ARG  85  -7.487 -11.353  -2.902
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1 -10.296  -5.303 -10.680
    2   2H    MET   1          2HT       MET   1 -10.348  -6.796  -9.876
    3   3H    MET   1          3HT       MET   1 -10.707  -6.694 -11.523
    4    HA   MET   1           HA       MET   1  -8.441  -7.556 -10.909
    5   1HB   MET   1          2HB       MET   1  -9.171  -6.497 -13.160
    6   2HB   MET   1          1HB       MET   1  -8.395  -5.002 -12.614
    7   1HG   MET   1          2HG       MET   1  -6.250  -6.634 -12.321
    8   2HG   MET   1          1HG       MET   1  -7.224  -7.752 -13.307
    9   1HE   MET   1          1HE       MET   1  -4.571  -7.259 -14.324
   10   2HE   MET   1          2HE       MET   1  -4.811  -6.752 -16.031
   11   3HE   MET   1          3HE       MET   1  -5.856  -8.028 -15.317
   12    H    ALA   2           H        ALA   2  -6.743  -4.710 -11.412
   13    HA   ALA   2           HA       ALA   2  -6.675  -4.038  -8.574
   14   1HB   ALA   2          1HB       ALA   2  -4.738  -5.517  -8.970
   15   2HB   ALA   2          2HB       ALA   2  -4.180  -3.823  -8.734
   16   3HB   ALA   2          3HB       ALA   2  -4.243  -4.526 -10.399
   17    H    TYR   3           H        TYR   3  -6.213  -1.964  -8.045
   18    HA   TYR   3           HA       TYR   3  -6.647  -0.111 -10.276
   19   1HB   TYR   3          2HB       TYR   3  -7.962   1.283  -9.118
   20   2HB   TYR   3          1HB       TYR   3  -8.588  -0.337  -8.713
   21    HD1  TYR   3           1HD      TYR   3  -8.201   2.686  -7.491
   22    HD2  TYR   3           2HD      TYR   3  -7.084  -1.269  -6.413
   23    HE1  TYR   3           1HE      TYR   3  -8.356   3.295  -5.123
   24    HE2  TYR   3           2HE      TYR   3  -7.260  -0.691  -4.070
   25    HH   TYR   3           HH       TYR   3  -8.809   2.205  -3.020
   26    H    SER   4           H        SER   4  -5.538   1.838 -10.334
   27    HA   SER   4           HA       SER   4  -3.089   1.800  -8.696
   28   1HB   SER   4          2HB       SER   4  -3.408   2.555 -11.647
   29   2HB   SER   4          1HB       SER   4  -1.932   2.851 -10.662
   30    HG   SER   4           HG       SER   4  -3.062   0.384 -11.451
   31    H    VAL   5           H        VAL   5  -2.795   3.595  -7.475
   32    HA   VAL   5           HA       VAL   5  -3.750   6.134  -8.536
   33    HB   VAL   5           HB       VAL   5  -5.390   6.115  -6.978
   34   1HG1  VAL   5          1HG1      VAL   5  -5.507   4.818  -5.023
   35   2HG1  VAL   5          2HG1      VAL   5  -3.786   4.242  -5.179
   36   3HG1  VAL   5          3HG1      VAL   5  -5.076   3.738  -6.359
   37   1HG2  VAL   5          1HG2      VAL   5  -4.828   7.318  -5.023
   38   2HG2  VAL   5          2HG2      VAL   5  -3.777   7.927  -6.352
   39   3HG2  VAL   5          3HG2      VAL   5  -3.100   6.830  -5.092
   40    H    THR   6           H        THR   6  -2.256   7.620  -8.595
   41    HA   THR   6           HA       THR   6   0.186   7.236  -7.027
   42    HB   THR   6           HB       THR   6  -0.385   9.315  -9.133
   43    HG1  THR   6           1HG      THR   6  -0.357   7.574 -10.231
   44   1HG2  THR   6          1HG2      THR   6   1.534   9.860  -7.545
   45   2HG2  THR   6          2HG2      THR   6   2.163   9.428  -9.164
   46   3HG2  THR   6          3HG2      THR   6   2.242   8.225  -7.841
   47    H    LEU   7           H        LEU   7   0.176   8.121  -5.071
   48    HA   LEU   7           HA       LEU   7  -1.545  10.397  -4.539
   49   1HB   LEU   7          2HB       LEU   7  -1.655   8.307  -3.202
   50   2HB   LEU   7          1HB       LEU   7   0.056   8.502  -2.754
   51    HG   LEU   7           HG       LEU   7  -0.496  10.586  -1.510
   52   1HD1  LEU   7          1HD1      LEU   7  -3.405  10.019  -2.363
   53   2HD1  LEU   7          2HD1      LEU   7  -2.433  11.492  -2.711
   54   3HD1  LEU   7          3HD1      LEU   7  -2.924  11.128  -1.025
   55   1HD2  LEU   7          1HD2      LEU   7  -1.883   9.402   0.305
   56   2HD2  LEU   7          2HD2      LEU   7  -0.441   8.495  -0.279
   57   3HD2  LEU   7          3HD2      LEU   7  -2.076   8.024  -0.843
   58    H    THR   8           H        THR   8  -0.813  12.346  -3.699
   59    HA   THR   8           HA       THR   8   2.065  12.802  -3.702
   60    HB   THR   8           HB       THR   8   1.416  15.217  -4.372
   61    HG1  THR   8           1HG      THR   8  -0.571  13.885  -5.790
   62   1HG2  THR   8          1HG2      THR   8   1.596  14.628  -6.781
   63   2HG2  THR   8          2HG2      THR   8   1.302  12.885  -6.395
   64   3HG2  THR   8          3HG2      THR   8   2.769  13.726  -5.757
   65    H    GLY   9           H        GLY   9   2.829  14.252  -2.191
   66   1HA   GLY   9          2HA       GLY   9   2.505  16.133  -0.935
   67   2HA   GLY   9          1HA       GLY   9   0.831  15.661  -0.594
   68    HA   PRO  10           HA       PRO  10   3.876  13.061   1.821
   69   1HB   PRO  10          2HB       PRO  10   5.720  14.406   3.446
   70   2HB   PRO  10          1HB       PRO  10   5.992  14.014   1.714
   71   1HG   PRO  10          2HG       PRO  10   4.885  16.643   2.867
   72   2HG   PRO  10          1HG       PRO  10   6.275  16.433   1.716
   73   1HD   PRO  10          2HD       PRO  10   3.729  17.000   0.819
   74   2HD   PRO  10          1HD       PRO  10   4.759  15.798  -0.087
   75    H    GLY  11           H        GLY  11   3.748  12.046   3.763
   76   1HA   GLY  11          2HA       GLY  11   3.417  13.135   6.205
   77   2HA   GLY  11          1HA       GLY  11   1.747  12.844   5.535
   78    HA   PRO  12           HA       PRO  12   3.278   8.737   6.784
   79   1HB   PRO  12          2HB       PRO  12   1.650   8.148   8.910
   80   2HB   PRO  12          1HB       PRO  12   3.112   9.189   9.098
   81   1HG   PRO  12          2HG       PRO  12   0.222  10.143   8.684
   82   2HG   PRO  12          1HG       PRO  12   1.379  10.647   9.988
   83   1HD   PRO  12          2HD       PRO  12   1.056  12.092   7.632
   84   2HD   PRO  12          1HD       PRO  12   2.688  11.939   8.431
   85    H    TRP  13           H        TRP  13   0.646  10.245   5.528
   86    HA   TRP  13           HA       TRP  13  -0.830   9.707   4.091
   87   1HB   TRP  13          2HB       TRP  13   0.171   6.846   3.980
   88   2HB   TRP  13          1HB       TRP  13  -0.798   7.618   2.775
   89    HD1  TRP  13           HD       TRP  13   2.695   6.940   3.711
   90    HE1  TRP  13           1HE      TRP  13   4.322   8.125   2.074
   91    HE3  TRP  13           3HE      TRP  13  -0.490  10.397   1.835
   92    HZ2  TRP  13           2HZ      TRP  13   4.212  10.255   0.261
   93    HZ3  TRP  13           3HZ      TRP  13   0.331  11.989   0.172
   94    HH2  TRP  13           HH       TRP  13   2.632  11.916  -0.620
   95    H    GLY  14           H        GLY  14  -0.846   7.050   6.430
   96   1HA   GLY  14          2HA       GLY  14  -2.452   7.216   8.123
   97   2HA   GLY  14          1HA       GLY  14  -3.669   7.752   6.929
   98    H    PHE  15           H        PHE  15  -1.522   4.938   6.608
   99    HA   PHE  15           HA       PHE  15  -3.848   3.174   6.933
  100   1HB   PHE  15          2HB       PHE  15  -3.094   1.987   4.865
  101   2HB   PHE  15          1HB       PHE  15  -3.286   3.712   4.491
  102    HD1  PHE  15           1HD      PHE  15  -1.248   5.149   4.385
  103    HD2  PHE  15           2HD      PHE  15  -0.990   0.937   4.861
  104    HE1  PHE  15           1HE      PHE  15   1.251   5.264   4.382
  105    HE2  PHE  15           2HE      PHE  15   1.404   1.039   4.433
  106    HZ   PHE  15           HZ       PHE  15   2.552   3.205   4.431
  107    H    ARG  16           H        ARG  16  -3.333   0.864   7.191
  108    HA   ARG  16           HA       ARG  16  -1.126   0.708   9.069
  109   1HB   ARG  16          2HB       ARG  16  -3.973  -0.383   9.120
  110   2HB   ARG  16          1HB       ARG  16  -2.710  -1.264  10.021
  111   1HG   ARG  16          2HG       ARG  16  -3.327   1.708  10.403
  112   2HG   ARG  16          1HG       ARG  16  -4.088   0.393  11.362
  113   1HD   ARG  16          2HD       ARG  16  -1.835  -0.282  12.246
  114   2HD   ARG  16          1HD       ARG  16  -1.060   1.031  11.252
  115    HE   ARG  16           HE       ARG  16  -2.799   2.578  12.559
  116   1HH1  ARG  16          1HH1      ARG  16  -0.903  -0.064  14.142
  117   2HH1  ARG  16          2HH1      ARG  16  -1.261   0.581  15.701
  118   1HH2  ARG  16          1HH2      ARG  16  -3.081   3.366  14.542
  119   2HH2  ARG  16          2HH2      ARG  16  -2.454   2.562  15.949
  120    H    LEU  17           H        LEU  17   0.171  -1.193   9.021
  121    HA   LEU  17           HA       LEU  17  -0.223  -2.677   6.544
  122   1HB   LEU  17          2HB       LEU  17   2.377  -2.051   8.003
  123   2HB   LEU  17          1HB       LEU  17   2.200  -3.065   6.536
  124    HG   LEU  17           HG       LEU  17   0.896  -0.922   5.592
  125   1HD1  LEU  17          1HD1      LEU  17   2.382   1.133   6.481
  126   2HD1  LEU  17          2HD1      LEU  17   2.468   0.111   7.978
  127   3HD1  LEU  17          3HD1      LEU  17   0.865   0.611   7.290
  128   1HD2  LEU  17          1HD2      LEU  17   2.677  -1.810   4.362
  129   2HD2  LEU  17          2HD2      LEU  17   3.900  -1.489   5.632
  130   3HD2  LEU  17          3HD2      LEU  17   3.179  -0.118   4.686
  131    H    GLN  18           H        GLN  18  -0.255  -4.885   6.520
  132    HA   GLN  18           HA       GLN  18   0.545  -6.358   8.889
  133   1HB   GLN  18          2HB       GLN  18  -2.243  -6.309   7.644
  134   2HB   GLN  18          1HB       GLN  18  -1.654  -7.696   8.640
  135   1HG   GLN  18          2HG       GLN  18  -1.289  -6.076  10.554
  136   2HG   GLN  18          1HG       GLN  18  -2.059  -4.784   9.582
  137   1HE2  GLN  18          1HE2      GLN  18  -3.989  -7.138   8.458
  138   2HE2  GLN  18          2HE2      GLN  18  -5.059  -7.396   9.795
  139    H    GLY  19           H        GLY  19   1.459  -8.279   8.362
  140   1HA   GLY  19          2HA       GLY  19   2.067 -10.036   7.213
  141   2HA   GLY  19          1HA       GLY  19   0.771  -9.709   6.024
  142    H    GLY  20           H        GLY  20   3.016 -10.921   5.131
  143   1HA   GLY  20          2HA       GLY  20   3.655  -9.408   2.990
  144   2HA   GLY  20          1HA       GLY  20   4.958  -9.109   4.207
  145    H    LYS  21           H        LYS  21   6.019 -10.182   2.087
  146    HA   LYS  21           HA       LYS  21   5.572 -12.734   1.515
  147   1HB   LYS  21          2HB       LYS  21   7.035 -10.790   0.448
  148   2HB   LYS  21          1HB       LYS  21   8.388 -11.569   1.292
  149   1HG   LYS  21          2HG       LYS  21   8.274 -12.318  -1.002
  150   2HG   LYS  21          1HG       LYS  21   7.829 -13.722   0.005
  151   1HD   LYS  21          2HD       LYS  21   5.530 -11.972  -0.797
  152   2HD   LYS  21          1HD       LYS  21   6.408 -12.664  -2.195
  153   1HE   LYS  21          2HE       LYS  21   5.998 -14.959  -1.487
  154   2HE   LYS  21          1HE       LYS  21   5.379 -14.418   0.122
  155   1HZ   LYS  21          1HZ       LYS  21   4.074 -13.924  -2.517
  156   2HZ   LYS  21          2HZ       LYS  21   3.536 -13.322  -1.019
  157   3HZ   LYS  21          3HZ       LYS  21   3.617 -14.992  -1.311
  158    H    ASP  22           H        ASP  22   7.610 -11.701   4.209
  159    HA   ASP  22           HA       ASP  22   8.918 -14.187   4.371
  160   1HB   ASP  22          2HB       ASP  22  10.223 -13.260   5.982
  161   2HB   ASP  22          1HB       ASP  22   9.676 -11.823   5.100
  162    H    PHE  23           H        PHE  23   5.818 -13.186   5.367
  163    HA   PHE  23           HA       PHE  23   5.476 -15.379   7.241
  164   1HB   PHE  23          2HB       PHE  23   3.874 -12.978   6.254
  165   2HB   PHE  23          1HB       PHE  23   2.953 -14.382   6.855
  166    HD1  PHE  23           1HD      PHE  23   2.254 -14.223   8.946
  167    HD2  PHE  23           2HD      PHE  23   5.991 -12.434   7.977
  168    HE1  PHE  23           1HE      PHE  23   2.465 -13.425  11.242
  169    HE2  PHE  23           2HE      PHE  23   6.214 -11.659  10.278
  170    HZ   PHE  23           HZ       PHE  23   4.452 -12.138  11.917
  171    H    ASN  24           H        ASN  24   5.665 -15.124   3.985
  172    HA   ASN  24           HA       ASN  24   5.084 -16.200   2.269
  173   1HB   ASN  24          2HB       ASN  24   5.003 -18.248   3.981
  174   2HB   ASN  24          1HB       ASN  24   3.256 -18.217   3.607
  175   1HD2  ASN  24          1HD2      ASN  24   6.501 -18.874   2.430
  176   2HD2  ASN  24          2HD2      ASN  24   6.074 -19.423   0.832
  177    H    MET  25           H        MET  25   3.507 -13.980   3.394
  178    HA   MET  25           HA       MET  25   0.848 -14.581   2.417
  179   1HB   MET  25          2HB       MET  25   2.106 -12.963   4.506
  180   2HB   MET  25          1HB       MET  25   0.928 -11.983   3.625
  181   1HG   MET  25          2HG       MET  25  -0.116 -13.019   5.553
  182   2HG   MET  25          1HG       MET  25  -0.843 -13.681   4.067
  183   1HE   MET  25          1HE       MET  25  -1.531 -14.915   6.640
  184   2HE   MET  25          2HE       MET  25  -1.300 -16.673   6.360
  185   3HE   MET  25          3HE       MET  25  -1.984 -15.642   5.061
  186    HA   PRO  26           HA       PRO  26   1.447 -11.453  -0.773
  187   1HB   PRO  26          2HB       PRO  26  -1.166 -10.191  -0.587
  188   2HB   PRO  26          1HB       PRO  26  -0.682 -11.535  -1.645
  189   1HG   PRO  26          2HG       PRO  26  -2.496 -11.677   0.634
  190   2HG   PRO  26          1HG       PRO  26  -1.946 -12.989  -0.466
  191   1HD   PRO  26          2HD       PRO  26  -0.864 -12.011   2.225
  192   2HD   PRO  26          1HD       PRO  26  -0.865 -13.725   1.650
  193    H    LEU  27           H        LEU  27   1.795  -8.975  -0.826
  194    HA   LEU  27           HA       LEU  27   2.240  -8.083   1.852
  195   1HB   LEU  27          2HB       LEU  27   3.373  -7.661  -0.664
  196   2HB   LEU  27          1HB       LEU  27   2.597  -6.099  -0.319
  197    HG   LEU  27           HG       LEU  27   4.580  -7.694   1.422
  198   1HD1  LEU  27          1HD1      LEU  27   4.880  -5.061  -0.169
  199   2HD1  LEU  27          2HD1      LEU  27   5.670  -6.651  -0.520
  200   3HD1  LEU  27          3HD1      LEU  27   6.134  -5.729   0.952
  201   1HD2  LEU  27          1HD2      LEU  27   4.718  -5.665   2.913
  202   2HD2  LEU  27          2HD2      LEU  27   3.081  -6.411   2.959
  203   3HD2  LEU  27          3HD2      LEU  27   3.372  -4.914   1.986
  204    H    THR  28           H        THR  28   0.483  -7.617   2.976
  205    HA   THR  28           HA       THR  28  -1.787  -6.492   1.515
  206    HB   THR  28           HB       THR  28  -3.275  -7.391   2.751
  207    HG1  THR  28           1HG      THR  28  -1.392  -7.530   4.852
  208   1HG2  THR  28          1HG2      THR  28  -0.963  -9.371   3.245
  209   2HG2  THR  28          2HG2      THR  28  -1.520  -8.917   1.593
  210   3HG2  THR  28          3HG2      THR  28  -2.671  -9.716   2.752
  211    H    ILE  29           H        ILE  29  -2.991  -4.793   2.229
  212    HA   ILE  29           HA       ILE  29  -1.859  -3.217   4.491
  213    HB   ILE  29           HB       ILE  29  -3.533  -2.240   2.207
  214   1HG1  ILE  29          2HG1      ILE  29  -0.888  -2.773   1.927
  215   2HG1  ILE  29          1HG1      ILE  29  -1.797  -1.512   1.087
  216   1HG2  ILE  29          1HG2      ILE  29  -2.334  -0.892   4.728
  217   2HG2  ILE  29          2HG2      ILE  29  -4.090  -1.055   4.300
  218   3HG2  ILE  29          3HG2      ILE  29  -3.035   0.037   3.374
  219   1HD1  ILE  29          1HD1      ILE  29  -0.972   0.226   2.675
  220   2HD1  ILE  29          2HD1      ILE  29   0.405  -0.711   2.000
  221   3HD1  ILE  29          3HD1      ILE  29  -0.169  -1.048   3.669
  222    H    SER  30           H        SER  30  -3.285  -2.612   6.093
  223    HA   SER  30           HA       SER  30  -5.633  -4.305   6.336
  224   1HB   SER  30          2HB       SER  30  -4.084  -4.501   8.091
  225   2HB   SER  30          1HB       SER  30  -3.884  -2.746   8.271
  226    HG   SER  30           HG       SER  30  -5.193  -3.425   9.876
  227    H    ARG  31           H        ARG  31  -5.393  -1.060   7.826
  228    HA   ARG  31           HA       ARG  31  -7.748  -0.296   6.270
  229   1HB   ARG  31          2HB       ARG  31  -7.573  -0.767   9.276
  230   2HB   ARG  31          1HB       ARG  31  -8.831   0.286   8.559
  231   1HG   ARG  31          2HG       ARG  31  -9.753  -1.551   7.238
  232   2HG   ARG  31          1HG       ARG  31  -8.420  -2.634   7.731
  233   1HD   ARG  31          2HD       ARG  31 -10.394  -3.258   8.914
  234   2HD   ARG  31          1HD       ARG  31  -9.203  -2.589  10.107
  235    HE   ARG  31           HE       ARG  31 -10.930  -0.446   9.193
  236   1HH1  ARG  31          1HH1      ARG  31 -11.551  -3.602  10.732
  237   2HH1  ARG  31          2HH1      ARG  31 -12.829  -2.996  11.693
  238   1HH2  ARG  31          1HH2      ARG  31 -12.409   0.379  10.729
  239   2HH2  ARG  31          2HH2      ARG  31 -13.246  -0.710  11.776
  240    H    ILE  32           H        ILE  32  -8.417   1.828   6.471
  241    HA   ILE  32           HA       ILE  32  -6.247   3.678   6.728
  242    HB   ILE  32           HB       ILE  32  -9.062   3.699   5.692
  243   1HG1  ILE  32          2HG1      ILE  32  -8.184   4.416   3.657
  244   2HG1  ILE  32          1HG1      ILE  32  -6.711   5.088   4.343
  245   1HG2  ILE  32          1HG2      ILE  32  -7.289   6.179   6.122
  246   2HG2  ILE  32          2HG2      ILE  32  -8.921   5.914   6.903
  247   3HG2  ILE  32          3HG2      ILE  32  -8.780   6.111   5.124
  248   1HD1  ILE  32          1HD1      ILE  32  -5.832   2.684   4.714
  249   2HD1  ILE  32          2HD1      ILE  32  -6.044   3.257   3.034
  250   3HD1  ILE  32          3HD1      ILE  32  -7.279   2.139   3.753
  251    H    THR  33           H        THR  33  -6.045   5.313   8.118
  252    HA   THR  33           HA       THR  33  -7.667   5.370  10.504
  253    HB   THR  33           HB       THR  33  -5.140   6.756   9.608
  254    HG1  THR  33           1HG      THR  33  -5.256   4.679  10.700
  255   1HG2  THR  33          1HG2      THR  33  -5.226   7.949  11.892
  256   2HG2  THR  33          2HG2      THR  33  -6.988   7.516  11.972
  257   3HG2  THR  33          3HG2      THR  33  -6.389   8.586  10.681
  258    HA   PRO  34           HA       PRO  34 -10.060   8.418   8.425
  259   1HB   PRO  34          2HB       PRO  34 -11.660   9.400  10.434
  260   2HB   PRO  34          1HB       PRO  34 -11.634   7.625   9.978
  261   1HG   PRO  34          2HG       PRO  34  -9.933   8.775  12.238
  262   2HG   PRO  34          1HG       PRO  34 -11.271   7.541  12.375
  263   1HD   PRO  34          2HD       PRO  34  -8.739   6.674  11.924
  264   2HD   PRO  34          1HD       PRO  34 -10.066   5.974  10.913
  265    H    GLY  35           H        GLY  35 -10.461  10.708   8.208
  266   1HA   GLY  35          2HA       GLY  35 -10.016  12.874   8.538
  267   2HA   GLY  35          1HA       GLY  35  -8.837  12.473   9.823
  268    H    SER  36           H        SER  36  -7.456  10.610   7.908
  269    HA   SER  36           HA       SER  36  -5.689  12.695   6.939
  270   1HB   SER  36          2HB       SER  36  -5.034  10.784   8.513
  271   2HB   SER  36          1HB       SER  36  -5.093   9.709   7.090
  272    HG   SER  36           HG       SER  36  -3.063  10.656   7.666
  273    H    LYS  37           H        LYS  37  -4.215  11.501   5.075
  274    HA   LYS  37           HA       LYS  37  -5.802  12.154   2.821
  275   1HB   LYS  37          2HB       LYS  37  -2.885  11.302   3.074
  276   2HB   LYS  37          1HB       LYS  37  -3.699  11.597   1.509
  277   1HG   LYS  37          2HG       LYS  37  -2.790  13.664   1.830
  278   2HG   LYS  37          1HG       LYS  37  -4.440  13.877   2.479
  279   1HD   LYS  37          2HD       LYS  37  -3.203  13.210   4.811
  280   2HD   LYS  37          1HD       LYS  37  -1.752  13.739   3.926
  281   1HE   LYS  37          2HE       LYS  37  -4.300  15.397   4.554
  282   2HE   LYS  37          1HE       LYS  37  -2.655  15.568   5.291
  283   1HZ   LYS  37          1HZ       LYS  37  -1.881  16.029   2.943
  284   2HZ   LYS  37          2HZ       LYS  37  -2.787  17.220   3.677
  285   3HZ   LYS  37          3HZ       LYS  37  -3.515  16.232   2.523
  286    H    ALA  38           H        ALA  38  -4.534   9.111   4.083
  287    HA   ALA  38           HA       ALA  38  -5.302   7.454   2.007
  288   1HB   ALA  38          1HB       ALA  38  -5.134   6.798   4.976
  289   2HB   ALA  38          2HB       ALA  38  -3.725   6.920   3.851
  290   3HB   ALA  38          3HB       ALA  38  -4.954   5.664   3.563
  291    H    ALA  39           H        ALA  39  -7.392   9.041   4.303
  292    HA   ALA  39           HA       ALA  39  -9.549   7.296   3.497
  293   1HB   ALA  39          1HB       ALA  39  -9.447   8.168   5.871
  294   2HB   ALA  39          2HB       ALA  39 -10.923   8.768   5.043
  295   3HB   ALA  39          3HB       ALA  39  -9.492   9.850   5.257
  296    H    GLN  40           H        GLN  40  -8.592  10.697   3.246
  297    HA   GLN  40           HA       GLN  40 -10.738  11.729   1.936
  298   1HB   GLN  40          2HB       GLN  40  -7.827  12.395   2.314
  299   2HB   GLN  40          1HB       GLN  40  -8.699  13.404   1.150
  300   1HG   GLN  40          2HG       GLN  40  -9.764  12.995   4.011
  301   2HG   GLN  40          1HG       GLN  40  -8.545  14.243   3.587
  302   1HE2  GLN  40          1HE2      GLN  40 -11.938  13.529   3.581
  303   2HE2  GLN  40          2HE2      GLN  40 -12.436  14.956   2.706
  304    H    SER  41           H        SER  41  -7.853  10.312   0.408
  305    HA   SER  41           HA       SER  41  -8.542  11.682  -2.041
  306   1HB   SER  41          2HB       SER  41  -6.265  11.686  -0.945
  307   2HB   SER  41          1HB       SER  41  -6.086   9.987  -1.436
  308    HG   SER  41           HG       SER  41  -5.926  12.326  -2.880
  309    H    GLN  42           H        GLN  42  -7.120   9.730  -3.733
  310    HA   GLN  42           HA       GLN  42  -9.490   8.387  -4.574
  311   1HB   GLN  42          2HB       GLN  42  -6.627   8.626  -5.583
  312   2HB   GLN  42          1HB       GLN  42  -7.787   7.551  -6.401
  313   1HG   GLN  42          2HG       GLN  42  -8.345  10.559  -5.927
  314   2HG   GLN  42          1HG       GLN  42  -7.498   9.930  -7.373
  315   1HE2  GLN  42          1HE2      GLN  42  -8.661   7.967  -8.415
  316   2HE2  GLN  42          2HE2      GLN  42 -10.351   8.230  -8.744
  317    H    LEU  43           H        LEU  43  -6.292   7.313  -3.309
  318    HA   LEU  43           HA       LEU  43  -6.984   4.630  -3.209
  319   1HB   LEU  43          2HB       LEU  43  -5.005   4.253  -1.989
  320   2HB   LEU  43          1HB       LEU  43  -4.646   5.400  -3.296
  321    HG   LEU  43           HG       LEU  43  -3.320   6.031  -1.594
  322   1HD1  LEU  43          1HD1      LEU  43  -4.089   8.365  -1.151
  323   2HD1  LEU  43          2HD1      LEU  43  -5.786   7.831  -1.467
  324   3HD1  LEU  43          3HD1      LEU  43  -4.571   7.769  -2.817
  325   1HD2  LEU  43          1HD2      LEU  43  -4.344   4.808   0.385
  326   2HD2  LEU  43          2HD2      LEU  43  -5.561   6.111   0.493
  327   3HD2  LEU  43          3HD2      LEU  43  -3.800   6.435   0.752
  328    H    SER  44           H        SER  44  -7.303   3.343  -1.519
  329    HA   SER  44           HA       SER  44  -7.063   4.395   1.101
  330   1HB   SER  44          2HB       SER  44  -9.675   2.926   0.401
  331   2HB   SER  44          1HB       SER  44  -9.031   3.096   2.071
  332    HG   SER  44           HG       SER  44  -8.986   5.458   1.474
  333    H    GLN  45           H        GLN  45  -5.057   3.201   0.725
  334    HA   GLN  45           HA       GLN  45  -4.666   0.770  -0.101
  335   1HB   GLN  45          2HB       GLN  45  -3.612   2.298   2.328
  336   2HB   GLN  45          1HB       GLN  45  -2.762   0.882   1.618
  337   1HG   GLN  45          2HG       GLN  45  -2.179   1.905  -0.309
  338   2HG   GLN  45          1HG       GLN  45  -3.378   3.216  -0.254
  339   1HE2  GLN  45          2HE2      GLN  45  -0.222   2.643   0.146
  340   2HE2  GLN  45          1HE2      GLN  45   0.296   3.947   1.230
  341    H    GLY  46           H        GLY  46  -5.459  -1.193   0.334
  342   1HA   GLY  46          2HA       GLY  46  -5.483  -2.304   2.878
  343   2HA   GLY  46          1HA       GLY  46  -7.080  -1.560   2.641
  344    H    ASP  47           H        ASP  47  -4.816  -3.435   0.553
  345    HA   ASP  47           HA       ASP  47  -6.471  -5.701   0.649
  346   1HB   ASP  47          2HB       ASP  47  -7.515  -4.090  -1.224
  347   2HB   ASP  47          1HB       ASP  47  -6.093  -4.538  -2.190
  348    H    LEU  48           H        LEU  48  -5.260  -6.846  -1.809
  349    HA   LEU  48           HA       LEU  48  -2.625  -7.338  -0.756
  350   1HB   LEU  48          2HB       LEU  48  -4.081  -8.546  -3.154
  351   2HB   LEU  48          1HB       LEU  48  -2.488  -9.024  -2.507
  352    HG   LEU  48           HG       LEU  48  -3.804 -10.662  -1.614
  353   1HD1  LEU  48          1HD1      LEU  48  -4.334 -10.331   0.775
  354   2HD1  LEU  48          2HD1      LEU  48  -4.290  -8.543   0.599
  355   3HD1  LEU  48          3HD1      LEU  48  -2.775  -9.508   0.334
  356   1HD2  LEU  48          1HD2      LEU  48  -5.987  -9.530  -2.491
  357   2HD2  LEU  48          2HD2      LEU  48  -5.982  -8.634  -0.901
  358   3HD2  LEU  48          3HD2      LEU  48  -6.141 -10.443  -0.896
  359    H    VAL  49           H        VAL  49  -1.036  -5.956  -1.338
  360    HA   VAL  49           HA       VAL  49  -1.434  -4.201  -3.528
  361    HB   VAL  49           HB       VAL  49   0.907  -4.598  -1.642
  362   1HG1  VAL  49          1HG1      VAL  49   1.408  -2.206  -2.271
  363   2HG1  VAL  49          2HG1      VAL  49   0.105  -2.271  -3.520
  364   3HG1  VAL  49          3HG1      VAL  49   1.573  -3.319  -3.676
  365   1HG2  VAL  49          1HG2      VAL  49  -1.570  -2.742  -1.518
  366   2HG2  VAL  49          2HG2      VAL  49  -0.118  -2.600  -0.467
  367   3HG2  VAL  49          3HG2      VAL  49  -1.153  -4.064  -0.358
  368    H    VAL  50           H        VAL  50  -0.416  -4.341  -5.547
  369    HA   VAL  50           HA       VAL  50   1.122  -6.733  -6.102
  370    HB   VAL  50           HB       VAL  50   0.310  -4.610  -8.120
  371   1HG1  VAL  50          1HG1      VAL  50   2.077  -6.277  -8.785
  372   2HG1  VAL  50          2HG1      VAL  50   0.522  -6.590  -9.636
  373   3HG1  VAL  50          3HG1      VAL  50   1.005  -7.620  -8.239
  374   1HG2  VAL  50          1HG2      VAL  50  -1.759  -5.183  -7.075
  375   2HG2  VAL  50          2HG2      VAL  50  -1.344  -6.955  -7.033
  376   3HG2  VAL  50          3HG2      VAL  50  -1.638  -6.110  -8.606
  377    H    ALA  51           H        ALA  51   1.243  -3.267  -6.839
  378    HA   ALA  51           HA       ALA  51   4.170  -3.331  -6.631
  379   1HB   ALA  51          1HB       ALA  51   4.246  -1.666  -8.518
  380   2HB   ALA  51          2HB       ALA  51   2.467  -1.822  -8.692
  381   3HB   ALA  51          3HB       ALA  51   3.528  -3.235  -9.027
  382    H    ILE  52           H        ILE  52   5.234  -1.609  -5.890
  383    HA   ILE  52           HA       ILE  52   3.688   0.507  -4.611
  384    HB   ILE  52           HB       ILE  52   4.837  -1.601  -3.351
  385   1HG1  ILE  52          2HG1      ILE  52   4.423   1.223  -2.204
  386   2HG1  ILE  52          1HG1      ILE  52   3.152   0.006  -2.518
  387   1HG2  ILE  52          1HG2      ILE  52   7.127  -1.010  -3.894
  388   2HG2  ILE  52          2HG2      ILE  52   6.870  -0.791  -2.136
  389   3HG2  ILE  52          3HG2      ILE  52   6.940   0.643  -3.215
  390   1HD1  ILE  52          1HD1      ILE  52   5.467  -0.326  -0.504
  391   2HD1  ILE  52          2HD1      ILE  52   4.253  -1.600  -0.922
  392   3HD1  ILE  52          3HD1      ILE  52   3.729  -0.077  -0.137
  393    H    ASP  53           H        ASP  53   4.400   2.477  -5.139
  394    HA   ASP  53           HA       ASP  53   5.169   3.874  -6.517
  395   1HB   ASP  53          2HB       ASP  53   7.434   4.699  -6.285
  396   2HB   ASP  53          1HB       ASP  53   6.593   4.353  -4.739
  397    H    GLY  54           H        GLY  54   4.728   1.363  -7.773
  398   1HA   GLY  54          2HA       GLY  54   4.653   1.008 -10.031
  399   2HA   GLY  54          1HA       GLY  54   6.199   1.880 -10.251
  400    H    VAL  55           H        VAL  55   6.756  -0.058  -7.608
  401    HA   VAL  55           HA       VAL  55   8.044  -1.986  -9.371
  402    HB   VAL  55           HB       VAL  55   8.799  -1.238  -6.542
  403   1HG1  VAL  55          1HG1      VAL  55   9.609  -3.473  -7.366
  404   2HG1  VAL  55          2HG1      VAL  55  10.979  -2.305  -7.316
  405   3HG1  VAL  55          3HG1      VAL  55  10.194  -2.718  -8.885
  406   1HG2  VAL  55          1HG2      VAL  55   9.004   0.819  -7.821
  407   2HG2  VAL  55          2HG2      VAL  55   9.680  -0.055  -9.250
  408   3HG2  VAL  55          3HG2      VAL  55  10.643   0.098  -7.741
  409    H    ASN  56           H        ASN  56   7.569  -4.104  -9.221
  410    HA   ASN  56           HA       ASN  56   5.350  -4.832  -7.661
  411   1HB   ASN  56          2HB       ASN  56   5.499  -6.960  -8.899
  412   2HB   ASN  56          1HB       ASN  56   5.654  -5.511  -9.969
  413   1HD2  ASN  56          1HD2      ASN  56   6.915  -8.531  -9.613
  414   2HD2  ASN  56          2HD2      ASN  56   8.496  -8.226 -10.275
  415    H    THR  57           H        THR  57   5.097  -6.090  -5.923
  416    HA   THR  57           HA       THR  57   7.260  -6.142  -4.173
  417    HB   THR  57           HB       THR  57   5.538  -6.854  -2.534
  418    HG1  THR  57           1HG      THR  57   3.773  -6.432  -4.689
  419   1HG2  THR  57          1HG2      THR  57   4.314  -4.717  -2.628
  420   2HG2  THR  57          2HG2      THR  57   4.792  -4.451  -4.341
  421   3HG2  THR  57          3HG2      THR  57   6.042  -4.442  -3.053
  422    H    ASP  58           H        ASP  58   8.003  -8.010  -6.027
  423    HA   ASP  58           HA       ASP  58   7.375 -10.618  -5.360
  424   1HB   ASP  58          2HB       ASP  58   9.792  -9.306  -6.689
  425   2HB   ASP  58          1HB       ASP  58   9.805 -11.067  -6.320
  426    H    THR  59           H        THR  59  10.163  -8.767  -4.100
  427    HA   THR  59           HA       THR  59  10.519 -10.951  -2.181
  428    HB   THR  59           HB       THR  59  12.250 -10.348  -3.924
  429    HG1  THR  59           1HG      THR  59  13.786 -10.879  -2.685
  430   1HG2  THR  59          1HG2      THR  59  12.784  -7.971  -2.002
  431   2HG2  THR  59          2HG2      THR  59  12.156  -7.844  -3.695
  432   3HG2  THR  59          3HG2      THR  59  13.798  -8.490  -3.392
  433    H    MET  60           H        MET  60   9.432  -7.790  -2.339
  434    HA   MET  60           HA       MET  60  10.226  -6.586  -0.074
  435   1HB   MET  60          2HB       MET  60   7.834  -6.573  -1.960
  436   2HB   MET  60          1HB       MET  60   7.954  -5.359  -0.638
  437   1HG   MET  60          2HG       MET  60   8.786  -4.215  -2.443
  438   2HG   MET  60          1HG       MET  60  10.260  -4.732  -1.586
  439   1HE   MET  60          1HE       MET  60  11.288  -4.499  -5.339
  440   2HE   MET  60          2HE       MET  60  11.592  -3.973  -3.653
  441   3HE   MET  60          3HE       MET  60  10.063  -3.502  -4.485
  442    H    THR  61           H        THR  61   9.575  -6.413   1.964
  443    HA   THR  61           HA       THR  61   7.594  -8.322   2.951
  444    HB   THR  61           HB       THR  61   8.896  -8.196   5.062
  445    HG1  THR  61           1HG      THR  61  11.065  -7.126   3.844
  446   1HG2  THR  61          1HG2      THR  61   9.391  -9.951   3.332
  447   2HG2  THR  61          2HG2      THR  61  10.877  -9.433   4.191
  448   3HG2  THR  61          3HG2      THR  61  10.538  -8.831   2.516
  449    H    HIS  62           H        HIS  62   6.790  -7.508   5.249
  450    HA   HIS  62           HA       HIS  62   5.256  -5.285   4.964
  451   1HB   HIS  62          2HB       HIS  62   4.686  -5.488   7.245
  452   2HB   HIS  62          1HB       HIS  62   5.036  -7.147   6.674
  453    HD1  HIS  62           1HD      HIS  62   7.617  -8.020   7.393
  454    HD2  HIS  62           2HD      HIS  62   5.993  -4.812   9.547
  455    HE1  HIS  62           1HE      HIS  62   9.051  -7.676   9.464
  456    H    LEU  63           H        LEU  63   8.225  -5.486   6.813
  457    HA   LEU  63           HA       LEU  63   8.767  -2.928   7.539
  458   1HB   LEU  63          2HB       LEU  63  10.075  -4.905   8.200
  459   2HB   LEU  63          1HB       LEU  63  10.545  -5.199   6.503
  460    HG   LEU  63           HG       LEU  63  11.842  -3.020   6.516
  461   1HD1  LEU  63          1HD1      LEU  63  10.707  -1.823   8.392
  462   2HD1  LEU  63          2HD1      LEU  63  12.457  -2.048   8.753
  463   3HD1  LEU  63          3HD1      LEU  63  11.234  -3.108   9.546
  464   1HD2  LEU  63          1HD2      LEU  63  12.887  -5.218   6.795
  465   2HD2  LEU  63          2HD2      LEU  63  12.595  -5.157   8.584
  466   3HD2  LEU  63          3HD2      LEU  63  13.732  -3.976   7.805
  467    H    GLU  64           H        GLU  64   9.645  -4.510   4.453
  468    HA   GLU  64           HA       GLU  64  10.920  -2.278   3.423
  469   1HB   GLU  64          2HB       GLU  64  10.803  -4.882   2.672
  470   2HB   GLU  64          1HB       GLU  64   9.670  -4.232   1.448
  471   1HG   GLU  64          2HG       GLU  64  11.477  -2.417   0.983
  472   2HG   GLU  64          1HG       GLU  64  12.492  -3.230   2.224
  473    H    ALA  65           H        ALA  65   7.569  -3.431   2.923
  474    HA   ALA  65           HA       ALA  65   6.769  -1.462   1.169
  475   1HB   ALA  65          1HB       ALA  65   5.663  -3.640   1.754
  476   2HB   ALA  65          2HB       ALA  65   4.496  -2.249   1.803
  477   3HB   ALA  65          3HB       ALA  65   5.161  -2.948   3.334
  478    H    GLN  66           H        GLN  66   6.743  -1.398   4.722
  479    HA   GLN  66           HA       GLN  66   5.609   1.103   5.071
  480   1HB   GLN  66          2HB       GLN  66   7.710  -0.508   6.599
  481   2HB   GLN  66          1HB       GLN  66   7.189   1.113   7.167
  482   1HG   GLN  66          2HG       GLN  66   4.737   0.127   6.992
  483   2HG   GLN  66          1HG       GLN  66   5.575  -1.470   6.971
  484   1HE2  GLN  66          1HE2      GLN  66   4.472   1.178   8.962
  485   2HE2  GLN  66          2HE2      GLN  66   5.052   0.502  10.464
  486    H    ASN  67           H        ASN  67   9.047   0.258   4.776
  487    HA   ASN  67           HA       ASN  67  10.039   2.854   4.807
  488   1HB   ASN  67          2HB       ASN  67  11.064   0.161   3.738
  489   2HB   ASN  67          1HB       ASN  67  12.109   1.618   3.752
  490   1HD2  ASN  67          1HD2      ASN  67  12.731  -0.741   5.175
  491   2HD2  ASN  67          2HD2      ASN  67  12.629  -0.397   6.887
  492    H    LYS  68           H        LYS  68   8.832   0.947   2.096
  493    HA   LYS  68           HA       LYS  68   9.783   2.672   0.090
  494   1HB   LYS  68          2HB       LYS  68   7.431   0.736   0.131
  495   2HB   LYS  68          1HB       LYS  68   8.087   1.510  -1.348
  496   1HG   LYS  68          2HG       LYS  68  10.132   0.043   0.294
  497   2HG   LYS  68          1HG       LYS  68   8.810  -0.966  -0.344
  498   1HD   LYS  68          2HD       LYS  68   9.243  -0.053  -2.645
  499   2HD   LYS  68          1HD       LYS  68  10.621   0.875  -2.018
  500   1HE   LYS  68          2HE       LYS  68  10.369  -2.191  -1.637
  501   2HE   LYS  68          1HE       LYS  68  11.035  -1.483  -3.162
  502   1HZ   LYS  68          1HZ       LYS  68  12.898  -0.885  -2.183
  503   2HZ   LYS  68          2HZ       LYS  68  12.539  -2.146  -1.155
  504   3HZ   LYS  68          3HZ       LYS  68  12.263  -0.554  -0.644
  505    H    ILE  69           H        ILE  69   6.313   2.390   1.293
  506    HA   ILE  69           HA       ILE  69   5.401   4.635   0.236
  507    HB   ILE  69           HB       ILE  69   4.821   3.131   2.787
  508   1HG1  ILE  69          2HG1      ILE  69   3.197   3.481   0.222
  509   2HG1  ILE  69          1HG1      ILE  69   4.351   2.174   0.332
  510   1HG2  ILE  69          1HG2      ILE  69   3.929   5.320   3.301
  511   2HG2  ILE  69          2HG2      ILE  69   2.527   4.487   2.520
  512   3HG2  ILE  69          3HG2      ILE  69   3.501   5.646   1.575
  513   1HD1  ILE  69          1HD1      ILE  69   3.152   1.317   2.443
  514   2HD1  ILE  69          2HD1      ILE  69   2.244   1.189   0.897
  515   3HD1  ILE  69          3HD1      ILE  69   1.837   2.498   2.057
  516    H    LYS  70           H        LYS  70   6.991   4.547   3.510
  517    HA   LYS  70           HA       LYS  70   6.603   7.328   3.740
  518   1HB   LYS  70          2HB       LYS  70   7.825   5.160   5.427
  519   2HB   LYS  70          1HB       LYS  70   8.229   6.852   5.777
  520   1HG   LYS  70          2HG       LYS  70   6.468   6.642   7.133
  521   2HG   LYS  70          1HG       LYS  70   5.716   7.402   5.712
  522   1HD   LYS  70          2HD       LYS  70   4.137   5.756   6.362
  523   2HD   LYS  70          1HD       LYS  70   4.997   4.987   5.010
  524   1HE   LYS  70          2HE       LYS  70   4.712   3.342   6.813
  525   2HE   LYS  70          1HE       LYS  70   6.464   3.765   6.712
  526   1HZ   LYS  70          1HZ       LYS  70   5.472   5.552   8.544
  527   2HZ   LYS  70          2HZ       LYS  70   6.277   4.102   8.852
  528   3HZ   LYS  70          3HZ       LYS  70   4.579   4.165   8.845
  529    H    SER  71           H        SER  71   8.706   6.036   1.618
  530    HA   SER  71           HA       SER  71  10.631   8.211   2.122
  531   1HB   SER  71          2HB       SER  71  10.751   5.699   0.398
  532   2HB   SER  71          1HB       SER  71  11.874   7.079   0.133
  533    HG   SER  71           HG       SER  71  12.511   5.325   1.620
  534    H    ALA  72           H        ALA  72   7.765   7.592   0.516
  535    HA   ALA  72           HA       ALA  72   8.519   9.035  -1.897
  536   1HB   ALA  72          1HB       ALA  72   7.321   6.835  -1.986
  537   2HB   ALA  72          2HB       ALA  72   6.337   8.150  -2.731
  538   3HB   ALA  72          3HB       ALA  72   5.969   7.561  -1.059
  539    H    SER  73           H        SER  73   7.144  10.711  -2.746
  540    HA   SER  73           HA       SER  73   5.249  11.968  -1.040
  541   1HB   SER  73          2HB       SER  73   6.340  14.162  -0.791
  542   2HB   SER  73          1HB       SER  73   7.187  12.872   0.109
  543    HG   SER  73           HG       SER  73   8.819  12.956  -1.207
  544    H    TYR  74           H        TYR  74   7.382  12.680  -3.813
  545    HA   TYR  74           HA       TYR  74   5.427  14.203  -5.166
  546   1HB   TYR  74          2HB       TYR  74   8.024  12.822  -6.090
  547   2HB   TYR  74          1HB       TYR  74   7.052  13.905  -7.137
  548    HD1  TYR  74           1HD      TYR  74   6.613  16.256  -6.367
  549    HD2  TYR  74           2HD      TYR  74   9.626  13.772  -4.690
  550    HE1  TYR  74           1HE      TYR  74   7.908  18.241  -5.758
  551    HE2  TYR  74           2HE      TYR  74  10.917  15.754  -4.069
  552    HH   TYR  74           HH       TYR  74  11.182  17.956  -4.447
  553    H    ASN  75           H        ASN  75   6.359  10.817  -5.227
  554    HA   ASN  75           HA       ASN  75   3.897  10.217  -6.632
  555   1HB   ASN  75          2HB       ASN  75   5.271  10.364  -8.546
  556   2HB   ASN  75          1HB       ASN  75   6.674   9.648  -7.653
  557   1HD2  ASN  75          1HD2      ASN  75   6.580   7.298  -7.166
  558   2HD2  ASN  75          2HD2      ASN  75   6.011   6.326  -8.509
  559    H    LEU  76           H        LEU  76   3.008   9.051  -5.348
  560    HA   LEU  76           HA       LEU  76   4.368   6.630  -4.313
  561   1HB   LEU  76          2HB       LEU  76   3.852   8.121  -2.405
  562   2HB   LEU  76          1HB       LEU  76   2.150   8.201  -2.901
  563    HG   LEU  76           HG       LEU  76   1.890   5.758  -2.482
  564   1HD1  LEU  76          1HD1      LEU  76   4.821   5.844  -1.491
  565   2HD1  LEU  76          2HD1      LEU  76   4.275   4.992  -2.994
  566   3HD1  LEU  76          3HD1      LEU  76   3.709   4.444  -1.389
  567   1HD2  LEU  76          1HD2      LEU  76   2.095   5.759  -0.018
  568   2HD2  LEU  76          2HD2      LEU  76   1.520   7.382  -0.570
  569   3HD2  LEU  76          3HD2      LEU  76   3.234   7.136  -0.075
  570    H    SER  77           H        SER  77   3.863   5.523  -6.198
  571    HA   SER  77           HA       SER  77   1.038   5.422  -6.929
  572   1HB   SER  77          2HB       SER  77   2.918   5.990  -8.606
  573   2HB   SER  77          1HB       SER  77   3.295   4.241  -8.584
  574    HG   SER  77           HG       SER  77   0.948   5.614  -9.367
  575    H    LEU  78           H        LEU  78  -0.084   3.971  -5.811
  576    HA   LEU  78           HA       LEU  78   1.116   1.330  -5.317
  577   1HB   LEU  78          2HB       LEU  78  -1.329   2.761  -4.234
  578   2HB   LEU  78          1HB       LEU  78  -1.096   1.025  -3.974
  579    HG   LEU  78           HG       LEU  78  -0.413   2.871  -2.162
  580   1HD1  LEU  78          1HD1      LEU  78   0.934   1.051  -1.081
  581   2HD1  LEU  78          2HD1      LEU  78   0.986   0.171  -2.656
  582   3HD1  LEU  78          3HD1      LEU  78  -0.590   0.424  -1.810
  583   1HD2  LEU  78          1HD2      LEU  78   2.015   3.087  -1.918
  584   2HD2  LEU  78          2HD2      LEU  78   1.470   3.888  -3.438
  585   3HD2  LEU  78          3HD2      LEU  78   2.293   2.286  -3.509
  586    H    THR  79           H        THR  79   0.298  -0.445  -6.186
  587    HA   THR  79           HA       THR  79  -2.231  -0.332  -7.652
  588    HB   THR  79           HB       THR  79   0.251  -1.897  -8.488
  589    HG1  THR  79           1HG      THR  79  -1.071   0.144  -9.902
  590   1HG2  THR  79          1HG2      THR  79  -2.576  -1.572  -9.697
  591   2HG2  THR  79          2HG2      THR  79  -1.850  -3.083  -9.020
  592   3HG2  THR  79          3HG2      THR  79  -1.171  -2.370 -10.526
  593    H    LEU  80           H        LEU  80  -3.516  -1.530  -6.259
  594    HA   LEU  80           HA       LEU  80  -2.610  -4.159  -5.353
  595   1HB   LEU  80          2HB       LEU  80  -3.682  -3.896  -3.259
  596   2HB   LEU  80          1HB       LEU  80  -2.528  -2.514  -3.485
  597    HG   LEU  80           HG       LEU  80  -5.535  -2.562  -3.781
  598   1HD1  LEU  80          1HD1      LEU  80  -4.609  -2.698  -1.459
  599   2HD1  LEU  80          2HD1      LEU  80  -5.508  -1.115  -1.758
  600   3HD1  LEU  80          3HD1      LEU  80  -3.673  -1.161  -1.771
  601   1HD2  LEU  80          1HD2      LEU  80  -3.315  -0.490  -4.229
  602   2HD2  LEU  80          2HD2      LEU  80  -4.994   0.117  -3.749
  603   3HD2  LEU  80          3HD2      LEU  80  -4.763  -0.808  -5.298
  604    H    GLN  81           H        GLN  81  -4.690  -5.482  -4.717
  605    HA   GLN  81           HA       GLN  81  -6.344  -5.283  -7.035
  606   1HB   GLN  81          2HB       GLN  81  -6.359  -7.343  -4.830
  607   2HB   GLN  81          1HB       GLN  81  -7.183  -7.438  -6.429
  608   1HG   GLN  81          2HG       GLN  81  -5.013  -7.421  -7.603
  609   2HG   GLN  81          1HG       GLN  81  -4.133  -7.171  -6.057
  610   1HE2  GLN  81          1HE2      GLN  81  -2.935  -9.019  -5.955
  611   2HE2  GLN  81          2HE2      GLN  81  -3.598 -10.629  -5.976
  612    H    LYS  82           H        LYS  82  -8.622  -5.262  -7.127
  613    HA   LYS  82           HA       LYS  82  -9.692  -3.489  -5.200
  614   1HB   LYS  82          2HB       LYS  82  -9.730  -3.568  -7.875
  615   2HB   LYS  82          1HB       LYS  82 -11.170  -4.587  -7.647
  616   1HG   LYS  82          2HG       LYS  82 -11.743  -2.205  -8.030
  617   2HG   LYS  82          1HG       LYS  82 -12.261  -2.693  -6.393
  618   1HD   LYS  82          2HD       LYS  82  -9.510  -1.834  -6.298
  619   2HD   LYS  82          1HD       LYS  82 -10.378  -0.574  -7.214
  620   1HE   LYS  82          2HE       LYS  82 -11.227  -1.602  -4.413
  621   2HE   LYS  82          1HE       LYS  82 -10.208  -0.139  -4.681
  622   1HZ   LYS  82          1HZ       LYS  82 -12.648   0.215  -4.380
  623   2HZ   LYS  82          2HZ       LYS  82 -12.896  -0.420  -5.924
  624   3HZ   LYS  82          3HZ       LYS  82 -11.955   0.968  -5.711
  625    H    SER  83           H        SER  83  -9.577  -6.522  -4.798
  626    HA   SER  83           HA       SER  83 -10.551  -7.901  -3.428
  627   1HB   SER  83          2HB       SER  83 -10.833  -5.870  -2.041
  628   2HB   SER  83          1HB       SER  83 -12.520  -5.734  -2.630
  629    HG   SER  83           HG       SER  83 -12.317  -6.834  -0.643
  630    H    LYS  84           H        LYS  84 -12.981  -6.427  -5.495
  631    HA   LYS  84           HA       LYS  84 -15.117  -7.532  -4.484
  632   1HB   LYS  84          2HB       LYS  84 -14.718  -6.978  -7.461
  633   2HB   LYS  84          1HB       LYS  84 -16.289  -7.063  -6.610
  634   1HG   LYS  84          2HG       LYS  84 -15.545  -5.133  -5.139
  635   2HG   LYS  84          1HG       LYS  84 -14.093  -4.963  -6.190
  636   1HD   LYS  84          2HD       LYS  84 -15.584  -4.683  -8.191
  637   2HD   LYS  84          1HD       LYS  84 -17.020  -4.813  -7.120
  638   1HE   LYS  84          2HE       LYS  84 -16.167  -2.782  -5.816
  639   2HE   LYS  84          1HE       LYS  84 -14.850  -2.602  -7.044
  640   1HZ   LYS  84          1HZ       LYS  84 -17.790  -2.506  -7.543
  641   2HZ   LYS  84          2HZ       LYS  84 -16.617  -2.442  -8.745
  642   3HZ   LYS  84          3HZ       LYS  84 -16.712  -1.210  -7.548
  643    H    ARG  85           H        ARG  85 -16.577  -9.086  -4.683
  644    HA   ARG  85           HA       ARG  85 -16.007 -11.369  -6.435
  645   1HB   ARG  85          2HB       ARG  85 -16.864 -11.253  -3.508
  646   2HB   ARG  85          1HB       ARG  85 -17.093 -12.710  -4.528
  647   1HG   ARG  85          2HG       ARG  85 -14.684 -12.962  -4.861
  648   2HG   ARG  85          1HG       ARG  85 -14.353 -11.385  -4.086
  649   1HD   ARG  85          2HD       ARG  85 -13.827 -13.303  -2.577
  650   2HD   ARG  85          1HD       ARG  85 -15.107 -12.215  -1.886
  651    HE   ARG  85           HE       ARG  85 -16.451 -14.268  -3.385
  652   1HH1  ARG  85          1HH1      ARG  85 -14.482 -14.102  -0.350
  653   2HH1  ARG  85          2HH1      ARG  85 -15.424 -15.413   0.334
  654   1HH2  ARG  85          1HH2      ARG  85 -17.485 -15.912  -2.422
  655   2HH2  ARG  85          2HH2      ARG  85 -17.037 -16.442  -0.796