*HEADER    OXIDOREDUCTASE                          03-AUG-01   1GJX
*TITLE     SOLUTION STRUCTURE OF THE LIPOYL DOMAIN OF THE CHIMERIC
*TITLE    2 DIHYDROLIPOYL DEHYDROGENASE P64K FROM NEISSERIA
*TITLE    3 MENINGITIDIS
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: PYRUVATE DEHYDROGENASE;
*COMPND   3 SYNONYM: LIPOAMIDE DEHYDROGENASE, E3 COMPONENT;
*COMPND   4 CHAIN: A;
*COMPND   5 FRAGMENT: LIPOYL DOMAIN RESIDUES 2-82;
*COMPND   6 EC: 1.8.1.4;
*COMPND   7 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: NEISSERIA MENINGITIDIS;
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   4 EXPRESSION_SYSTEM_STRAIN: XL1-BLUE;
*SOURCE   5 EXPRESSION_SYSTEM_PLASMID: PM-143
*KEYWDS    LIPOYL DOMAIN, DIHYDROLIPOYL DEHYDROGENASE, MULTIENZYME
*KEYWDS   2 COMPLEX, NEISSERIA MENINGITIDIS, POST-TRANSLATIONAL
*KEYWDS   3 MODIFICATION
*EXPDTA    NMR, 18 STRUCTURES
*AUTHOR    K.TOZAWA,R.W.BROADHURST,A.R.C.RAINE,C.FULLER,A.ALVAREZ,
*AUTHOR   2 G.GUILLEN,G.PADRON,R.N.PERHAM




! Kaeko Tozawa   7th July  1997

! NB that for XPLOR HB1 in noe.tbl must correspond to b2 in chi1 definition
!               and HB2 in noe.tbl must correspond to b3 in chi1 definition

! chi angles (rotamer types) for residues with 2 HBs


! chi1 = 60 degrees     g2g3

assign ( resid 13 and name N  ) ( resid 13 and name CA )  
       ( resid 13 and name CB ) ( resid 13 and name CG )  1 60.0 30.0 2

assign ( resid 15 and name N  ) ( resid 15 and name CA )  
       ( resid 15 and name CB ) ( resid 15 and name CG )  1 60.0 30.0 2

!assign ( resid 27 and name N  ) ( resid 27 and name CA )  
!       ( resid 27 and name CB ) ( resid 27 and name CG )  1 60.0 30.0 2

assign ( resid 32 and name N  ) ( resid 32 and name CA )  
       ( resid 32 and name CB ) ( resid 32 and name CG )  1 60.0 30.0 2

assign ( resid 33 and name N  ) ( resid 33 and name CA )  
       ( resid 33 and name CB ) ( resid 33 and name CG )  1 60.0 30.0 2

assign ( resid 64 and name N  ) ( resid 64 and name CA )  
       ( resid 64 and name CB ) ( resid 64 and name CG )  1 60.0 30.0 2

assign ( resid 67 and name N  ) ( resid 67 and name CA )  
       ( resid 67 and name CB ) ( resid 67 and name CG )  1 60.0 30.0 2

! Valines

!assign ( resid 11 and name N  ) ( resid 11 and name CA )  
!       ( resid 11 and name CB ) ( resid 11 and name HB )  1 60.0 30.0 2

!assign ( resid 16 and name N  ) ( resid 16 and name CA )  
!       ( resid 16 and name CB ) ( resid 16 and name HB )  1 60.0 30.0 2

!assign ( resid 39 and name N  ) ( resid 39 and name CA )  
!       ( resid 39 and name CB ) ( resid 39 and name HB )  1 60.0 30.0 2

!assign ( resid 63 and name N  ) ( resid 63 and name CA )  
!       ( resid 63 and name CB ) ( resid 63 and name HB )  1 60.0 30.0 2

!assign ( resid 68 and name N  ) ( resid 68 and name CA )  
!       ( resid 68 and name CB ) ( resid 68 and name HB )  1 60.0 30.0 2

! Isoleucines

!assign ( resid 6  and name N  ) ( resid 6  and name CA )  
!       ( resid 6  and name CB ) ( resid 6  and name HB )  1 60.0 30.0 2

!assign ( resid 10 and name N  ) ( resid 10 and name CA )  
!       ( resid 10 and name CB ) ( resid 10 and name HB )  1 60.0 30.0 2

!assign ( resid 45 and name N  ) ( resid 45 and name CA )  
!       ( resid 45 and name CB ) ( resid 45 and name HB )  1 60.0 30.0 2

!assign ( resid 55 and name N  ) ( resid 55 and name CA )  
!       ( resid 55 and name CB ) ( resid 55 and name HB )  1 60.0 30.0 2

!assign ( resid 66 and name N  ) ( resid 66 and name CA )  
!       ( resid 66 and name CB ) ( resid 66 and name HB )  1 60.0 30.0 2

! Threonines

!assign ( resid 18 and name N  ) ( resid 18 and name CA )  
!       ( resid 18 and name CB ) ( resid 18 and name HB )  1 60.0 30.0 2

!assign ( resid 42 and name N  ) ( resid 42 and name CA )  
!       ( resid 42 and name CB ) ( resid 42 and name HB )  1 60.0 30.0 2

!assign ( resid 62 and name N  ) ( resid 62 and name CA )  
!       ( resid 62 and name CB ) ( resid 62 and name HB )  1 60.0 30.0 2


! Total g2g3 : 7


! chi1 = 180 degrees    g2t3 

!assign ( resid 21 and name N  ) ( resid 21 and name CA )  
!       ( resid 21 and name CB ) ( resid 21 and name CG )  1 180.0 30.0 2

!assign ( resid 35 and name N  ) ( resid 35 and name CA )  
!       ( resid 35 and name CB ) ( resid 35 and name CG )  1 180.0 30.0 2

!assign ( resid 59 and name N  ) ( resid 59 and name CA )  
!       ( resid 59 and name CB ) ( resid 59 and name CG )  1 180.0 30.0 2

!assign ( resid 76 and name N  ) ( resid 76 and name CA )  
!       ( resid 76 and name CB ) ( resid 76 and name CG )  1 180.0 30.0 2

!assign ( resid 54 and name N  ) ( resid 54 and name CA )  
!       ( resid 54 and name CB ) ( resid 54 and name CG )  1 180.0 30.0 2

!assign ( resid 75 and name N  ) ( resid 75 and name CA )  
!       ( resid 75 and name CB ) ( resid 75 and name CG )  1 180.0 30.0 2

!assign ( resid 19 and name N  ) ( resid 19 and name CA )  
!       ( resid 19 and name CB ) ( resid 19 and name CG )  1 180.0 30.0 2

!assign ( resid 38 and name N  ) ( resid 38 and name CA )  
!       ( resid 38 and name CB ) ( resid 38 and name CG )  1 180.0 30.0 2

!assign ( resid 80 and name N  ) ( resid 80 and name CA )  
!       ( resid 80 and name CB ) ( resid 80 and name CG )  1 180.0 30.0 2


! Total g2g3 : 


! chi1 = -60 degrees    t2g3

!assign ( resid 6 and name N  ) ( resid 6 and name CA )  
!       ( resid 6 and name CB ) ( resid 6 and name CG )  1 -60.0 30.0 2

assign ( resid 57 and name N  ) ( resid 57 and name CA )  
       ( resid 57 and name CB ) ( resid 57 and name CG )  1 -60.0 30.0 2

assign ( resid 59 and name N  ) ( resid 59 and name CA )  
       ( resid 59 and name CB ) ( resid 59 and name CG )  1 -60.0 30.0 2

!assign ( resid 65 and name N  ) ( resid 65 and name CA )  
!       ( resid 65 and name CB ) ( resid 65 and name CG )  1 -60.0 30.0 2


! Valines

assign ( resid 23 and name N  ) ( resid 23 and name CA )  
       ( resid 23 and name CB ) ( resid 23 and name CG1 )  1 -60.0 30.0 2

assign ( resid 54 and name N  ) ( resid 54 and name CA )  
       ( resid 54 and name CB ) ( resid 54 and name CG1 )  1 180.0 30.0 2

assign ( resid 55 and name N  ) ( resid 55 and name CA )  
       ( resid 55 and name CB ) ( resid 55 and name CG1 )  1 180.0 30.0 2


! Total t2g3 : 4



! t2g3 or g2g3 :

! Valines

!assign ( resid 46 and name N  ) ( resid 46 and name CA )  
!       ( resid 46 and name CB ) ( resid 46 and name HB )  1  0.0 90.0 2

!assign ( resid 81 and name N  ) ( resid 81 and name CA )  
!       ( resid 81 and name CB ) ( resid 81 and name HB )  1  0.0 90.0 2

! Isoleucines

!assign ( resid 83 and name N  ) ( resid 83 and name CA )  
!       ( resid 83 and name CB ) ( resid 83 and name HB )  1  0.0 90.0 2

! Total: 


!! Total number of chi1 restraints: 7
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           H1       ALA   1 -12.391   3.999 -12.491
    2    H2   ALA   1           H2       ALA   1 -13.591   3.078 -13.303
    3    H3   ALA   1           H3       ALA   1 -13.966   4.644 -12.713
    4    HA   ALA   1           HA       ALA   1 -14.123   3.994 -10.604
    5   1HB   ALA   1          1HB       ALA   1 -15.241   2.191 -12.521
    6   2HB   ALA   1          2HB       ALA   1 -15.890   2.704 -10.963
    7   3HB   ALA   1          3HB       ALA   1 -14.819   1.306 -11.055
    8    H    LEU   2           H        LEU   2 -13.718   2.256  -8.911
    9    HA   LEU   2           HA       LEU   2 -12.207   1.160  -7.610
   10   1HB   LEU   2          1HB       LEU   2 -11.365   0.047 -10.288
   11   2HB   LEU   2          2HB       LEU   2 -10.842  -0.584  -8.737
   12    HG   LEU   2           HG       LEU   2 -13.678  -0.506  -8.699
   13   1HD1  LEU   2          1HD1      LEU   2 -12.537  -1.175 -11.321
   14   2HD1  LEU   2          2HD1      LEU   2 -13.671  -2.359 -10.671
   15   3HD1  LEU   2          3HD1      LEU   2 -14.173  -0.682 -10.882
   16   1HD2  LEU   2          1HD2      LEU   2 -11.878  -2.067  -7.644
   17   2HD2  LEU   2          2HD2      LEU   2 -13.468  -2.710  -8.059
   18   3HD2  LEU   2          3HD2      LEU   2 -12.093  -3.000  -9.126
   19    H    VAL   3           H        VAL   3  -9.758   0.719  -7.323
   20    HA   VAL   3           HA       VAL   3  -8.066   2.679  -8.646
   21    HB   VAL   3           HB       VAL   3  -8.854   2.853  -5.754
   22   1HG1  VAL   3          1HG1      VAL   3  -6.409   2.651  -5.718
   23   2HG1  VAL   3          2HG1      VAL   3  -6.288   3.977  -6.877
   24   3HG1  VAL   3          3HG1      VAL   3  -6.936   4.274  -5.265
   25   1HG2  VAL   3          1HG2      VAL   3  -8.773   4.648  -8.118
   26   2HG2  VAL   3          2HG2      VAL   3 -10.034   4.428  -6.905
   27   3HG2  VAL   3          3HG2      VAL   3  -8.590   5.360  -6.514
   28    H    GLU   4           H        GLU   4  -5.789   2.458  -8.022
   29    HA   GLU   4           HA       GLU   4  -5.097  -0.149  -6.872
   30   1HB   GLU   4          1HB       GLU   4  -3.173   0.190  -8.816
   31   2HB   GLU   4          2HB       GLU   4  -4.544  -0.904  -8.914
   32   1HG   GLU   4          1HG       GLU   4  -5.825   1.005  -9.964
   33   2HG   GLU   4          2HG       GLU   4  -4.280   1.846 -10.090
   34    H    LEU   5           H        LEU   5  -4.041   0.421  -5.073
   35    HA   LEU   5           HA       LEU   5  -2.776   2.816  -4.552
   36   1HB   LEU   5          1HB       LEU   5  -2.987   0.260  -3.280
   37   2HB   LEU   5          2HB       LEU   5  -1.338   0.831  -3.140
   38    HG   LEU   5           HG       LEU   5  -2.679   1.480  -1.204
   39   1HD1  LEU   5          1HD1      LEU   5  -1.758   3.699  -3.014
   40   2HD1  LEU   5          2HD1      LEU   5  -2.266   3.963  -1.346
   41   3HD1  LEU   5          3HD1      LEU   5  -0.876   2.933  -1.692
   42   1HD2  LEU   5          1HD2      LEU   5  -4.725   1.814  -2.964
   43   2HD2  LEU   5          2HD2      LEU   5  -4.707   2.436  -1.313
   44   3HD2  LEU   5          3HD2      LEU   5  -4.252   3.486  -2.654
   45    H    LYS   6           H        LYS   6  -0.270   2.637  -3.778
   46    HA   LYS   6           HA       LYS   6   1.469   1.368  -5.652
   47   1HB   LYS   6          1HB       LYS   6   0.787   4.271  -5.972
   48   2HB   LYS   6          2HB       LYS   6   2.384   3.685  -6.414
   49   1HG   LYS   6          1HG       LYS   6   0.800   1.880  -7.676
   50   2HG   LYS   6          2HG       LYS   6  -0.195   3.336  -7.759
   51   1HD   LYS   6          1HD       LYS   6   2.341   4.234  -8.400
   52   2HD   LYS   6          2HD       LYS   6   2.240   2.661  -9.192
   53   1HE   LYS   6          1HE       LYS   6   1.147   3.701 -10.835
   54   2HE   LYS   6          2HE       LYS   6  -0.213   3.815  -9.719
   55   1HZ   LYS   6          1HZ       LYS   6   1.803   5.880  -9.441
   56   2HZ   LYS   6          2HZ       LYS   6   0.929   5.919 -10.888
   57   3HZ   LYS   6          3HZ       LYS   6   0.115   6.001  -9.408
   58    H    VAL   7           H        VAL   7   3.574   1.370  -4.968
   59    HA   VAL   7           HA       VAL   7   4.160   1.657  -2.304
   60    HB   VAL   7           HB       VAL   7   6.115   1.934  -4.593
   61   1HG1  VAL   7          1HG1      VAL   7   6.937   2.703  -2.361
   62   2HG1  VAL   7          2HG1      VAL   7   6.664   1.067  -1.767
   63   3HG1  VAL   7          3HG1      VAL   7   7.836   1.353  -3.054
   64   1HG2  VAL   7          1HG2      VAL   7   4.745  -0.123  -4.656
   65   2HG2  VAL   7          2HG2      VAL   7   6.456  -0.443  -4.382
   66   3HG2  VAL   7          3HG2      VAL   7   5.319  -0.521  -3.038
   67    HA   PRO   8           HA       PRO   8   4.439   6.035  -1.689
   68   1HB   PRO   8          1HB       PRO   8   5.745   6.059   0.683
   69   2HB   PRO   8          2HB       PRO   8   4.039   5.626   0.529
   70   1HG   PRO   8          1HG       PRO   8   6.424   3.852   0.826
   71   2HG   PRO   8          2HG       PRO   8   4.812   3.698   1.546
   72   1HD   PRO   8          1HD       PRO   8   5.638   2.269  -0.632
   73   2HD   PRO   8          2HD       PRO   8   3.942   2.683  -0.316
   74    H    ASP   9           H        ASP   9   6.335   7.467  -0.501
   75    HA   ASP   9           HA       ASP   9   8.573   7.257  -2.360
   76   1HB   ASP   9          1HB       ASP   9   7.171   9.404  -0.964
   77   2HB   ASP   9          2HB       ASP   9   8.924   9.573  -0.892
   78    H    ILE  10           H        ILE  10   9.268   5.325  -0.998
   79    HA   ILE  10           HA       ILE  10  10.200   5.562   1.610
   80    HB   ILE  10           HB       ILE  10  11.945   3.764   0.785
   81   1HG1  ILE  10          1HG1      ILE  10  11.316   2.575  -1.184
   82   2HG1  ILE  10          2HG1      ILE  10   9.837   3.513  -1.362
   83   1HG2  ILE  10          1HG2      ILE  10  10.092   3.349   2.294
   84   2HG2  ILE  10          2HG2      ILE  10   8.978   3.272   0.926
   85   3HG2  ILE  10          3HG2      ILE  10  10.234   2.048   1.111
   86   1HD1  ILE  10          1HD1      ILE  10  12.478   4.887  -1.483
   87   2HD1  ILE  10          2HD1      ILE  10  11.882   3.992  -2.881
   88   3HD1  ILE  10          3HD1      ILE  10  10.941   5.332  -2.226
   89    H    GLY  11           H        GLY  11  11.485   6.923  -1.268
   90   1HA   GLY  11          1HA       GLY  11  13.863   7.774   0.257
   91   2HA   GLY  11          2HA       GLY  11  13.068   8.748  -0.970
   92    H    GLY  12           H        GLY  12  14.299   5.401  -0.852
   93   1HA   GLY  12          1HA       GLY  12  15.773   4.294  -2.217
   94   2HA   GLY  12          2HA       GLY  12  16.471   5.863  -2.586
   95    H    HIS  13           H        HIS  13  14.097   3.478  -3.538
   96    HA   HIS  13           HA       HIS  13  12.872   4.745  -5.663
   97   1HB   HIS  13          1HB       HIS  13  14.387   3.464  -7.475
   98   2HB   HIS  13          2HB       HIS  13  14.670   5.135  -7.005
   99    HD1  HIS  13           HD1      HIS  13  15.681   2.446  -4.631
  100    HD2  HIS  13           HD2      HIS  13  17.416   4.816  -7.571
  101    HE1  HIS  13           HE1      HIS  13  18.163   2.179  -4.332
  102    HE2  HIS  13           HE2      HIS  13  19.193   3.578  -6.157
  103    H    GLU  14           H        GLU  14  14.642   1.742  -6.168
  104    HA   GLU  14           HA       GLU  14  12.086   0.298  -5.964
  105   1HB   GLU  14          1HB       GLU  14  12.972  -1.289  -7.586
  106   2HB   GLU  14          2HB       GLU  14  13.019   0.344  -8.236
  107   1HG   GLU  14          1HG       GLU  14  15.485   0.131  -7.105
  108   2HG   GLU  14          2HG       GLU  14  15.196  -1.517  -7.661
  109    H    ASN  15           H        ASN  15  12.596  -2.182  -5.684
  110    HA   ASN  15           HA       ASN  15  13.037  -3.729  -4.060
  111   1HB   ASN  15          1HB       ASN  15  15.412  -4.238  -3.800
  112   2HB   ASN  15          2HB       ASN  15  15.037  -3.877  -5.482
  113   1HD2  ASN  15          2HD2      ASN  15  16.914  -3.072  -2.772
  114   2HD2  ASN  15          1HD2      ASN  15  17.740  -1.714  -3.449
  115    H    VAL  16           H        VAL  16  11.834  -2.248  -2.545
  116    HA   VAL  16           HA       VAL  16  13.611  -1.513  -0.313
  117    HB   VAL  16           HB       VAL  16  12.152   0.317   0.297
  118   1HG1  VAL  16          1HG1      VAL  16  13.881   0.327  -1.797
  119   2HG1  VAL  16          2HG1      VAL  16  12.423   0.975  -2.548
  120   3HG1  VAL  16          3HG1      VAL  16  13.109   1.763  -1.126
  121   1HG2  VAL  16          1HG2      VAL  16  10.330  -0.979  -1.535
  122   2HG2  VAL  16          2HG2      VAL  16  10.004   0.218  -0.283
  123   3HG2  VAL  16          3HG2      VAL  16  10.491   0.739  -1.896
  124    H    ASP  17           H        ASP  17  13.206  -2.590   1.493
  125    HA   ASP  17           HA       ASP  17  11.089  -4.469   1.648
  126   1HB   ASP  17          1HB       ASP  17  12.985  -3.502   3.795
  127   2HB   ASP  17          2HB       ASP  17  11.941  -4.915   3.922
  128    H    ILE  18           H        ILE  18   9.065  -4.193   2.276
  129    HA   ILE  18           HA       ILE  18   8.024  -1.732   3.152
  130    HB   ILE  18           HB       ILE  18   6.896  -4.532   3.211
  131   1HG1  ILE  18          1HG1      ILE  18   5.584  -2.573   1.534
  132   2HG1  ILE  18          2HG1      ILE  18   7.298  -2.692   1.156
  133   1HG2  ILE  18          1HG2      ILE  18   5.532  -1.945   3.928
  134   2HG2  ILE  18          2HG2      ILE  18   4.682  -3.446   3.569
  135   3HG2  ILE  18          3HG2      ILE  18   5.764  -3.358   4.957
  136   1HD1  ILE  18          1HD1      ILE  18   6.124  -5.304   1.462
  137   2HD1  ILE  18          2HD1      ILE  18   5.266  -4.348   0.254
  138   3HD1  ILE  18          3HD1      ILE  18   7.003  -4.614   0.098
  139    H    ILE  19           H        ILE  19   6.840  -1.436   5.273
  140    HA   ILE  19           HA       ILE  19   8.282  -2.853   7.418
  141    HB   ILE  19           HB       ILE  19   9.181  -1.031   8.310
  142   1HG1  ILE  19          1HG1      ILE  19   6.641   0.568   7.984
  143   2HG1  ILE  19          2HG1      ILE  19   6.965  -0.488   9.351
  144   1HG2  ILE  19          1HG2      ILE  19   9.118  -0.483   5.721
  145   2HG2  ILE  19          2HG2      ILE  19   8.171   0.888   6.295
  146   3HG2  ILE  19          3HG2      ILE  19   9.802   0.628   6.904
  147   1HD1  ILE  19          1HD1      ILE  19   9.027   0.901   9.759
  148   2HD1  ILE  19          2HD1      ILE  19   8.370   2.043   8.588
  149   3HD1  ILE  19          3HD1      ILE  19   7.475   1.680  10.063
  150    H    ALA  20           H        ALA  20   5.269  -1.949   6.185
  151    HA   ALA  20           HA       ALA  20   3.967  -3.131   8.484
  152   1HB   ALA  20          1HB       ALA  20   4.211  -0.595   8.836
  153   2HB   ALA  20          2HB       ALA  20   2.962  -0.454   7.601
  154   3HB   ALA  20          3HB       ALA  20   2.628  -1.330   9.094
  155    H    VAL  21           H        VAL  21   1.974  -4.026   8.020
  156    HA   VAL  21           HA       VAL  21   0.811  -3.568   5.385
  157    HB   VAL  21           HB       VAL  21   2.367  -5.448   5.061
  158   1HG1  VAL  21          1HG1      VAL  21   2.043  -6.216   7.507
  159   2HG1  VAL  21          2HG1      VAL  21   0.663  -7.114   6.874
  160   3HG1  VAL  21          3HG1      VAL  21   2.283  -7.437   6.257
  161   1HG2  VAL  21          1HG2      VAL  21  -0.246  -5.265   4.256
  162   2HG2  VAL  21          2HG2      VAL  21   0.941  -6.406   3.623
  163   3HG2  VAL  21          3HG2      VAL  21  -0.161  -6.901   4.907
  164    H    GLU  22           H        GLU  22  -1.311  -3.319   5.591
  165    HA   GLU  22           HA       GLU  22  -2.752  -4.923   7.573
  166   1HB   GLU  22          1HB       GLU  22  -4.121  -2.675   7.923
  167   2HB   GLU  22          2HB       GLU  22  -2.713  -3.064   8.900
  168   1HG   GLU  22          1HG       GLU  22  -1.360  -1.728   7.229
  169   2HG   GLU  22          2HG       GLU  22  -2.901  -1.164   6.585
  170    H    VAL  23           H        VAL  23  -2.750  -5.506   4.933
  171    HA   VAL  23           HA       VAL  23  -5.515  -4.921   4.202
  172    HB   VAL  23           HB       VAL  23  -4.796  -4.611   1.794
  173   1HG1  VAL  23          1HG1      VAL  23  -4.395  -2.643   3.990
  174   2HG1  VAL  23          2HG1      VAL  23  -3.934  -2.185   2.351
  175   3HG1  VAL  23          3HG1      VAL  23  -5.596  -2.665   2.697
  176   1HG2  VAL  23          1HG2      VAL  23  -2.220  -4.993   3.016
  177   2HG2  VAL  23          2HG2      VAL  23  -2.647  -4.910   1.308
  178   3HG2  VAL  23          3HG2      VAL  23  -2.292  -3.432   2.199
  179    H    ASN  24           H        ASN  24  -6.519  -6.746   3.733
  180    HA   ASN  24           HA       ASN  24  -4.980  -8.968   2.561
  181   1HB   ASN  24          1HB       ASN  24  -5.889  -8.982   5.119
  182   2HB   ASN  24          2HB       ASN  24  -7.263  -9.688   4.276
  183   1HD2  ASN  24          2HD2      ASN  24  -7.168 -11.790   4.645
  184   2HD2  ASN  24          1HD2      ASN  24  -5.781 -12.794   4.413
  185    H    VAL  25           H        VAL  25  -6.954  -6.837   1.583
  186    HA   VAL  25           HA       VAL  25  -8.537  -6.681  -0.040
  187    HB   VAL  25           HB       VAL  25  -8.037  -9.644  -0.323
  188   1HG1  VAL  25          1HG1      VAL  25 -10.247  -8.968  -1.202
  189   2HG1  VAL  25          2HG1      VAL  25  -9.444  -7.792  -2.242
  190   3HG1  VAL  25          3HG1      VAL  25  -9.145  -9.516  -2.466
  191   1HG2  VAL  25          1HG2      VAL  25  -6.839  -7.205  -1.565
  192   2HG2  VAL  25          2HG2      VAL  25  -6.042  -8.634  -0.908
  193   3HG2  VAL  25          3HG2      VAL  25  -6.878  -8.725  -2.458
  194    H    GLY  26           H        GLY  26 -10.490  -6.167   0.702
  195   1HA   GLY  26          1HA       GLY  26 -12.039  -8.246   2.117
  196   2HA   GLY  26          2HA       GLY  26 -12.768  -7.229   0.883
  197    H    ASP  27           H        ASP  27 -10.426  -5.794   2.963
  198    HA   ASP  27           HA       ASP  27 -12.335  -4.886   4.925
  199   1HB   ASP  27          1HB       ASP  27  -9.711  -5.337   5.110
  200   2HB   ASP  27          2HB       ASP  27  -9.646  -3.628   4.690
  201    H    THR  28           H        THR  28 -13.031  -2.763   5.243
  202    HA   THR  28           HA       THR  28 -13.472  -1.264   2.859
  203    HB   THR  28           HB       THR  28 -14.031  -0.614   5.758
  204    HG1  THR  28           HG1      THR  28 -15.522  -2.036   5.360
  205   1HG2  THR  28          1HG2      THR  28 -14.736   0.877   3.265
  206   2HG2  THR  28          2HG2      THR  28 -15.758   0.948   4.700
  207   3HG2  THR  28          3HG2      THR  28 -14.081   1.490   4.783
  208    H    ILE  29           H        ILE  29 -12.863   0.956   2.495
  209    HA   ILE  29           HA       ILE  29 -10.544   1.922   3.983
  210    HB   ILE  29           HB       ILE  29  -9.300   2.406   1.907
  211   1HG1  ILE  29          1HG1      ILE  29 -10.362   0.578   0.086
  212   2HG1  ILE  29          2HG1      ILE  29 -11.765   1.437   0.717
  213   1HG2  ILE  29          1HG2      ILE  29  -9.403   0.073   3.311
  214   2HG2  ILE  29          2HG2      ILE  29  -9.625  -0.490   1.654
  215   3HG2  ILE  29          3HG2      ILE  29  -8.203   0.462   2.077
  216   1HD1  ILE  29          1HD1      ILE  29  -9.414   3.033  -0.119
  217   2HD1  ILE  29          2HD1      ILE  29 -10.425   2.309  -1.370
  218   3HD1  ILE  29          3HD1      ILE  29 -11.130   3.420  -0.196
  219    H    ALA  30           H        ALA  30 -10.282   4.137   3.951
  220    HA   ALA  30           HA       ALA  30 -12.378   5.649   2.533
  221   1HB   ALA  30          1HB       ALA  30 -12.946   5.794   4.806
  222   2HB   ALA  30          2HB       ALA  30 -12.118   7.309   4.452
  223   3HB   ALA  30          3HB       ALA  30 -11.268   6.017   5.300
  224    H    VAL  31           H        VAL  31 -11.664   8.144   2.675
  225    HA   VAL  31           HA       VAL  31  -9.218   8.254   1.124
  226    HB   VAL  31           HB       VAL  31 -10.962  10.598   1.854
  227   1HG1  VAL  31          1HG1      VAL  31  -8.572  10.432   0.489
  228   2HG1  VAL  31          2HG1      VAL  31  -9.776  10.489  -0.799
  229   3HG1  VAL  31          3HG1      VAL  31  -9.721  11.768   0.415
  230   1HG2  VAL  31          1HG2      VAL  31 -11.757   8.304   0.404
  231   2HG2  VAL  31          2HG2      VAL  31 -12.632   9.822   0.615
  232   3HG2  VAL  31          3HG2      VAL  31 -11.544   9.614  -0.757
  233    H    ASP  32           H        ASP  32  -8.523   7.559   3.641
  234    HA   ASP  32           HA       ASP  32  -6.484   9.170   4.377
  235   1HB   ASP  32          1HB       ASP  32  -7.533  10.281   6.494
  236   2HB   ASP  32          2HB       ASP  32  -7.718  11.068   4.930
  237    H    ASP  33           H        ASP  33  -6.086   6.805   4.581
  238    HA   ASP  33           HA       ASP  33  -6.173   6.066   7.377
  239   1HB   ASP  33          1HB       ASP  33  -7.182   3.842   6.947
  240   2HB   ASP  33          2HB       ASP  33  -8.306   5.162   6.648
  241    H    THR  34           H        THR  34  -4.141   5.501   7.776
  242    HA   THR  34           HA       THR  34  -2.189   4.964   5.923
  243    HB   THR  34           HB       THR  34  -1.276   3.539   8.015
  244    HG1  THR  34           HG1      THR  34  -2.251   4.071   9.812
  245   1HG2  THR  34          1HG2      THR  34  -1.314   6.532   7.806
  246   2HG2  THR  34          2HG2      THR  34  -0.236   5.586   8.832
  247   3HG2  THR  34          3HG2      THR  34  -0.133   5.443   7.076
  248    H    LEU  35           H        LEU  35  -1.966   3.429   4.500
  249    HA   LEU  35           HA       LEU  35  -3.305   0.876   4.839
  250   1HB   LEU  35          1HB       LEU  35  -1.920   2.266   2.578
  251   2HB   LEU  35          2HB       LEU  35  -2.152   0.530   2.507
  252    HG   LEU  35           HG       LEU  35  -4.302   2.639   2.675
  253   1HD1  LEU  35          1HD1      LEU  35  -3.273   0.829   0.533
  254   2HD1  LEU  35          2HD1      LEU  35  -4.960   1.345   0.521
  255   3HD1  LEU  35          3HD1      LEU  35  -3.670   2.547   0.458
  256   1HD2  LEU  35          1HD2      LEU  35  -4.427  -0.343   2.975
  257   2HD2  LEU  35          2HD2      LEU  35  -5.159   0.906   3.982
  258   3HD2  LEU  35          3HD2      LEU  35  -5.802   0.581   2.373
  259    H    ILE  36           H        ILE  36  -0.026   2.168   4.471
  260    HA   ILE  36           HA       ILE  36   1.030  -0.021   6.017
  261    HB   ILE  36           HB       ILE  36   2.773  -0.636   4.312
  262   1HG1  ILE  36          1HG1      ILE  36   2.566  -0.165   2.051
  263   2HG1  ILE  36          2HG1      ILE  36   0.865   0.265   2.183
  264   1HG2  ILE  36          1HG2      ILE  36   0.473  -1.780   4.900
  265   2HG2  ILE  36          2HG2      ILE  36   0.172  -1.466   3.193
  266   3HG2  ILE  36          3HG2      ILE  36   1.566  -2.432   3.682
  267   1HD1  ILE  36          1HD1      ILE  36   3.188   1.923   3.144
  268   2HD1  ILE  36          2HD1      ILE  36   2.257   2.192   1.669
  269   3HD1  ILE  36          3HD1      ILE  36   1.484   2.369   3.246
  270    H    THR  37           H        THR  37   3.570   0.124   5.859
  271    HA   THR  37           HA       THR  37   4.467   2.892   5.718
  272    HB   THR  37           HB       THR  37   4.827   1.112   8.145
  273    HG1  THR  37           HG1      THR  37   3.088   2.101   8.733
  274   1HG2  THR  37          1HG2      THR  37   6.818   2.564   7.534
  275   2HG2  THR  37          2HG2      THR  37   5.780   3.941   7.898
  276   3HG2  THR  37          3HG2      THR  37   6.145   2.758   9.153
  277    H    LEU  38           H        LEU  38   6.166   2.861   4.409
  278    HA   LEU  38           HA       LEU  38   7.771   0.401   4.273
  279   1HB   LEU  38          1HB       LEU  38   7.073   2.489   2.242
  280   2HB   LEU  38          2HB       LEU  38   8.430   1.403   2.000
  281    HG   LEU  38           HG       LEU  38   6.618  -0.449   2.479
  282   1HD1  LEU  38          1HD1      LEU  38   5.068   1.958   2.350
  283   2HD1  LEU  38          2HD1      LEU  38   4.623   0.879   1.027
  284   3HD1  LEU  38          3HD1      LEU  38   4.546   0.309   2.695
  285   1HD2  LEU  38          1HD2      LEU  38   7.537   0.936   0.086
  286   2HD2  LEU  38          2HD2      LEU  38   7.413  -0.791   0.421
  287   3HD2  LEU  38          3HD2      LEU  38   5.997   0.104  -0.131
  288    H    GLU  39           H        GLU  39  10.051   0.812   3.403
  289    HA   GLU  39           HA       GLU  39  11.351   3.265   3.946
  290   1HB   GLU  39          1HB       GLU  39  10.988   2.804   6.259
  291   2HB   GLU  39          2HB       GLU  39  11.493   1.131   6.073
  292   1HG   GLU  39          1HG       GLU  39  13.779   1.951   5.532
  293   2HG   GLU  39          2HG       GLU  39  13.230   3.581   5.914
  294    H    THR  40           H        THR  40  13.677   3.124   3.641
  295    HA   THR  40           HA       THR  40  14.572   0.593   2.452
  296    HB   THR  40           HB       THR  40  14.231   1.663   0.463
  297    HG1  THR  40           HG1      THR  40  16.312   1.428   0.152
  298   1HG2  THR  40          1HG2      THR  40  13.733   3.937   1.881
  299   2HG2  THR  40          2HG2      THR  40  15.202   4.360   1.004
  300   3HG2  THR  40          3HG2      THR  40  13.775   3.814   0.125
  301    H    ASP  41           H        ASP  41  16.337   3.634   2.404
  302    HA   ASP  41           HA       ASP  41  17.928   2.886   4.708
  303   1HB   ASP  41          1HB       ASP  41  18.782   2.306   2.025
  304   2HB   ASP  41          2HB       ASP  41  19.844   3.523   2.727
  305    H    LYS  42           H        LYS  42  16.150   5.104   3.662
  306    HA   LYS  42           HA       LYS  42  17.997   7.291   4.310
  307   1HB   LYS  42          1HB       LYS  42  17.137   6.930   1.771
  308   2HB   LYS  42          2HB       LYS  42  15.835   7.933   2.396
  309   1HG   LYS  42          1HG       LYS  42  17.089   9.761   2.306
  310   2HG   LYS  42          2HG       LYS  42  18.423   8.973   3.150
  311   1HD   LYS  42          1HD       LYS  42  19.477   8.385   1.220
  312   2HD   LYS  42          2HD       LYS  42  17.967   8.206   0.323
  313   1HE   LYS  42          1HE       LYS  42  17.974  10.875   0.840
  314   2HE   LYS  42          2HE       LYS  42  19.698  10.551   0.667
  315   1HZ   LYS  42          1HZ       LYS  42  18.961   9.311  -1.452
  316   2HZ   LYS  42          2HZ       LYS  42  17.547  10.232  -1.318
  317   3HZ   LYS  42          3HZ       LYS  42  19.045  11.002  -1.481
  318    H    ALA  43           H        ALA  43  14.620   6.243   4.027
  319    HA   ALA  43           HA       ALA  43  13.973   7.413   6.563
  320   1HB   ALA  43          1HB       ALA  43  12.849   9.271   5.983
  321   2HB   ALA  43          2HB       ALA  43  12.193   8.540   4.518
  322   3HB   ALA  43          3HB       ALA  43  13.833   9.189   4.522
  323    H    THR  44           H        THR  44  11.569   7.181   7.019
  324    HA   THR  44           HA       THR  44  10.624   4.667   5.815
  325    HB   THR  44           HB       THR  44   9.313   4.386   7.904
  326    HG1  THR  44           HG1      THR  44   9.342   5.854   9.436
  327   1HG2  THR  44          1HG2      THR  44  12.270   4.563   7.964
  328   2HG2  THR  44          2HG2      THR  44  11.410   4.335   9.488
  329   3HG2  THR  44          3HG2      THR  44  11.207   3.171   8.179
  330    H    MET  45           H        MET  45   9.022   4.910   4.411
  331    HA   MET  45           HA       MET  45   7.260   7.241   4.654
  332   1HB   MET  45          1HB       MET  45   8.521   6.027   2.457
  333   2HB   MET  45          2HB       MET  45   6.806   5.677   2.275
  334   1HG   MET  45          1HG       MET  45   7.404   7.721   1.120
  335   2HG   MET  45          2HG       MET  45   6.296   8.054   2.450
  336   1HE   MET  45          1HE       MET  45   7.176  10.215   1.323
  337   2HE   MET  45          2HE       MET  45   8.014  11.246   2.483
  338   3HE   MET  45          3HE       MET  45   8.904  10.523   1.142
  339    H    ASP  46           H        ASP  46   5.030   6.593   3.447
  340    HA   ASP  46           HA       ASP  46   3.896   4.082   4.056
  341   1HB   ASP  46          1HB       ASP  46   2.314   4.957   5.857
  342   2HB   ASP  46          2HB       ASP  46   3.974   4.653   6.360
  343    H    VAL  47           H        VAL  47   1.409   4.222   3.893
  344    HA   VAL  47           HA       VAL  47   0.680   6.438   2.091
  345    HB   VAL  47           HB       VAL  47  -0.077   3.530   1.772
  346   1HG1  VAL  47          1HG1      VAL  47  -1.523   5.823   1.010
  347   2HG1  VAL  47          2HG1      VAL  47  -0.793   5.177  -0.461
  348   3HG1  VAL  47          3HG1      VAL  47  -1.819   4.149   0.540
  349   1HG2  VAL  47          1HG2      VAL  47   2.218   4.127   1.050
  350   2HG2  VAL  47          2HG2      VAL  47   1.184   3.609  -0.283
  351   3HG2  VAL  47          3HG2      VAL  47   1.527   5.324  -0.048
  352    HA   PRO  48           HA       PRO  48  -2.715   6.589   5.018
  353   1HB   PRO  48          1HB       PRO  48  -3.595   9.025   4.419
  354   2HB   PRO  48          2HB       PRO  48  -2.021   8.801   5.195
  355   1HG   PRO  48          1HG       PRO  48  -2.660   9.399   2.342
  356   2HG   PRO  48          2HG       PRO  48  -1.325   9.996   3.343
  357   1HD   PRO  48          1HD       PRO  48  -1.192   7.882   1.506
  358   2HD   PRO  48          2HD       PRO  48   0.000   8.243   2.770
  359    H    ALA  49           H        ALA  49  -2.981   5.393   2.218
  360    HA   ALA  49           HA       ALA  49  -4.636   4.651   0.850
  361   1HB   ALA  49          1HB       ALA  49  -7.033   4.965   1.934
  362   2HB   ALA  49          2HB       ALA  49  -5.897   3.752   2.520
  363   3HB   ALA  49          3HB       ALA  49  -6.065   5.286   3.372
  364    H    GLU  50           H        GLU  50  -6.118   5.341  -0.725
  365    HA   GLU  50           HA       GLU  50  -7.037   8.091  -0.682
  366   1HB   GLU  50          1HB       GLU  50  -4.714   8.105  -1.672
  367   2HB   GLU  50          2HB       GLU  50  -5.345   7.120  -2.985
  368   1HG   GLU  50          1HG       GLU  50  -7.059   8.994  -3.310
  369   2HG   GLU  50          2HG       GLU  50  -5.990   9.960  -2.295
  370    H    VAL  51           H        VAL  51  -8.939   6.622  -0.460
  371    HA   VAL  51           HA       VAL  51 -10.431   6.573  -2.834
  372    HB   VAL  51           HB       VAL  51 -10.622   3.852  -2.521
  373   1HG1  VAL  51          1HG1      VAL  51 -10.231   5.586  -4.541
  374   2HG1  VAL  51          2HG1      VAL  51  -8.682   4.746  -4.544
  375   3HG1  VAL  51          3HG1      VAL  51 -10.180   3.834  -4.727
  376   1HG2  VAL  51          1HG2      VAL  51  -8.314   4.294  -1.208
  377   2HG2  VAL  51          2HG2      VAL  51  -8.634   2.828  -2.132
  378   3HG2  VAL  51          3HG2      VAL  51  -7.695   4.136  -2.852
  379    H    ALA  52           H        ALA  52 -12.424   4.927  -2.449
  380    HA   ALA  52           HA       ALA  52 -13.117   4.836   0.383
  381   1HB   ALA  52          1HB       ALA  52 -14.622   6.466  -1.637
  382   2HB   ALA  52          2HB       ALA  52 -15.278   5.993  -0.070
  383   3HB   ALA  52          3HB       ALA  52 -13.849   7.024  -0.149
  384    H    GLY  53           H        GLY  53 -12.825   2.547  -0.503
  385   1HA   GLY  53          1HA       GLY  53 -14.389   1.241  -2.281
  386   2HA   GLY  53          2HA       GLY  53 -15.473   1.478  -0.923
  387    H    VAL  54           H        VAL  54 -13.952  -0.874  -2.258
  388    HA   VAL  54           HA       VAL  54 -12.868  -2.024   0.233
  389    HB   VAL  54           HB       VAL  54 -14.592  -3.411  -1.827
  390   1HG1  VAL  54          1HG1      VAL  54 -12.734  -4.444   0.146
  391   2HG1  VAL  54          2HG1      VAL  54 -14.374  -5.039   0.411
  392   3HG1  VAL  54          3HG1      VAL  54 -13.587  -5.284  -1.149
  393   1HG2  VAL  54          1HG2      VAL  54 -15.216  -1.955   0.573
  394   2HG2  VAL  54          2HG2      VAL  54 -16.303  -2.682  -0.611
  395   3HG2  VAL  54          3HG2      VAL  54 -15.697  -3.644   0.737
  396    H    VAL  55           H        VAL  55 -11.092  -3.391   0.037
  397    HA   VAL  55           HA       VAL  55  -9.505  -3.030  -2.325
  398    HB   VAL  55           HB       VAL  55  -8.954  -4.745   0.099
  399   1HG1  VAL  55          1HG1      VAL  55  -7.729  -5.428  -1.973
  400   2HG1  VAL  55          2HG1      VAL  55  -7.027  -3.810  -2.031
  401   3HG1  VAL  55          3HG1      VAL  55  -6.677  -4.873  -0.669
  402   1HG2  VAL  55          1HG2      VAL  55  -9.186  -2.186   0.332
  403   2HG2  VAL  55          2HG2      VAL  55  -7.751  -2.963   1.000
  404   3HG2  VAL  55          3HG2      VAL  55  -7.658  -2.120  -0.547
  405    H    LYS  56           H        LYS  56  -8.813  -4.548  -3.771
  406    HA   LYS  56           HA       LYS  56 -10.360  -7.056  -3.847
  407   1HB   LYS  56          1HB       LYS  56  -9.209  -6.415  -6.398
  408   2HB   LYS  56          2HB       LYS  56 -10.904  -6.636  -5.981
  409   1HG   LYS  56          1HG       LYS  56  -9.468  -4.041  -5.516
  410   2HG   LYS  56          2HG       LYS  56 -10.245  -4.431  -7.051
  411   1HD   LYS  56          1HD       LYS  56 -11.660  -4.487  -4.389
  412   2HD   LYS  56          2HD       LYS  56 -11.654  -3.090  -5.468
  413   1HE   LYS  56          1HE       LYS  56 -13.485  -3.990  -6.379
  414   2HE   LYS  56          2HE       LYS  56 -12.384  -5.138  -7.140
  415   1HZ   LYS  56          1HZ       LYS  56 -12.711  -6.359  -4.846
  416   2HZ   LYS  56          2HZ       LYS  56 -14.174  -5.510  -4.858
  417   3HZ   LYS  56          3HZ       LYS  56 -13.801  -6.570  -6.123
  418    H    GLU  57           H        GLU  57  -7.310  -5.504  -4.715
  419    HA   GLU  57           HA       GLU  57  -6.049  -8.130  -4.593
  420   1HB   GLU  57          1HB       GLU  57  -5.615  -5.779  -6.331
  421   2HB   GLU  57          2HB       GLU  57  -4.173  -6.656  -5.836
  422   1HG   GLU  57          1HG       GLU  57  -6.387  -8.318  -6.822
  423   2HG   GLU  57          2HG       GLU  57  -5.644  -7.248  -8.012
  424    H    VAL  58           H        VAL  58  -3.582  -7.869  -4.107
  425    HA   VAL  58           HA       VAL  58  -2.821  -5.805  -2.277
  426    HB   VAL  58           HB       VAL  58  -4.267  -7.099  -0.778
  427   1HG1  VAL  58          1HG1      VAL  58  -3.466  -9.282  -2.174
  428   2HG1  VAL  58          2HG1      VAL  58  -2.505  -9.445  -0.704
  429   3HG1  VAL  58          3HG1      VAL  58  -4.262  -9.339  -0.601
  430   1HG2  VAL  58          1HG2      VAL  58  -1.732  -6.234  -0.269
  431   2HG2  VAL  58          2HG2      VAL  58  -2.869  -6.809   0.953
  432   3HG2  VAL  58          3HG2      VAL  58  -1.660  -7.907   0.287
  433    H    LYS  59           H        LYS  59  -0.745  -5.550  -2.688
  434    HA   LYS  59           HA       LYS  59   0.938  -7.924  -3.111
  435   1HB   LYS  59          1HB       LYS  59   1.514  -5.422  -4.635
  436   2HB   LYS  59          2HB       LYS  59   1.899  -7.090  -5.041
  437   1HG   LYS  59          1HG       LYS  59  -0.847  -7.076  -5.070
  438   2HG   LYS  59          2HG       LYS  59  -0.433  -5.488  -5.720
  439   1HD   LYS  59          1HD       LYS  59   1.252  -6.827  -7.184
  440   2HD   LYS  59          2HD       LYS  59   0.223  -8.203  -6.786
  441   1HE   LYS  59          1HE       LYS  59  -1.586  -6.251  -7.497
  442   2HE   LYS  59          2HE       LYS  59  -0.245  -5.978  -8.609
  443   1HZ   LYS  59          1HZ       LYS  59  -1.377  -8.676  -8.186
  444   2HZ   LYS  59          2HZ       LYS  59  -2.042  -7.607  -9.315
  445   3HZ   LYS  59          3HZ       LYS  59  -0.438  -8.118  -9.478
  446    H    VAL  60           H        VAL  60   1.147  -7.285  -0.726
  447    HA   VAL  60           HA       VAL  60   3.692  -6.131  -0.339
  448    HB   VAL  60           HB       VAL  60   2.896  -3.976  -0.551
  449   1HG1  VAL  60          1HG1      VAL  60   0.348  -4.829   0.809
  450   2HG1  VAL  60          2HG1      VAL  60   0.710  -3.189   0.272
  451   3HG1  VAL  60          3HG1      VAL  60   0.573  -4.493  -0.909
  452   1HG2  VAL  60          1HG2      VAL  60   3.943  -4.293   1.686
  453   2HG2  VAL  60          2HG2      VAL  60   2.823  -2.934   1.606
  454   3HG2  VAL  60          3HG2      VAL  60   2.326  -4.443   2.373
  455    H    LYS  61           H        LYS  61   4.369  -6.180   1.885
  456    HA   LYS  61           HA       LYS  61   2.711  -7.121   3.979
  457   1HB   LYS  61          1HB       LYS  61   3.258  -9.136   2.264
  458   2HB   LYS  61          2HB       LYS  61   4.661  -9.249   3.319
  459   1HG   LYS  61          1HG       LYS  61   3.313 -10.591   4.512
  460   2HG   LYS  61          2HG       LYS  61   2.708  -9.065   5.159
  461   1HD   LYS  61          1HD       LYS  61   0.806 -10.343   4.543
  462   2HD   LYS  61          2HD       LYS  61   0.994  -9.094   3.310
  463   1HE   LYS  61          1HE       LYS  61   1.833 -10.617   1.737
  464   2HE   LYS  61          2HE       LYS  61   2.173 -11.832   2.968
  465   1HZ   LYS  61          1HZ       LYS  61  -0.603 -10.975   2.553
  466   2HZ   LYS  61          2HZ       LYS  61   0.092 -12.039   1.438
  467   3HZ   LYS  61          3HZ       LYS  61  -0.006 -12.470   3.071
  468    H    VAL  62           H        VAL  62   4.683  -8.587   5.414
  469    HA   VAL  62           HA       VAL  62   6.657  -6.451   5.878
  470    HB   VAL  62           HB       VAL  62   5.595  -8.481   7.847
  471   1HG1  VAL  62          1HG1      VAL  62   7.909  -7.862   8.310
  472   2HG1  VAL  62          2HG1      VAL  62   7.470  -6.155   8.256
  473   3HG1  VAL  62          3HG1      VAL  62   6.820  -7.191   9.526
  474   1HG2  VAL  62          1HG2      VAL  62   4.234  -6.347   6.952
  475   2HG2  VAL  62          2HG2      VAL  62   4.106  -6.956   8.601
  476   3HG2  VAL  62          3HG2      VAL  62   5.161  -5.589   8.246
  477    H    GLY  63           H        GLY  63   8.348  -7.147   4.619
  478   1HA   GLY  63          1HA       GLY  63   9.327  -9.886   5.068
  479   2HA   GLY  63          2HA       GLY  63  10.410  -8.527   5.323
  480    H    ASP  64           H        ASP  64   8.159  -8.094   2.789
  481    HA   ASP  64           HA       ASP  64  10.010  -9.123   0.773
  482   1HB   ASP  64          1HB       ASP  64   8.092  -8.495  -0.800
  483   2HB   ASP  64          2HB       ASP  64   7.797  -9.814   0.329
  484    H    LYS  65           H        LYS  65  10.376  -7.773  -1.181
  485    HA   LYS  65           HA       LYS  65  10.929  -5.010  -0.370
  486   1HB   LYS  65          1HB       LYS  65  12.263  -5.239  -2.704
  487   2HB   LYS  65          2HB       LYS  65  12.960  -5.641  -1.143
  488   1HG   LYS  65          1HG       LYS  65  13.464  -7.386  -2.703
  489   2HG   LYS  65          2HG       LYS  65  12.317  -8.002  -1.510
  490   1HD   LYS  65          1HD       LYS  65  10.914  -8.559  -3.138
  491   2HD   LYS  65          2HD       LYS  65  10.843  -6.874  -3.658
  492   1HE   LYS  65          1HE       LYS  65  11.776  -7.575  -5.561
  493   2HE   LYS  65          2HE       LYS  65  13.269  -7.728  -4.637
  494   1HZ   LYS  65          1HZ       LYS  65  11.390  -9.968  -4.574
  495   2HZ   LYS  65          2HZ       LYS  65  12.277  -9.730  -5.994
  496   3HZ   LYS  65          3HZ       LYS  65  13.082  -9.975  -4.527
  497    H    ILE  66           H        ILE  66  10.394  -3.256  -1.702
  498    HA   ILE  66           HA       ILE  66   8.589  -3.809  -3.930
  499    HB   ILE  66           HB       ILE  66   7.611  -3.165  -1.463
  500   1HG1  ILE  66          1HG1      ILE  66   5.498  -2.692  -2.679
  501   2HG1  ILE  66          2HG1      ILE  66   6.423  -2.630  -4.180
  502   1HG2  ILE  66          1HG2      ILE  66   7.772  -0.582  -2.992
  503   2HG2  ILE  66          2HG2      ILE  66   6.635  -0.883  -1.685
  504   3HG2  ILE  66          3HG2      ILE  66   8.367  -0.919  -1.370
  505   1HD1  ILE  66          1HD1      ILE  66   7.084  -5.021  -2.797
  506   2HD1  ILE  66          2HD1      ILE  66   5.327  -4.883  -2.898
  507   3HD1  ILE  66          3HD1      ILE  66   6.301  -4.824  -4.368
  508    H    SER  67           H        SER  67   7.963  -1.590  -5.007
  509    HA   SER  67           HA       SER  67  10.205   0.283  -4.947
  510   1HB   SER  67          1HB       SER  67   9.230  -0.885  -7.557
  511   2HB   SER  67          2HB       SER  67  10.622   0.167  -7.299
  512    HG   SER  67           HG       SER  67  10.338  -2.560  -6.847
  513    H    GLU  68           H        GLU  68   9.655   2.358  -5.375
  514    HA   GLU  68           HA       GLU  68   7.205   3.405  -4.999
  515   1HB   GLU  68          1HB       GLU  68   9.255   4.489  -6.935
  516   2HB   GLU  68          2HB       GLU  68   7.945   5.411  -6.210
  517   1HG   GLU  68          1HG       GLU  68   8.903   5.059  -4.002
  518   2HG   GLU  68          2HG       GLU  68  10.205   4.107  -4.711
  519    H    GLY  69           H        GLY  69   5.302   3.048  -5.939
  520   1HA   GLY  69          1HA       GLY  69   4.893   3.451  -8.727
  521   2HA   GLY  69          2HA       GLY  69   3.696   2.875  -7.576
  522    H    GLY  70           H        GLY  70   3.906   0.552  -6.912
  523   1HA   GLY  70          1HA       GLY  70   5.202  -1.527  -7.723
  524   2HA   GLY  70          2HA       GLY  70   4.603  -1.029  -9.298
  525    H    LEU  71           H        LEU  71   2.039  -0.114  -8.221
  526    HA   LEU  71           HA       LEU  71  -0.036  -0.891  -7.688
  527   1HB   LEU  71          1HB       LEU  71   0.380  -1.940  -9.904
  528   2HB   LEU  71          2HB       LEU  71   0.962  -3.374  -9.079
  529    HG   LEU  71           HG       LEU  71  -1.193  -3.877  -8.215
  530   1HD1  LEU  71          1HD1      LEU  71  -1.673  -1.033  -8.728
  531   2HD1  LEU  71          2HD1      LEU  71  -3.024  -2.089  -9.141
  532   3HD1  LEU  71          3HD1      LEU  71  -2.364  -2.101  -7.506
  533   1HD2  LEU  71          1HD2      LEU  71  -1.279  -3.000 -11.091
  534   2HD2  LEU  71          2HD2      LEU  71  -1.005  -4.620 -10.451
  535   3HD2  LEU  71          3HD2      LEU  71  -2.599  -3.876 -10.318
  536    H    ILE  72           H        ILE  72  -0.046  -1.016  -5.481
  537    HA   ILE  72           HA       ILE  72   0.924  -3.460  -4.220
  538    HB   ILE  72           HB       ILE  72   0.468  -0.687  -3.326
  539   1HG1  ILE  72          1HG1      ILE  72   2.268  -2.460  -1.837
  540   2HG1  ILE  72          2HG1      ILE  72   2.590  -2.391  -3.568
  541   1HG2  ILE  72          1HG2      ILE  72  -0.403  -2.984  -1.636
  542   2HG2  ILE  72          2HG2      ILE  72   0.450  -1.642  -0.871
  543   3HG2  ILE  72          3HG2      ILE  72  -1.055  -1.349  -1.742
  544   1HD1  ILE  72          1HD1      ILE  72   2.208   0.149  -2.074
  545   2HD1  ILE  72          2HD1      ILE  72   3.734  -0.724  -1.922
  546   3HD1  ILE  72          3HD1      ILE  72   3.178  -0.187  -3.507
  547    H    VAL  73           H        VAL  73  -1.936  -1.442  -3.495
  548    HA   VAL  73           HA       VAL  73  -3.541  -3.912  -3.563
  549    HB   VAL  73           HB       VAL  73  -4.855  -3.140  -1.686
  550   1HG1  VAL  73          1HG1      VAL  73  -2.215  -4.002  -1.555
  551   2HG1  VAL  73          2HG1      VAL  73  -2.319  -2.691  -0.379
  552   3HG1  VAL  73          3HG1      VAL  73  -3.418  -4.067  -0.266
  553   1HG2  VAL  73          1HG2      VAL  73  -4.685  -0.732  -2.120
  554   2HG2  VAL  73          2HG2      VAL  73  -4.299  -1.126  -0.444
  555   3HG2  VAL  73          3HG2      VAL  73  -3.005  -0.760  -1.584
  556    H    VAL  74           H        VAL  74  -5.468  -3.837  -4.556
  557    HA   VAL  74           HA       VAL  74  -6.226  -1.295  -5.832
  558    HB   VAL  74           HB       VAL  74  -7.014  -4.125  -6.556
  559   1HG1  VAL  74          1HG1      VAL  74  -8.587  -2.128  -7.090
  560   2HG1  VAL  74          2HG1      VAL  74  -7.391  -1.748  -8.328
  561   3HG1  VAL  74          3HG1      VAL  74  -8.218  -3.304  -8.351
  562   1HG2  VAL  74          1HG2      VAL  74  -4.670  -2.577  -7.168
  563   2HG2  VAL  74          2HG2      VAL  74  -5.043  -4.253  -7.574
  564   3HG2  VAL  74          3HG2      VAL  74  -5.565  -2.948  -8.641
  565    H    VAL  75           H        VAL  75  -8.297  -0.471  -5.575
  566    HA   VAL  75           HA       VAL  75 -10.053  -1.949  -3.749
  567    HB   VAL  75           HB       VAL  75 -10.705   0.151  -2.712
  568   1HG1  VAL  75          1HG1      VAL  75  -8.713  -1.253  -1.935
  569   2HG1  VAL  75          2HG1      VAL  75  -7.713   0.030  -2.615
  570   3HG1  VAL  75          3HG1      VAL  75  -8.847   0.391  -1.313
  571   1HG2  VAL  75          1HG2      VAL  75  -9.804   1.368  -4.939
  572   2HG2  VAL  75          2HG2      VAL  75 -10.088   2.199  -3.409
  573   3HG2  VAL  75          3HG2      VAL  75  -8.460   1.673  -3.839
  574    H    GLU  76           H        GLU  76 -12.295  -0.957  -3.695
  575    HA   GLU  76           HA       GLU  76 -13.282  -0.866  -6.414
  576   1HB   GLU  76          1HB       GLU  76 -14.268  -1.875  -4.025
  577   2HB   GLU  76          2HB       GLU  76 -15.242  -0.433  -4.290
  578   1HG   GLU  76          1HG       GLU  76 -14.845  -2.471  -6.449
  579   2HG   GLU  76          2HG       GLU  76 -16.097  -2.648  -5.220
  580    H    ALA  77           H        ALA  77 -13.080   1.228  -3.599
  581    HA   ALA  77           HA       ALA  77 -13.372   3.448  -3.280
  582   1HB   ALA  77          1HB       ALA  77 -12.120   4.658  -4.659
  583   2HB   ALA  77          2HB       ALA  77 -13.095   4.238  -6.066
  584   3HB   ALA  77          3HB       ALA  77 -11.833   3.140  -5.508
  585    H    GLU  78           H        GLU  78 -14.992   4.894  -3.126
  586    HA   GLU  78           HA       GLU  78 -17.207   5.494  -3.126
  587   1HB   GLU  78          1HB       GLU  78 -15.841   6.425  -5.322
  588   2HB   GLU  78          2HB       GLU  78 -17.301   5.751  -6.038
  589   1HG   GLU  78          1HG       GLU  78 -18.607   7.104  -4.371
  590   2HG   GLU  78          2HG       GLU  78 -17.091   7.899  -3.950
  591    H    GLY  79           H        GLY  79 -17.011   2.695  -3.143
  592   1HA   GLY  79          1HA       GLY  79 -18.043   0.755  -3.984
  593   2HA   GLY  79          2HA       GLY  79 -18.939   1.750  -5.122
  594    H    THR  80           H        THR  80 -20.787   0.459  -4.472
  595    HA   THR  80           HA       THR  80 -21.881   1.243  -1.854
  596    HB   THR  80           HB       THR  80 -24.000   1.714  -2.781
  597    HG1  THR  80           HG1      THR  80 -24.555   1.195  -4.882
  598   1HG2  THR  80          1HG2      THR  80 -21.779   3.105  -3.772
  599   2HG2  THR  80          2HG2      THR  80 -22.882   2.885  -5.131
  600   3HG2  THR  80          3HG2      THR  80 -23.448   3.664  -3.652
  601    H    ALA  81           H        ALA  81 -23.793  -0.165  -1.235
  602    HA   ALA  81           HA       ALA  81 -23.298  -2.944  -2.092
  603   1HB   ALA  81          1HB       ALA  81 -24.073  -2.000   0.667
  604   2HB   ALA  81          2HB       ALA  81 -22.462  -2.526   0.175
  605   3HB   ALA  81          3HB       ALA  81 -23.804  -3.672   0.174

  No H/Q in entry =         605
  Start of MODEL    2
    1    H1   ALA   1           H1       ALA   1 -12.479   3.689 -11.859
    2    H2   ALA   1           H2       ALA   1 -13.919   4.305 -12.554
    3    H3   ALA   1           H3       ALA   1 -13.086   5.215 -11.361
    4    HA   ALA   1           HA       ALA   1 -14.788   4.329 -10.196
    5   1HB   ALA   1          1HB       ALA   1 -14.719   2.348 -12.269
    6   2HB   ALA   1          2HB       ALA   1 -16.027   2.762 -11.159
    7   3HB   ALA   1          3HB       ALA   1 -14.815   1.571 -10.688
    8    H    LEU   2           H        LEU   2 -12.651   1.559 -10.754
    9    HA   LEU   2           HA       LEU   2 -12.120   1.301  -7.943
   10   1HB   LEU   2          1HB       LEU   2 -10.811  -0.135 -10.252
   11   2HB   LEU   2          2HB       LEU   2 -10.788  -0.624  -8.569
   12    HG   LEU   2           HG       LEU   2 -13.510  -0.380  -9.392
   13   1HD1  LEU   2          1HD1      LEU   2 -11.686  -1.552 -11.394
   14   2HD1  LEU   2          2HD1      LEU   2 -13.135  -2.481 -11.013
   15   3HD1  LEU   2          3HD1      LEU   2 -13.279  -0.822 -11.593
   16   1HD2  LEU   2          1HD2      LEU   2 -12.026  -1.949  -7.748
   17   2HD2  LEU   2          2HD2      LEU   2 -13.690  -2.287  -8.223
   18   3HD2  LEU   2          3HD2      LEU   2 -12.354  -3.057  -9.079
   19    H    VAL   3           H        VAL   3  -9.750   0.890  -7.291
   20    HA   VAL   3           HA       VAL   3  -7.963   2.854  -8.537
   21    HB   VAL   3           HB       VAL   3  -8.729   2.735  -5.626
   22   1HG1  VAL   3          1HG1      VAL   3  -6.303   4.098  -6.798
   23   2HG1  VAL   3          2HG1      VAL   3  -6.895   4.310  -5.151
   24   3HG1  VAL   3          3HG1      VAL   3  -6.298   2.733  -5.678
   25   1HG2  VAL   3          1HG2      VAL   3  -8.881   4.749  -7.816
   26   2HG2  VAL   3          2HG2      VAL   3 -10.096   4.282  -6.626
   27   3HG2  VAL   3          3HG2      VAL   3  -8.738   5.300  -6.146
   28    H    GLU   4           H        GLU   4  -5.716   2.574  -7.948
   29    HA   GLU   4           HA       GLU   4  -5.029  -0.081  -6.911
   30   1HB   GLU   4          1HB       GLU   4  -3.110   0.370  -8.859
   31   2HB   GLU   4          2HB       GLU   4  -4.447  -0.764  -8.965
   32   1HG   GLU   4          1HG       GLU   4  -5.813   1.046  -9.991
   33   2HG   GLU   4          2HG       GLU   4  -4.365   2.052 -10.018
   34    H    LEU   5           H        LEU   5  -3.937   0.371  -5.120
   35    HA   LEU   5           HA       LEU   5  -2.581   2.783  -4.618
   36   1HB   LEU   5          1HB       LEU   5  -3.447   0.809  -3.052
   37   2HB   LEU   5          2HB       LEU   5  -1.766   0.324  -3.163
   38    HG   LEU   5           HG       LEU   5  -1.281   2.795  -2.473
   39   1HD1  LEU   5          1HD1      LEU   5  -3.812   3.277  -2.692
   40   2HD1  LEU   5          2HD1      LEU   5  -3.924   2.519  -1.104
   41   3HD1  LEU   5          3HD1      LEU   5  -2.924   3.954  -1.328
   42   1HD2  LEU   5          1HD2      LEU   5  -1.731   0.358  -1.024
   43   2HD2  LEU   5          2HD2      LEU   5  -0.541   1.628  -0.739
   44   3HD2  LEU   5          3HD2      LEU   5  -2.150   1.751  -0.027
   45    H    LYS   6           H        LYS   6  -0.284   3.035  -4.122
   46    HA   LYS   6           HA       LYS   6   1.535   1.244  -5.525
   47   1HB   LYS   6          1HB       LYS   6   1.033   4.109  -6.275
   48   2HB   LYS   6          2HB       LYS   6   2.609   3.381  -6.547
   49   1HG   LYS   6          1HG       LYS   6   1.814   2.709  -8.508
   50   2HG   LYS   6          2HG       LYS   6   0.857   1.532  -7.606
   51   1HD   LYS   6          1HD       LYS   6  -0.954   3.212  -7.428
   52   2HD   LYS   6          2HD       LYS   6  -0.003   4.300  -8.439
   53   1HE   LYS   6          1HE       LYS   6  -0.114   1.816  -9.774
   54   2HE   LYS   6          2HE       LYS   6  -1.750   2.174  -9.221
   55   1HZ   LYS   6          1HZ       LYS   6  -1.114   4.525 -10.208
   56   2HZ   LYS   6          2HZ       LYS   6  -0.098   3.580 -11.174
   57   3HZ   LYS   6          3HZ       LYS   6  -1.766   3.298 -11.171
   58    H    VAL   7           H        VAL   7   3.542   1.181  -4.656
   59    HA   VAL   7           HA       VAL   7   4.066   1.771  -2.063
   60    HB   VAL   7           HB       VAL   7   6.056   1.771  -4.336
   61   1HG1  VAL   7          1HG1      VAL   7   6.825   2.810  -2.127
   62   2HG1  VAL   7          2HG1      VAL   7   6.700   1.179  -1.471
   63   3HG1  VAL   7          3HG1      VAL   7   7.802   1.510  -2.805
   64   1HG2  VAL   7          1HG2      VAL   7   4.694  -0.267  -4.122
   65   2HG2  VAL   7          2HG2      VAL   7   6.397  -0.550  -3.781
   66   3HG2  VAL   7          3HG2      VAL   7   5.243  -0.434  -2.455
   67    HA   PRO   8           HA       PRO   8   4.417   6.179  -1.819
   68   1HB   PRO   8          1HB       PRO   8   5.610   6.413   0.588
   69   2HB   PRO   8          2HB       PRO   8   3.922   5.917   0.409
   70   1HG   PRO   8          1HG       PRO   8   6.348   4.239   0.909
   71   2HG   PRO   8          2HG       PRO   8   4.728   4.104   1.618
   72   1HD   PRO   8          1HD       PRO   8   5.625   2.527  -0.427
   73   2HD   PRO   8          2HD       PRO   8   3.914   2.918  -0.169
   74    H    ASP   9           H        ASP   9   6.245   7.732  -0.750
   75    HA   ASP   9           HA       ASP   9   8.499   7.468  -2.540
   76   1HB   ASP   9          1HB       ASP   9   7.439   9.639  -2.304
   77   2HB   ASP   9          2HB       ASP   9   7.718   9.619  -0.565
   78    H    ILE  10           H        ILE  10   9.800   5.838  -1.764
   79    HA   ILE  10           HA       ILE  10  10.770   6.057   0.993
   80    HB   ILE  10           HB       ILE  10  11.974   3.822   0.204
   81   1HG1  ILE  10          1HG1      ILE  10  10.502   2.512  -1.274
   82   2HG1  ILE  10          2HG1      ILE  10   9.491   3.931  -1.522
   83   1HG2  ILE  10          1HG2      ILE  10  10.340   4.172   2.062
   84   2HG2  ILE  10          2HG2      ILE  10   9.049   3.834   0.906
   85   3HG2  ILE  10          3HG2      ILE  10  10.246   2.593   1.281
   86   1HD1  ILE  10          1HD1      ILE  10  11.475   5.076  -2.502
   87   2HD1  ILE  10          2HD1      ILE  10  12.336   3.541  -2.404
   88   3HD1  ILE  10          3HD1      ILE  10  10.900   3.683  -3.418
   89    H    GLY  11           H        GLY  11  11.856   8.076   0.008
   90   1HA   GLY  11          1HA       GLY  11  14.639   7.352  -0.446
   91   2HA   GLY  11          2HA       GLY  11  14.027   8.954  -0.066
   92    H    GLY  12           H        GLY  12  14.672   6.644  -2.590
   93   1HA   GLY  12          1HA       GLY  12  15.171   8.628  -4.523
   94   2HA   GLY  12          2HA       GLY  12  13.548   8.000  -4.771
   95    H    HIS  13           H        HIS  13  14.165   5.313  -3.912
   96    HA   HIS  13           HA       HIS  13  15.441   4.399  -6.366
   97   1HB   HIS  13          1HB       HIS  13  16.609   2.617  -4.759
   98   2HB   HIS  13          2HB       HIS  13  17.382   4.139  -5.183
   99    HD1  HIS  13           HD1      HIS  13  18.686   4.581  -3.090
  100    HD2  HIS  13           HD2      HIS  13  14.689   3.737  -2.327
  101    HE1  HIS  13           HE1      HIS  13  18.358   5.037  -0.640
  102    HE2  HIS  13           HE2      HIS  13  15.910   4.618  -0.224
  103    H    GLU  14           H        GLU  14  15.073   2.099  -6.775
  104    HA   GLU  14           HA       GLU  14  12.419   1.330  -5.876
  105   1HB   GLU  14          1HB       GLU  14  12.723  -0.503  -7.597
  106   2HB   GLU  14          2HB       GLU  14  12.728   1.142  -8.217
  107   1HG   GLU  14          1HG       GLU  14  15.066   1.121  -8.527
  108   2HG   GLU  14          2HG       GLU  14  15.250  -0.356  -7.582
  109    H    ASN  15           H        ASN  15  12.267  -1.262  -5.859
  110    HA   ASN  15           HA       ASN  15  12.428  -3.013  -4.407
  111   1HB   ASN  15          1HB       ASN  15  14.594  -4.120  -4.404
  112   2HB   ASN  15          2HB       ASN  15  14.246  -3.489  -6.010
  113   1HD2  ASN  15          2HD2      ASN  15  16.347  -3.419  -3.320
  114   2HD2  ASN  15          1HD2      ASN  15  17.482  -2.277  -3.947
  115    H    VAL  16           H        VAL  16  11.718  -2.264  -2.461
  116    HA   VAL  16           HA       VAL  16  13.811  -1.691  -0.488
  117    HB   VAL  16           HB       VAL  16  12.030  -0.094   0.577
  118   1HG1  VAL  16          1HG1      VAL  16  14.163   0.333  -1.371
  119   2HG1  VAL  16          2HG1      VAL  16  13.012   1.666  -1.277
  120   3HG1  VAL  16          3HG1      VAL  16  13.860   1.127   0.173
  121   1HG2  VAL  16          1HG2      VAL  16  10.683  -0.757  -1.748
  122   2HG2  VAL  16          2HG2      VAL  16  10.300   0.575  -0.658
  123   3HG2  VAL  16          3HG2      VAL  16  11.321   0.855  -2.069
  124    H    ASP  17           H        ASP  17  12.937  -1.899   1.782
  125    HA   ASP  17           HA       ASP  17  11.198  -4.247   1.866
  126   1HB   ASP  17          1HB       ASP  17  13.109  -3.068   3.883
  127   2HB   ASP  17          2HB       ASP  17  12.046  -4.428   4.238
  128    H    ILE  18           H        ILE  18   9.238  -4.268   2.779
  129    HA   ILE  18           HA       ILE  18   7.998  -1.797   3.506
  130    HB   ILE  18           HB       ILE  18   7.031  -4.657   3.500
  131   1HG1  ILE  18          1HG1      ILE  18   5.771  -2.524   1.884
  132   2HG1  ILE  18          2HG1      ILE  18   7.409  -2.977   1.428
  133   1HG2  ILE  18          1HG2      ILE  18   5.498  -2.179   4.268
  134   2HG2  ILE  18          2HG2      ILE  18   4.759  -3.737   3.895
  135   3HG2  ILE  18          3HG2      ILE  18   5.837  -3.582   5.282
  136   1HD1  ILE  18          1HD1      ILE  18   5.748  -5.297   1.871
  137   2HD1  ILE  18          2HD1      ILE  18   5.068  -4.220   0.651
  138   3HD1  ILE  18          3HD1      ILE  18   6.707  -4.844   0.462
  139    H    ILE  19           H        ILE  19   6.784  -1.556   5.581
  140    HA   ILE  19           HA       ILE  19   8.167  -2.924   7.784
  141    HB   ILE  19           HB       ILE  19   9.296  -1.025   8.188
  142   1HG1  ILE  19          1HG1      ILE  19   6.586  -0.166   9.210
  143   2HG1  ILE  19          2HG1      ILE  19   7.851  -0.992  10.112
  144   1HG2  ILE  19          1HG2      ILE  19   8.236  -0.070   5.976
  145   2HG2  ILE  19          2HG2      ILE  19   7.352   0.943   7.115
  146   3HG2  ILE  19          3HG2      ILE  19   9.109   0.966   7.099
  147   1HD1  ILE  19          1HD1      ILE  19   8.905   1.433   9.062
  148   2HD1  ILE  19          2HD1      ILE  19   7.375   1.769   9.874
  149   3HD1  ILE  19          3HD1      ILE  19   8.675   0.955  10.746
  150    H    ALA  20           H        ALA  20   5.210  -2.124   6.409
  151    HA   ALA  20           HA       ALA  20   3.847  -3.056   8.794
  152   1HB   ALA  20          1HB       ALA  20   4.065  -0.459   8.742
  153   2HB   ALA  20          2HB       ALA  20   2.755  -0.569   7.562
  154   3HB   ALA  20          3HB       ALA  20   2.531  -1.211   9.191
  155    H    VAL  21           H        VAL  21   1.773  -3.880   8.418
  156    HA   VAL  21           HA       VAL  21   0.806  -3.933   5.660
  157    HB   VAL  21           HB       VAL  21   1.275  -6.437   7.286
  158   1HG1  VAL  21          1HG1      VAL  21  -0.532  -5.863   5.119
  159   2HG1  VAL  21          2HG1      VAL  21   0.645  -7.088   4.642
  160   3HG1  VAL  21          3HG1      VAL  21  -0.357  -7.336   6.073
  161   1HG2  VAL  21          1HG2      VAL  21   3.274  -5.333   6.174
  162   2HG2  VAL  21          2HG2      VAL  21   2.961  -7.015   5.744
  163   3HG2  VAL  21          3HG2      VAL  21   2.503  -5.722   4.637
  164    H    GLU  22           H        GLU  22  -1.280  -3.411   5.677
  165    HA   GLU  22           HA       GLU  22  -3.025  -4.506   7.741
  166   1HB   GLU  22          1HB       GLU  22  -2.786  -1.543   7.191
  167   2HB   GLU  22          2HB       GLU  22  -4.050  -2.283   8.164
  168   1HG   GLU  22          1HG       GLU  22  -1.145  -2.628   8.819
  169   2HG   GLU  22          2HG       GLU  22  -2.071  -1.236   9.378
  170    H    VAL  23           H        VAL  23  -3.220  -5.558   5.418
  171    HA   VAL  23           HA       VAL  23  -5.623  -4.368   4.244
  172    HB   VAL  23           HB       VAL  23  -4.702  -5.164   1.962
  173   1HG1  VAL  23          1HG1      VAL  23  -3.602  -2.703   3.316
  174   2HG1  VAL  23          2HG1      VAL  23  -3.654  -2.973   1.575
  175   3HG1  VAL  23          3HG1      VAL  23  -5.155  -2.839   2.491
  176   1HG2  VAL  23          1HG2      VAL  23  -2.176  -4.951   3.589
  177   2HG2  VAL  23          2HG2      VAL  23  -2.742  -6.323   2.635
  178   3HG2  VAL  23          3HG2      VAL  23  -2.204  -4.850   1.827
  179    H    ASN  24           H        ASN  24  -7.163  -5.836   4.412
  180    HA   ASN  24           HA       ASN  24  -6.479  -8.671   4.498
  181   1HB   ASN  24          1HB       ASN  24  -8.362  -7.082   5.833
  182   2HB   ASN  24          2HB       ASN  24  -9.299  -8.107   4.753
  183   1HD2  ASN  24          2HD2      ASN  24 -10.166  -9.443   6.252
  184   2HD2  ASN  24          1HD2      ASN  24  -9.242 -10.521   7.236
  185    H    VAL  25           H        VAL  25  -6.813  -6.741   2.032
  186    HA   VAL  25           HA       VAL  25  -7.712  -6.797  -0.072
  187    HB   VAL  25           HB       VAL  25  -6.047  -8.519  -0.285
  188   1HG1  VAL  25          1HG1      VAL  25  -8.138 -10.358   0.858
  189   2HG1  VAL  25          2HG1      VAL  25  -6.666 -10.919   0.066
  190   3HG1  VAL  25          3HG1      VAL  25  -6.562  -9.958   1.541
  191   1HG2  VAL  25          1HG2      VAL  25  -8.422  -8.423  -1.817
  192   2HG2  VAL  25          2HG2      VAL  25  -6.810  -8.926  -2.327
  193   3HG2  VAL  25          3HG2      VAL  25  -7.944 -10.116  -1.686
  194    H    GLY  26           H        GLY  26  -9.823  -6.237   1.168
  195   1HA   GLY  26          1HA       GLY  26 -11.826  -8.362   0.906
  196   2HA   GLY  26          2HA       GLY  26 -12.044  -6.900  -0.044
  197    H    ASP  27           H        ASP  27 -11.250  -4.961   1.754
  198    HA   ASP  27           HA       ASP  27 -13.418  -5.129   3.723
  199   1HB   ASP  27          1HB       ASP  27 -10.894  -5.493   4.555
  200   2HB   ASP  27          2HB       ASP  27 -10.937  -3.732   4.577
  201    H    THR  28           H        THR  28 -13.723  -2.869   4.769
  202    HA   THR  28           HA       THR  28 -14.170  -1.023   2.608
  203    HB   THR  28           HB       THR  28 -14.658  -0.662   5.571
  204    HG1  THR  28           HG1      THR  28 -15.840  -2.406   4.794
  205   1HG2  THR  28          1HG2      THR  28 -14.825   1.240   3.581
  206   2HG2  THR  28          2HG2      THR  28 -16.482   0.663   3.762
  207   3HG2  THR  28          3HG2      THR  28 -15.611   1.295   5.159
  208    H    ILE  29           H        ILE  29 -13.028   0.752   2.098
  209    HA   ILE  29           HA       ILE  29 -10.871   1.582   3.924
  210    HB   ILE  29           HB       ILE  29  -9.549   2.166   1.850
  211   1HG1  ILE  29          1HG1      ILE  29 -10.745   0.141   0.188
  212   2HG1  ILE  29          2HG1      ILE  29 -11.948   1.360   0.593
  213   1HG2  ILE  29          1HG2      ILE  29  -9.743  -0.192   3.297
  214   2HG2  ILE  29          2HG2      ILE  29  -9.721  -0.715   1.613
  215   3HG2  ILE  29          3HG2      ILE  29  -8.415   0.290   2.242
  216   1HD1  ILE  29          1HD1      ILE  29 -10.316   3.089  -0.185
  217   2HD1  ILE  29          2HD1      ILE  29  -9.311   1.768  -0.782
  218   3HD1  ILE  29          3HD1      ILE  29 -10.930   2.011  -1.440
  219    H    ALA  30           H        ALA  30 -10.311   3.788   3.893
  220    HA   ALA  30           HA       ALA  30 -12.280   5.536   2.568
  221   1HB   ALA  30          1HB       ALA  30 -11.054   6.595   5.010
  222   2HB   ALA  30          2HB       ALA  30 -12.734   6.625   4.475
  223   3HB   ALA  30          3HB       ALA  30 -12.084   5.185   5.260
  224    H    VAL  31           H        VAL  31 -11.375   7.938   2.745
  225    HA   VAL  31           HA       VAL  31  -8.864   7.888   1.284
  226    HB   VAL  31           HB       VAL  31 -10.464  10.354   1.924
  227   1HG1  VAL  31          1HG1      VAL  31  -8.204   9.669   0.211
  228   2HG1  VAL  31          2HG1      VAL  31  -9.479  10.554  -0.626
  229   3HG1  VAL  31          3HG1      VAL  31  -8.733  11.239   0.818
  230   1HG2  VAL  31          1HG2      VAL  31 -11.886   8.493   0.942
  231   2HG2  VAL  31          2HG2      VAL  31 -11.862  10.017   0.056
  232   3HG2  VAL  31          3HG2      VAL  31 -10.904   8.651  -0.514
  233    H    ASP  32           H        ASP  32  -8.365   7.170   3.850
  234    HA   ASP  32           HA       ASP  32  -6.275   8.699   4.678
  235   1HB   ASP  32          1HB       ASP  32  -7.324   9.847   6.734
  236   2HB   ASP  32          2HB       ASP  32  -7.552  10.615   5.166
  237    H    ASP  33           H        ASP  33  -6.059   6.273   4.802
  238    HA   ASP  33           HA       ASP  33  -6.260   5.486   7.590
  239   1HB   ASP  33          1HB       ASP  33  -7.314   3.306   7.046
  240   2HB   ASP  33          2HB       ASP  33  -8.382   4.669   6.726
  241    H    THR  34           H        THR  34  -4.086   5.281   7.815
  242    HA   THR  34           HA       THR  34  -2.191   4.541   6.038
  243    HB   THR  34           HB       THR  34  -1.242   3.282   8.229
  244    HG1  THR  34           HG1      THR  34  -2.576   3.689   9.793
  245   1HG2  THR  34          1HG2      THR  34  -0.158   5.127   7.043
  246   2HG2  THR  34          2HG2      THR  34  -1.257   6.256   7.839
  247   3HG2  THR  34          3HG2      THR  34  -0.108   5.321   8.798
  248    H    LEU  35           H        LEU  35  -2.018   2.920   4.704
  249    HA   LEU  35           HA       LEU  35  -3.267   0.368   5.289
  250   1HB   LEU  35          1HB       LEU  35  -1.774   1.351   2.854
  251   2HB   LEU  35          2HB       LEU  35  -2.540  -0.220   2.984
  252    HG   LEU  35           HG       LEU  35  -3.859   2.479   2.859
  253   1HD1  LEU  35          1HD1      LEU  35  -3.260   0.471   0.968
  254   2HD1  LEU  35          2HD1      LEU  35  -5.007   0.460   1.211
  255   3HD1  LEU  35          3HD1      LEU  35  -4.192   1.950   0.736
  256   1HD2  LEU  35          1HD2      LEU  35  -4.902  -0.102   3.929
  257   2HD2  LEU  35          2HD2      LEU  35  -5.185   1.546   4.489
  258   3HD2  LEU  35          3HD2      LEU  35  -5.982   0.961   3.028
  259    H    ILE  36           H        ILE  36  -0.030   1.608   4.480
  260    HA   ILE  36           HA       ILE  36   1.135  -0.443   6.177
  261    HB   ILE  36           HB       ILE  36   2.815  -1.100   4.442
  262   1HG1  ILE  36          1HG1      ILE  36   2.546  -0.694   2.167
  263   2HG1  ILE  36          2HG1      ILE  36   0.860  -0.224   2.338
  264   1HG2  ILE  36          1HG2      ILE  36   0.420  -2.164   5.046
  265   2HG2  ILE  36          2HG2      ILE  36   0.280  -2.004   3.297
  266   3HG2  ILE  36          3HG2      ILE  36   1.613  -2.923   3.997
  267   1HD1  ILE  36          1HD1      ILE  36   3.187   1.427   3.297
  268   2HD1  ILE  36          2HD1      ILE  36   2.404   1.620   1.730
  269   3HD1  ILE  36          3HD1      ILE  36   1.492   1.911   3.212
  270    H    THR  37           H        THR  37   3.677  -0.228   5.880
  271    HA   THR  37           HA       THR  37   4.393   2.609   5.773
  272    HB   THR  37           HB       THR  37   5.551   0.755   7.847
  273    HG1  THR  37           HG1      THR  37   3.386   2.533   8.261
  274   1HG2  THR  37          1HG2      THR  37   5.357   3.751   7.678
  275   2HG2  THR  37          2HG2      THR  37   5.984   2.850   9.057
  276   3HG2  THR  37          3HG2      THR  37   6.812   2.773   7.502
  277    H    LEU  38           H        LEU  38   6.186   2.959   4.578
  278    HA   LEU  38           HA       LEU  38   7.773   0.593   3.835
  279   1HB   LEU  38          1HB       LEU  38   6.863   2.967   2.264
  280   2HB   LEU  38          2HB       LEU  38   8.329   2.132   1.794
  281    HG   LEU  38           HG       LEU  38   6.700   1.180   0.442
  282   1HD1  LEU  38          1HD1      LEU  38   8.042  -0.432   1.998
  283   2HD1  LEU  38          2HD1      LEU  38   6.446  -0.776   2.665
  284   3HD1  LEU  38          3HD1      LEU  38   6.763  -1.047   0.951
  285   1HD2  LEU  38          1HD2      LEU  38   4.883   2.221   2.068
  286   2HD2  LEU  38          2HD2      LEU  38   4.491   0.951   0.908
  287   3HD2  LEU  38          3HD2      LEU  38   4.778   0.544   2.600
  288    H    GLU  39           H        GLU  39  10.047   1.112   3.165
  289    HA   GLU  39           HA       GLU  39  11.325   3.491   3.910
  290   1HB   GLU  39          1HB       GLU  39  10.789   3.044   6.171
  291   2HB   GLU  39          2HB       GLU  39  11.220   1.347   6.022
  292   1HG   GLU  39          1HG       GLU  39  13.571   1.962   5.784
  293   2HG   GLU  39          2HG       GLU  39  13.140   3.665   5.929
  294    H    THR  40           H        THR  40  13.715   3.249   4.013
  295    HA   THR  40           HA       THR  40  14.606   0.884   2.501
  296    HB   THR  40           HB       THR  40  15.969   2.210   1.138
  297    HG1  THR  40           HG1      THR  40  16.853   4.020   1.766
  298   1HG2  THR  40          1HG2      THR  40  13.270   3.026   1.394
  299   2HG2  THR  40          2HG2      THR  40  14.256   4.456   1.092
  300   3HG2  THR  40          3HG2      THR  40  14.316   3.093  -0.025
  301    H    ASP  41           H        ASP  41  15.916   3.595   4.389
  302    HA   ASP  41           HA       ASP  41  17.117   1.958   6.349
  303   1HB   ASP  41          1HB       ASP  41  18.563   1.575   4.232
  304   2HB   ASP  41          2HB       ASP  41  19.172   3.199   4.538
  305    H    LYS  42           H        LYS  42  17.196   5.021   4.599
  306    HA   LYS  42           HA       LYS  42  17.819   6.397   7.125
  307   1HB   LYS  42          1HB       LYS  42  18.523   6.905   4.303
  308   2HB   LYS  42          2HB       LYS  42  18.090   8.329   5.240
  309   1HG   LYS  42          1HG       LYS  42  20.266   6.348   5.877
  310   2HG   LYS  42          2HG       LYS  42  20.471   8.006   5.310
  311   1HD   LYS  42          1HD       LYS  42  19.121   8.647   7.419
  312   2HD   LYS  42          2HD       LYS  42  19.528   7.024   7.980
  313   1HE   LYS  42          1HE       LYS  42  21.919   7.546   7.625
  314   2HE   LYS  42          2HE       LYS  42  21.466   9.190   7.174
  315   1HZ   LYS  42          1HZ       LYS  42  20.237   8.756   9.583
  316   2HZ   LYS  42          2HZ       LYS  42  21.761   8.047   9.767
  317   3HZ   LYS  42          3HZ       LYS  42  21.635   9.673   9.320
  318    H    ALA  43           H        ALA  43  15.612   6.308   4.383
  319    HA   ALA  43           HA       ALA  43  13.849   8.190   5.811
  320   1HB   ALA  43          1HB       ALA  43  14.832   8.526   3.317
  321   2HB   ALA  43          2HB       ALA  43  13.301   9.203   3.877
  322   3HB   ALA  43          3HB       ALA  43  13.317   7.695   2.960
  323    H    THR  44           H        THR  44  11.732   7.652   6.160
  324    HA   THR  44           HA       THR  44  10.870   4.977   5.275
  325    HB   THR  44           HB       THR  44  10.091   4.398   7.379
  326    HG1  THR  44           HG1      THR  44  10.032   7.168   7.922
  327   1HG2  THR  44          1HG2      THR  44  12.660   4.979   7.341
  328   2HG2  THR  44          2HG2      THR  44  12.154   6.195   8.513
  329   3HG2  THR  44          3HG2      THR  44  11.839   4.488   8.823
  330    H    MET  45           H        MET  45   8.933   4.899   4.314
  331    HA   MET  45           HA       MET  45   7.198   7.272   4.542
  332   1HB   MET  45          1HB       MET  45   8.314   6.013   2.238
  333   2HB   MET  45          2HB       MET  45   6.570   5.797   2.188
  334   1HG   MET  45          1HG       MET  45   8.117   8.368   2.295
  335   2HG   MET  45          2HG       MET  45   7.055   7.787   1.015
  336   1HE   MET  45          1HE       MET  45   5.570   9.791   0.746
  337   2HE   MET  45          2HE       MET  45   4.564   8.347   0.852
  338   3HE   MET  45          3HE       MET  45   4.078   9.823   1.686
  339    H    ASP  46           H        ASP  46   4.990   6.256   3.206
  340    HA   ASP  46           HA       ASP  46   4.067   3.758   4.036
  341   1HB   ASP  46          1HB       ASP  46   2.482   4.534   5.850
  342   2HB   ASP  46          2HB       ASP  46   4.181   4.478   6.308
  343    H    VAL  47           H        VAL  47   1.550   3.718   4.001
  344    HA   VAL  47           HA       VAL  47   0.641   5.677   1.993
  345    HB   VAL  47           HB       VAL  47  -0.043   2.739   2.165
  346   1HG1  VAL  47          1HG1      VAL  47  -1.481   4.968   0.961
  347   2HG1  VAL  47          2HG1      VAL  47  -1.087   3.701  -0.203
  348   3HG1  VAL  47          3HG1      VAL  47  -2.005   3.309   1.254
  349   1HG2  VAL  47          1HG2      VAL  47   2.169   3.665   1.107
  350   2HG2  VAL  47          2HG2      VAL  47   1.242   2.407   0.288
  351   3HG2  VAL  47          3HG2      VAL  47   1.106   4.086  -0.235
  352    HA   PRO  48           HA       PRO  48  -2.503   6.234   5.173
  353   1HB   PRO  48          1HB       PRO  48  -3.316   8.653   4.440
  354   2HB   PRO  48          2HB       PRO  48  -1.712   8.420   5.150
  355   1HG   PRO  48          1HG       PRO  48  -2.483   8.795   2.285
  356   2HG   PRO  48          2HG       PRO  48  -1.099   9.463   3.171
  357   1HD   PRO  48          1HD       PRO  48  -1.027   7.219   1.525
  358   2HD   PRO  48          2HD       PRO  48   0.175   7.620   2.766
  359    H    ALA  49           H        ALA  49  -2.911   5.050   2.283
  360    HA   ALA  49           HA       ALA  49  -4.650   4.374   0.984
  361   1HB   ALA  49          1HB       ALA  49  -6.924   4.365   2.287
  362   2HB   ALA  49          2HB       ALA  49  -5.630   3.251   2.728
  363   3HB   ALA  49          3HB       ALA  49  -5.889   4.717   3.669
  364    H    GLU  50           H        GLU  50  -5.006   5.722  -0.663
  365    HA   GLU  50           HA       GLU  50  -6.592   8.150  -0.167
  366   1HB   GLU  50          1HB       GLU  50  -4.563   7.496  -2.303
  367   2HB   GLU  50          2HB       GLU  50  -5.664   8.860  -2.437
  368   1HG   GLU  50          1HG       GLU  50  -4.119   8.668   0.068
  369   2HG   GLU  50          2HG       GLU  50  -3.206   9.034  -1.396
  370    H    VAL  51           H        VAL  51  -8.393   6.544  -0.147
  371    HA   VAL  51           HA       VAL  51  -9.680   6.525  -2.726
  372    HB   VAL  51           HB       VAL  51 -10.128   3.897  -2.136
  373   1HG1  VAL  51          1HG1      VAL  51  -8.368   5.338  -4.040
  374   2HG1  VAL  51          2HG1      VAL  51  -8.238   3.582  -3.952
  375   3HG1  VAL  51          3HG1      VAL  51  -9.784   4.332  -4.343
  376   1HG2  VAL  51          1HG2      VAL  51  -7.271   4.519  -1.410
  377   2HG2  VAL  51          2HG2      VAL  51  -8.474   3.656  -0.452
  378   3HG2  VAL  51          3HG2      VAL  51  -7.808   2.913  -1.907
  379    H    ALA  52           H        ALA  52 -11.754   4.880  -2.336
  380    HA   ALA  52           HA       ALA  52 -12.861   5.142   0.311
  381   1HB   ALA  52          1HB       ALA  52 -13.222   7.389  -0.441
  382   2HB   ALA  52          2HB       ALA  52 -13.958   6.806  -1.936
  383   3HB   ALA  52          3HB       ALA  52 -14.766   6.536  -0.392
  384    H    GLY  53           H        GLY  53 -12.648   2.804  -0.603
  385   1HA   GLY  53          1HA       GLY  53 -14.180   1.659  -2.518
  386   2HA   GLY  53          2HA       GLY  53 -15.342   1.985  -1.246
  387    H    VAL  54           H        VAL  54 -13.591  -0.397  -2.515
  388    HA   VAL  54           HA       VAL  54 -12.887  -1.682   0.028
  389    HB   VAL  54           HB       VAL  54 -14.665  -2.926  -2.075
  390   1HG1  VAL  54          1HG1      VAL  54 -13.202  -4.034   0.264
  391   2HG1  VAL  54          2HG1      VAL  54 -14.823  -4.651  -0.066
  392   3HG1  VAL  54          3HG1      VAL  54 -13.566  -4.770  -1.298
  393   1HG2  VAL  54          1HG2      VAL  54 -15.232  -1.957   0.722
  394   2HG2  VAL  54          2HG2      VAL  54 -15.939  -1.374  -0.785
  395   3HG2  VAL  54          3HG2      VAL  54 -16.323  -2.993  -0.198
  396    H    VAL  55           H        VAL  55 -11.138  -3.033  -0.092
  397    HA   VAL  55           HA       VAL  55  -9.548  -2.943  -2.472
  398    HB   VAL  55           HB       VAL  55  -9.086  -4.555   0.038
  399   1HG1  VAL  55          1HG1      VAL  55  -7.875  -5.341  -2.014
  400   2HG1  VAL  55          2HG1      VAL  55  -7.099  -3.757  -2.090
  401   3HG1  VAL  55          3HG1      VAL  55  -6.821  -4.809  -0.702
  402   1HG2  VAL  55          1HG2      VAL  55  -9.227  -1.974   0.163
  403   2HG2  VAL  55          2HG2      VAL  55  -7.847  -2.789   0.899
  404   3HG2  VAL  55          3HG2      VAL  55  -7.675  -2.011  -0.675
  405    H    LYS  56           H        LYS  56  -8.965  -4.577  -3.832
  406    HA   LYS  56           HA       LYS  56 -10.614  -7.017  -3.711
  407   1HB   LYS  56          1HB       LYS  56  -9.467  -6.599  -6.318
  408   2HB   LYS  56          2HB       LYS  56 -11.156  -6.778  -5.871
  409   1HG   LYS  56          1HG       LYS  56 -10.224  -4.120  -5.241
  410   2HG   LYS  56          2HG       LYS  56  -9.896  -4.526  -6.921
  411   1HD   LYS  56          1HD       LYS  56 -12.030  -4.190  -7.426
  412   2HD   LYS  56          2HD       LYS  56 -12.507  -5.447  -6.284
  413   1HE   LYS  56          1HE       LYS  56 -11.791  -2.827  -5.128
  414   2HE   LYS  56          2HE       LYS  56 -13.275  -2.879  -6.078
  415   1HZ   LYS  56          1HZ       LYS  56 -13.822  -4.915  -4.654
  416   2HZ   LYS  56          2HZ       LYS  56 -12.614  -4.357  -3.610
  417   3HZ   LYS  56          3HZ       LYS  56 -13.962  -3.389  -3.937
  418    H    GLU  57           H        GLU  57  -7.512  -5.632  -4.640
  419    HA   GLU  57           HA       GLU  57  -6.359  -8.297  -4.397
  420   1HB   GLU  57          1HB       GLU  57  -5.857  -6.079  -6.285
  421   2HB   GLU  57          2HB       GLU  57  -4.445  -6.983  -5.753
  422   1HG   GLU  57          1HG       GLU  57  -5.334  -9.021  -6.599
  423   2HG   GLU  57          2HG       GLU  57  -6.897  -8.270  -6.920
  424    H    VAL  58           H        VAL  58  -3.894  -8.129  -3.935
  425    HA   VAL  58           HA       VAL  58  -3.059  -5.978  -2.214
  426    HB   VAL  58           HB       VAL  58  -4.492  -7.292  -0.679
  427   1HG1  VAL  58          1HG1      VAL  58  -3.494  -9.475  -1.998
  428   2HG1  VAL  58          2HG1      VAL  58  -2.635  -9.533  -0.459
  429   3HG1  VAL  58          3HG1      VAL  58  -4.398  -9.518  -0.484
  430   1HG2  VAL  58          1HG2      VAL  58  -1.534  -7.140  -0.224
  431   2HG2  VAL  58          2HG2      VAL  58  -2.814  -6.117   0.426
  432   3HG2  VAL  58          3HG2      VAL  58  -2.613  -7.764   1.023
  433    H    LYS  59           H        LYS  59  -0.967  -5.747  -2.591
  434    HA   LYS  59           HA       LYS  59   0.676  -8.135  -3.067
  435   1HB   LYS  59          1HB       LYS  59   1.106  -5.610  -4.630
  436   2HB   LYS  59          2HB       LYS  59   1.674  -7.238  -4.986
  437   1HG   LYS  59          1HG       LYS  59  -1.012  -7.603  -5.041
  438   2HG   LYS  59          2HG       LYS  59  -0.879  -5.945  -5.628
  439   1HD   LYS  59          1HD       LYS  59   0.945  -6.879  -7.193
  440   2HD   LYS  59          2HD       LYS  59   0.266  -8.459  -6.795
  441   1HE   LYS  59          1HE       LYS  59  -1.881  -7.819  -7.650
  442   2HE   LYS  59          2HE       LYS  59  -1.349  -6.153  -7.873
  443   1HZ   LYS  59          1HZ       LYS  59   0.125  -8.280  -9.248
  444   2HZ   LYS  59          2HZ       LYS  59  -1.390  -7.838  -9.856
  445   3HZ   LYS  59          3HZ       LYS  59  -0.160  -6.683  -9.727
  446    H    VAL  60           H        VAL  60   1.134  -7.684  -0.773
  447    HA   VAL  60           HA       VAL  60   3.619  -6.397  -0.468
  448    HB   VAL  60           HB       VAL  60   2.736  -4.281  -0.404
  449   1HG1  VAL  60          1HG1      VAL  60   0.267  -5.381   0.931
  450   2HG1  VAL  60          2HG1      VAL  60   0.537  -3.683   0.543
  451   3HG1  VAL  60          3HG1      VAL  60   0.425  -4.876  -0.753
  452   1HG2  VAL  60          1HG2      VAL  60   3.721  -5.049   1.910
  453   2HG2  VAL  60          2HG2      VAL  60   3.004  -3.450   1.714
  454   3HG2  VAL  60          3HG2      VAL  60   2.074  -4.748   2.463
  455    H    LYS  61           H        LYS  61   4.565  -6.813   1.532
  456    HA   LYS  61           HA       LYS  61   2.995  -8.254   3.534
  457   1HB   LYS  61          1HB       LYS  61   5.563  -9.406   2.442
  458   2HB   LYS  61          2HB       LYS  61   4.465 -10.149   3.597
  459   1HG   LYS  61          1HG       LYS  61   2.841  -9.704   1.435
  460   2HG   LYS  61          2HG       LYS  61   4.385 -10.117   0.687
  461   1HD   LYS  61          1HD       LYS  61   4.358 -12.248   1.486
  462   2HD   LYS  61          2HD       LYS  61   3.489 -11.800   2.956
  463   1HE   LYS  61          1HE       LYS  61   1.431 -11.945   1.945
  464   2HE   LYS  61          2HE       LYS  61   2.077 -11.612   0.339
  465   1HZ   LYS  61          1HZ       LYS  61   3.257 -13.932   0.866
  466   2HZ   LYS  61          2HZ       LYS  61   1.830 -14.138   1.752
  467   3HZ   LYS  61          3HZ       LYS  61   1.757 -13.812   0.095
  468    H    VAL  62           H        VAL  62   5.069  -9.129   5.134
  469    HA   VAL  62           HA       VAL  62   6.240  -6.574   6.001
  470    HB   VAL  62           HB       VAL  62   5.765  -9.081   7.622
  471   1HG1  VAL  62          1HG1      VAL  62   6.818  -6.359   8.369
  472   2HG1  VAL  62          2HG1      VAL  62   6.250  -7.545   9.545
  473   3HG1  VAL  62          3HG1      VAL  62   7.637  -7.914   8.520
  474   1HG2  VAL  62          1HG2      VAL  62   4.234  -6.503   7.400
  475   2HG2  VAL  62          2HG2      VAL  62   3.645  -8.149   7.168
  476   3HG2  VAL  62          3HG2      VAL  62   4.077  -7.586   8.782
  477    H    GLY  63           H        GLY  63   8.067  -6.698   4.627
  478   1HA   GLY  63          1HA       GLY  63  10.023  -8.753   5.456
  479   2HA   GLY  63          2HA       GLY  63  10.458  -7.088   5.103
  480    H    ASP  64           H        ASP  64   8.410  -7.278   2.805
  481    HA   ASP  64           HA       ASP  64   9.957  -8.959   0.968
  482   1HB   ASP  64          1HB       ASP  64   8.014  -8.444  -0.607
  483   2HB   ASP  64          2HB       ASP  64   7.646  -9.443   0.797
  484    H    LYS  65           H        LYS  65  10.082  -8.004  -1.335
  485    HA   LYS  65           HA       LYS  65  11.339  -5.385  -1.081
  486   1HB   LYS  65          1HB       LYS  65  11.575  -7.675  -2.946
  487   2HB   LYS  65          2HB       LYS  65  11.835  -6.078  -3.635
  488   1HG   LYS  65          1HG       LYS  65  13.964  -6.686  -3.016
  489   2HG   LYS  65          2HG       LYS  65  13.432  -5.752  -1.614
  490   1HD   LYS  65          1HD       LYS  65  14.148  -7.550  -0.460
  491   2HD   LYS  65          2HD       LYS  65  12.583  -8.225  -0.919
  492   1HE   LYS  65          1HE       LYS  65  13.488  -9.619  -2.483
  493   2HE   LYS  65          2HE       LYS  65  14.838  -8.538  -2.823
  494   1HZ   LYS  65          1HZ       LYS  65  14.613  -9.980  -0.251
  495   2HZ   LYS  65          2HZ       LYS  65  15.344 -10.687  -1.602
  496   3HZ   LYS  65          3HZ       LYS  65  15.984  -9.267  -0.942
  497    H    ILE  66           H        ILE  66  10.361  -3.580  -1.694
  498    HA   ILE  66           HA       ILE  66   8.175  -3.776  -3.648
  499    HB   ILE  66           HB       ILE  66   7.902  -3.063  -0.992
  500   1HG1  ILE  66          1HG1      ILE  66   5.609  -2.407  -1.672
  501   2HG1  ILE  66          2HG1      ILE  66   6.136  -2.429  -3.353
  502   1HG2  ILE  66          1HG2      ILE  66   7.938  -0.532  -2.621
  503   2HG2  ILE  66          2HG2      ILE  66   7.098  -0.688  -1.080
  504   3HG2  ILE  66          3HG2      ILE  66   8.847  -0.896  -1.155
  505   1HD1  ILE  66          1HD1      ILE  66   6.912  -4.888  -2.282
  506   2HD1  ILE  66          2HD1      ILE  66   5.278  -4.591  -1.688
  507   3HD1  ILE  66          3HD1      ILE  66   5.604  -4.570  -3.422
  508    H    SER  67           H        SER  67   7.686  -1.625  -4.710
  509    HA   SER  67           HA       SER  67   9.940   0.186  -4.936
  510   1HB   SER  67          1HB       SER  67  10.258  -0.103  -7.309
  511   2HB   SER  67          2HB       SER  67  10.413  -1.683  -6.543
  512    HG   SER  67           HG       SER  67   8.877  -2.308  -7.815
  513    H    GLU  68           H        GLU  68   9.367   2.213  -5.615
  514    HA   GLU  68           HA       GLU  68   6.880   3.222  -5.231
  515   1HB   GLU  68          1HB       GLU  68   8.792   4.241  -7.338
  516   2HB   GLU  68          2HB       GLU  68   7.539   5.167  -6.523
  517   1HG   GLU  68          1HG       GLU  68   8.774   4.636  -4.365
  518   2HG   GLU  68          2HG       GLU  68  10.103   4.101  -5.392
  519    H    GLY  69           H        GLY  69   5.169   2.056  -6.035
  520   1HA   GLY  69          1HA       GLY  69   4.726   2.327  -8.925
  521   2HA   GLY  69          2HA       GLY  69   3.476   2.094  -7.712
  522    H    GLY  70           H        GLY  70   3.900  -0.073  -6.408
  523   1HA   GLY  70          1HA       GLY  70   4.709  -2.360  -6.635
  524   2HA   GLY  70          2HA       GLY  70   4.574  -2.169  -8.377
  525    H    LEU  71           H        LEU  71   1.940  -0.699  -7.822
  526    HA   LEU  71           HA       LEU  71  -0.282  -1.178  -7.638
  527   1HB   LEU  71          1HB       LEU  71   0.436  -2.432  -9.707
  528   2HB   LEU  71          2HB       LEU  71   0.527  -3.875  -8.716
  529    HG   LEU  71           HG       LEU  71  -1.815  -3.898  -8.349
  530   1HD1  LEU  71          1HD1      LEU  71  -1.606  -1.058  -9.059
  531   2HD1  LEU  71          2HD1      LEU  71  -3.035  -1.882  -9.686
  532   3HD1  LEU  71          3HD1      LEU  71  -2.709  -1.877  -7.952
  533   1HD2  LEU  71          1HD2      LEU  71  -0.713  -4.116 -10.864
  534   2HD2  LEU  71          2HD2      LEU  71  -2.326  -4.646 -10.389
  535   3HD2  LEU  71          3HD2      LEU  71  -2.100  -3.057 -11.119
  536    H    ILE  72           H        ILE  72   0.842  -1.396  -5.227
  537    HA   ILE  72           HA       ILE  72   0.833  -3.748  -3.840
  538    HB   ILE  72           HB       ILE  72   0.202  -0.938  -3.039
  539   1HG1  ILE  72          1HG1      ILE  72   2.260  -2.578  -1.699
  540   2HG1  ILE  72          2HG1      ILE  72   2.512  -2.293  -3.419
  541   1HG2  ILE  72          1HG2      ILE  72  -0.504  -3.333  -1.481
  542   2HG2  ILE  72          2HG2      ILE  72   0.461  -2.134  -0.616
  543   3HG2  ILE  72          3HG2      ILE  72  -1.079  -1.672  -1.335
  544   1HD1  ILE  72          1HD1      ILE  72   1.786   0.089  -1.897
  545   2HD1  ILE  72          2HD1      ILE  72   3.320  -0.645  -1.433
  546   3HD1  ILE  72          3HD1      ILE  72   3.048  -0.153  -3.105
  547    H    VAL  73           H        VAL  73  -1.911  -1.619  -3.154
  548    HA   VAL  73           HA       VAL  73  -3.667  -3.969  -3.435
  549    HB   VAL  73           HB       VAL  73  -5.056  -3.116  -1.656
  550   1HG1  VAL  73          1HG1      VAL  73  -2.402  -4.004  -1.336
  551   2HG1  VAL  73          2HG1      VAL  73  -2.674  -2.759  -0.116
  552   3HG1  VAL  73          3HG1      VAL  73  -3.744  -4.158  -0.203
  553   1HG2  VAL  73          1HG2      VAL  73  -3.181  -0.763  -1.695
  554   2HG2  VAL  73          2HG2      VAL  73  -4.929  -0.769  -1.929
  555   3HG2  VAL  73          3HG2      VAL  73  -4.251  -1.117  -0.338
  556    H    VAL  74           H        VAL  74  -5.594  -3.780  -4.443
  557    HA   VAL  74           HA       VAL  74  -6.168  -1.211  -5.789
  558    HB   VAL  74           HB       VAL  74  -6.820  -4.036  -6.667
  559   1HG1  VAL  74          1HG1      VAL  74  -8.323  -1.867  -7.256
  560   2HG1  VAL  74          2HG1      VAL  74  -7.143  -1.811  -8.565
  561   3HG1  VAL  74          3HG1      VAL  74  -8.128  -3.254  -8.325
  562   1HG2  VAL  74          1HG2      VAL  74  -4.535  -2.326  -7.098
  563   2HG2  VAL  74          2HG2      VAL  74  -4.763  -4.025  -7.513
  564   3HG2  VAL  74          3HG2      VAL  74  -5.306  -2.765  -8.622
  565    H    VAL  75           H        VAL  75  -8.124  -0.283  -5.390
  566    HA   VAL  75           HA       VAL  75 -10.096  -1.902  -3.935
  567    HB   VAL  75           HB       VAL  75 -10.791   0.162  -2.786
  568   1HG1  VAL  75          1HG1      VAL  75  -8.430  -1.361  -2.358
  569   2HG1  VAL  75          2HG1      VAL  75  -8.120   0.305  -1.870
  570   3HG1  VAL  75          3HG1      VAL  75  -9.472  -0.583  -1.166
  571   1HG2  VAL  75          1HG2      VAL  75  -8.359   1.351  -4.103
  572   2HG2  VAL  75          2HG2      VAL  75 -10.038   1.791  -4.417
  573   3HG2  VAL  75          3HG2      VAL  75  -9.319   2.121  -2.842
  574    H    GLU  76           H        GLU  76 -12.316  -0.897  -3.956
  575    HA   GLU  76           HA       GLU  76 -13.135  -0.568  -6.691
  576   1HB   GLU  76          1HB       GLU  76 -14.320  -1.521  -4.336
  577   2HB   GLU  76          2HB       GLU  76 -15.216  -0.062  -4.737
  578   1HG   GLU  76          1HG       GLU  76 -15.024  -1.343  -7.157
  579   2HG   GLU  76          2HG       GLU  76 -15.222  -2.672  -6.017
  580    H    ALA  77           H        ALA  77 -12.869   1.440  -3.829
  581    HA   ALA  77           HA       ALA  77 -13.033   3.666  -3.471
  582   1HB   ALA  77          1HB       ALA  77 -12.061   5.081  -5.059
  583   2HB   ALA  77          2HB       ALA  77 -12.535   4.038  -6.399
  584   3HB   ALA  77          3HB       ALA  77 -11.277   3.517  -5.280
  585    H    GLU  78           H        GLU  78 -14.441   5.401  -3.505
  586    HA   GLU  78           HA       GLU  78 -16.592   6.208  -3.511
  587   1HB   GLU  78          1HB       GLU  78 -17.255   7.040  -5.716
  588   2HB   GLU  78          2HB       GLU  78 -15.546   7.321  -5.411
  589   1HG   GLU  78          1HG       GLU  78 -14.903   5.581  -6.875
  590   2HG   GLU  78          2HG       GLU  78 -16.553   4.972  -6.987
  591    H    GLY  79           H        GLY  79 -16.851   3.591  -2.960
  592   1HA   GLY  79          1HA       GLY  79 -18.005   1.619  -4.007
  593   2HA   GLY  79          2HA       GLY  79 -19.170   2.789  -4.607
  594    H    THR  80           H        THR  80 -20.844   1.637  -3.545
  595    HA   THR  80           HA       THR  80 -20.939   2.167  -0.650
  596    HB   THR  80           HB       THR  80 -22.678   3.413  -1.572
  597    HG1  THR  80           HG1      THR  80 -23.798   2.373  -0.094
  598   1HG2  THR  80          1HG2      THR  80 -23.112   1.137  -3.474
  599   2HG2  THR  80          2HG2      THR  80 -24.315   2.403  -3.217
  600   3HG2  THR  80          3HG2      THR  80 -22.716   2.817  -3.836
  601    H    ALA  81           H        ALA  81 -20.585   0.399   0.513
  602    HA   ALA  81           HA       ALA  81 -21.783  -2.136  -0.396
  603   1HB   ALA  81          1HB       ALA  81 -19.032  -1.526   0.438
  604   2HB   ALA  81          2HB       ALA  81 -19.648  -2.811  -0.600
  605   3HB   ALA  81          3HB       ALA  81 -19.728  -2.980   1.154

  No H/Q in entry =         605
  Start of MODEL    3
    1    H1   ALA   1           H1       ALA   1 -13.486   5.603  -9.709
    2    H2   ALA   1           H2       ALA   1 -14.761   5.651 -10.857
    3    H3   ALA   1           H3       ALA   1 -15.088   5.238  -9.223
    4    HA   ALA   1           HA       ALA   1 -15.095   3.225 -10.168
    5   1HB   ALA   1          1HB       ALA   1 -14.442   4.139 -12.399
    6   2HB   ALA   1          2HB       ALA   1 -12.755   3.994 -11.904
    7   3HB   ALA   1          3HB       ALA   1 -13.763   2.552 -12.033
    8    H    LEU   2           H        LEU   2 -13.284   1.385 -10.296
    9    HA   LEU   2           HA       LEU   2 -12.219   1.086  -7.778
   10   1HB   LEU   2          1HB       LEU   2 -11.289  -0.105 -10.388
   11   2HB   LEU   2          2HB       LEU   2 -10.706  -0.630  -8.820
   12    HG   LEU   2           HG       LEU   2 -13.554  -0.695  -8.764
   13   1HD1  LEU   2          1HD1      LEU   2 -13.065  -0.826 -11.315
   14   2HD1  LEU   2          2HD1      LEU   2 -12.546  -2.469 -10.942
   15   3HD1  LEU   2          3HD1      LEU   2 -14.195  -1.962 -10.578
   16   1HD2  LEU   2          1HD2      LEU   2 -11.255  -2.475  -8.348
   17   2HD2  LEU   2          2HD2      LEU   2 -12.709  -2.248  -7.377
   18   3HD2  LEU   2          3HD2      LEU   2 -12.755  -3.286  -8.801
   19    H    VAL   3           H        VAL   3  -9.735   0.632  -7.466
   20    HA   VAL   3           HA       VAL   3  -8.074   2.679  -8.695
   21    HB   VAL   3           HB       VAL   3  -8.900   2.712  -5.807
   22   1HG1  VAL   3          1HG1      VAL   3  -6.456   2.582  -5.746
   23   2HG1  VAL   3          2HG1      VAL   3  -6.356   3.949  -6.861
   24   3HG1  VAL   3          3HG1      VAL   3  -7.030   4.175  -5.247
   25   1HG2  VAL   3          1HG2      VAL   3  -9.101   4.450  -8.131
   26   2HG2  VAL   3          2HG2      VAL   3 -10.056   4.421  -6.649
   27   3HG2  VAL   3          3HG2      VAL   3  -8.519   5.285  -6.691
   28    H    GLU   4           H        GLU   4  -5.796   2.483  -8.051
   29    HA   GLU   4           HA       GLU   4  -5.070  -0.170  -7.020
   30   1HB   GLU   4          1HB       GLU   4  -3.771   1.126  -9.423
   31   2HB   GLU   4          2HB       GLU   4  -3.424  -0.467  -8.764
   32   1HG   GLU   4          1HG       GLU   4  -5.598  -1.264  -9.416
   33   2HG   GLU   4          2HG       GLU   4  -6.065   0.350  -9.951
   34    H    LEU   5           H        LEU   5  -3.856   0.150  -5.260
   35    HA   LEU   5           HA       LEU   5  -2.572   2.653  -4.752
   36   1HB   LEU   5          1HB       LEU   5  -3.258   0.323  -3.258
   37   2HB   LEU   5          2HB       LEU   5  -1.559   0.661  -3.000
   38    HG   LEU   5           HG       LEU   5  -2.834   1.736  -1.273
   39   1HD1  LEU   5          1HD1      LEU   5  -1.802   3.685  -3.327
   40   2HD1  LEU   5          2HD1      LEU   5  -2.220   4.114  -1.670
   41   3HD1  LEU   5          3HD1      LEU   5  -0.911   2.974  -1.981
   42   1HD2  LEU   5          1HD2      LEU   5  -4.497   2.658  -3.566
   43   2HD2  LEU   5          2HD2      LEU   5  -4.990   2.027  -1.994
   44   3HD2  LEU   5          3HD2      LEU   5  -4.381   3.678  -2.131
   45    H    LYS   6           H        LYS   6  -0.270   2.880  -4.209
   46    HA   LYS   6           HA       LYS   6   1.520   0.979  -5.492
   47   1HB   LYS   6          1HB       LYS   6   1.371   3.884  -6.305
   48   2HB   LYS   6          2HB       LYS   6   2.634   2.764  -6.797
   49   1HG   LYS   6          1HG       LYS   6   0.441   1.391  -7.567
   50   2HG   LYS   6          2HG       LYS   6  -0.124   3.051  -7.767
   51   1HD   LYS   6          1HD       LYS   6   1.854   3.541  -9.141
   52   2HD   LYS   6          2HD       LYS   6   2.383   1.867  -8.959
   53   1HE   LYS   6          1HE       LYS   6   1.109   1.254 -10.671
   54   2HE   LYS   6          2HE       LYS   6  -0.323   1.878  -9.851
   55   1HZ   LYS   6          1HZ       LYS   6   1.520   3.477 -11.547
   56   2HZ   LYS   6          2HZ       LYS   6  -0.004   2.908 -12.018
   57   3HZ   LYS   6          3HZ       LYS   6   0.127   4.056 -10.781
   58    H    VAL   7           H        VAL   7   3.668   1.145  -4.857
   59    HA   VAL   7           HA       VAL   7   4.242   1.670  -2.245
   60    HB   VAL   7           HB       VAL   7   6.151   1.864  -4.581
   61   1HG1  VAL   7          1HG1      VAL   7   6.971   2.869  -2.426
   62   2HG1  VAL   7          2HG1      VAL   7   6.841   1.259  -1.721
   63   3HG1  VAL   7          3HG1      VAL   7   7.943   1.544  -3.064
   64   1HG2  VAL   7          1HG2      VAL   7   4.905  -0.261  -4.421
   65   2HG2  VAL   7          2HG2      VAL   7   6.636  -0.456  -4.157
   66   3HG2  VAL   7          3HG2      VAL   7   5.530  -0.474  -2.788
   67    HA   PRO   8           HA       PRO   8   4.407   6.095  -1.931
   68   1HB   PRO   8          1HB       PRO   8   5.595   6.325   0.474
   69   2HB   PRO   8          2HB       PRO   8   3.933   5.744   0.300
   70   1HG   PRO   8          1HG       PRO   8   6.451   4.185   0.725
   71   2HG   PRO   8          2HG       PRO   8   4.855   3.953   1.464
   72   1HD   PRO   8          1HD       PRO   8   5.786   2.469  -0.636
   73   2HD   PRO   8          2HD       PRO   8   4.064   2.765  -0.333
   74    H    ASP   9           H        ASP   9   6.258   7.632  -0.762
   75    HA   ASP   9           HA       ASP   9   8.548   7.354  -2.545
   76   1HB   ASP   9          1HB       ASP   9   7.436   9.485  -2.611
   77   2HB   ASP   9          2HB       ASP   9   7.518   9.638  -0.859
   78    H    ILE  10           H        ILE  10   9.738   5.749  -1.455
   79    HA   ILE  10           HA       ILE  10  10.649   6.360   1.260
   80    HB   ILE  10           HB       ILE  10  11.858   4.065   0.905
   81   1HG1  ILE  10          1HG1      ILE  10  10.707   2.560  -0.613
   82   2HG1  ILE  10          2HG1      ILE  10   9.600   3.839  -1.097
   83   1HG2  ILE  10          1HG2      ILE  10   9.773   4.763   2.322
   84   2HG2  ILE  10          2HG2      ILE  10   8.896   3.815   1.120
   85   3HG2  ILE  10          3HG2      ILE  10  10.166   3.060   2.085
   86   1HD1  ILE  10          1HD1      ILE  10  11.477   5.071  -2.075
   87   2HD1  ILE  10          2HD1      ILE  10  12.562   3.758  -1.618
   88   3HD1  ILE  10          3HD1      ILE  10  11.279   3.473  -2.794
   89    H    GLY  11           H        GLY  11  11.745   8.241  -0.035
   90   1HA   GLY  11          1HA       GLY  11  14.534   7.407  -0.418
   91   2HA   GLY  11          2HA       GLY  11  13.992   9.033  -0.033
   92    H    GLY  12           H        GLY  12  14.488   6.685  -2.559
   93   1HA   GLY  12          1HA       GLY  12  14.904   8.700  -4.514
   94   2HA   GLY  12          2HA       GLY  12  13.325   7.963  -4.731
   95    H    HIS  13           H        HIS  13  14.066   5.328  -3.902
   96    HA   HIS  13           HA       HIS  13  15.457   4.501  -6.329
   97   1HB   HIS  13          1HB       HIS  13  16.670   2.756  -4.783
   98   2HB   HIS  13          2HB       HIS  13  17.337   4.370  -4.997
   99    HD1  HIS  13           HD1      HIS  13  16.526   6.117  -3.005
  100    HD2  HIS  13           HD2      HIS  13  16.404   2.045  -2.190
  101    HE1  HIS  13           HE1      HIS  13  16.465   5.935  -0.498
  102    HE2  HIS  13           HE2      HIS  13  16.491   3.460  -0.028
  103    H    GLU  14           H        GLU  14  15.560   1.872  -6.118
  104    HA   GLU  14           HA       GLU  14  12.756   1.097  -5.694
  105   1HB   GLU  14          1HB       GLU  14  14.882  -0.253  -7.365
  106   2HB   GLU  14          2HB       GLU  14  13.192  -0.730  -7.260
  107   1HG   GLU  14          1HG       GLU  14  12.839   0.547  -9.033
  108   2HG   GLU  14          2HG       GLU  14  13.082   1.936  -7.975
  109    H    ASN  15           H        ASN  15  12.793  -1.516  -5.497
  110    HA   ASN  15           HA       ASN  15  12.857  -3.124  -3.875
  111   1HB   ASN  15          1HB       ASN  15  15.127  -3.986  -3.418
  112   2HB   ASN  15          2HB       ASN  15  14.865  -3.672  -5.130
  113   1HD2  ASN  15          2HD2      ASN  15  16.738  -2.977  -2.380
  114   2HD2  ASN  15          1HD2      ASN  15  17.791  -1.814  -3.102
  115    H    VAL  16           H        VAL  16  11.841  -2.299  -2.111
  116    HA   VAL  16           HA       VAL  16  13.576  -1.486   0.094
  117    HB   VAL  16           HB       VAL  16  12.077   0.337   0.762
  118   1HG1  VAL  16          1HG1      VAL  16  14.080   0.575  -0.877
  119   2HG1  VAL  16          2HG1      VAL  16  12.829   0.933  -2.068
  120   3HG1  VAL  16          3HG1      VAL  16  12.990   1.940  -0.629
  121   1HG2  VAL  16          1HG2      VAL  16  10.393  -0.799  -1.254
  122   2HG2  VAL  16          2HG2      VAL  16  10.016   0.440  -0.059
  123   3HG2  VAL  16          3HG2      VAL  16  10.692   0.899  -1.621
  124    H    ASP  17           H        ASP  17  13.167  -2.880   1.664
  125    HA   ASP  17           HA       ASP  17  10.969  -4.603   1.748
  126   1HB   ASP  17          1HB       ASP  17  13.351  -4.455   3.067
  127   2HB   ASP  17          2HB       ASP  17  12.223  -4.019   4.348
  128    H    ILE  18           H        ILE  18   8.956  -4.406   2.464
  129    HA   ILE  18           HA       ILE  18   7.906  -1.936   3.330
  130    HB   ILE  18           HB       ILE  18   6.751  -4.728   3.344
  131   1HG1  ILE  18          1HG1      ILE  18   5.558  -2.724   1.610
  132   2HG1  ILE  18          2HG1      ILE  18   7.273  -2.950   1.285
  133   1HG2  ILE  18          1HG2      ILE  18   5.406  -2.113   3.994
  134   2HG2  ILE  18          2HG2      ILE  18   4.543  -3.604   3.619
  135   3HG2  ILE  18          3HG2      ILE  18   5.579  -3.519   5.042
  136   1HD1  ILE  18          1HD1      ILE  18   5.941  -5.483   1.590
  137   2HD1  ILE  18          2HD1      ILE  18   5.172  -4.497   0.345
  138   3HD1  ILE  18          3HD1      ILE  18   6.895  -4.863   0.242
  139    H    ILE  19           H        ILE  19   6.670  -1.675   5.412
  140    HA   ILE  19           HA       ILE  19   8.045  -3.108   7.586
  141    HB   ILE  19           HB       ILE  19   9.109  -1.216   8.122
  142   1HG1  ILE  19          1HG1      ILE  19   6.347  -0.322   8.957
  143   2HG1  ILE  19          2HG1      ILE  19   7.511  -1.205   9.937
  144   1HG2  ILE  19          1HG2      ILE  19   8.188  -0.260   5.848
  145   2HG2  ILE  19          2HG2      ILE  19   7.234   0.750   6.931
  146   3HG2  ILE  19          3HG2      ILE  19   8.988   0.777   7.025
  147   1HD1  ILE  19          1HD1      ILE  19   8.088   1.529   8.852
  148   2HD1  ILE  19          2HD1      ILE  19   7.254   1.274  10.384
  149   3HD1  ILE  19          3HD1      ILE  19   8.897   0.671  10.163
  150    H    ALA  20           H        ALA  20   5.116  -1.488   6.519
  151    HA   ALA  20           HA       ALA  20   3.719  -2.727   8.797
  152   1HB   ALA  20          1HB       ALA  20   3.835  -0.139   8.531
  153   2HB   ALA  20          2HB       ALA  20   2.571  -0.402   7.329
  154   3HB   ALA  20          3HB       ALA  20   2.321  -0.914   8.998
  155    H    VAL  21           H        VAL  21   1.732  -3.721   8.433
  156    HA   VAL  21           HA       VAL  21   0.929  -4.077   5.633
  157    HB   VAL  21           HB       VAL  21   2.262  -6.035   6.226
  158   1HG1  VAL  21          1HG1      VAL  21   1.578  -5.760   8.730
  159   2HG1  VAL  21          2HG1      VAL  21   0.257  -6.842   8.286
  160   3HG1  VAL  21          3HG1      VAL  21   1.930  -7.361   8.080
  161   1HG2  VAL  21          1HG2      VAL  21   0.170  -6.180   4.798
  162   2HG2  VAL  21          2HG2      VAL  21   0.750  -7.692   5.497
  163   3HG2  VAL  21          3HG2      VAL  21  -0.630  -6.860   6.215
  164    H    GLU  22           H        GLU  22  -1.136  -3.520   5.414
  165    HA   GLU  22           HA       GLU  22  -3.071  -4.336   7.436
  166   1HB   GLU  22          1HB       GLU  22  -3.054  -1.482   6.475
  167   2HB   GLU  22          2HB       GLU  22  -3.983  -2.180   7.795
  168   1HG   GLU  22          1HG       GLU  22  -1.601  -2.671   8.783
  169   2HG   GLU  22          2HG       GLU  22  -1.131  -1.353   7.711
  170    H    VAL  23           H        VAL  23  -2.648  -5.342   4.858
  171    HA   VAL  23           HA       VAL  23  -5.177  -4.564   3.580
  172    HB   VAL  23           HB       VAL  23  -3.937  -5.170   1.364
  173   1HG1  VAL  23          1HG1      VAL  23  -4.182  -2.672   2.866
  174   2HG1  VAL  23          2HG1      VAL  23  -2.959  -2.632   1.594
  175   3HG1  VAL  23          3HG1      VAL  23  -4.628  -3.046   1.201
  176   1HG2  VAL  23          1HG2      VAL  23  -1.840  -5.651   2.946
  177   2HG2  VAL  23          2HG2      VAL  23  -1.669  -5.080   1.286
  178   3HG2  VAL  23          3HG2      VAL  23  -1.557  -3.940   2.626
  179    H    ASN  24           H        ASN  24  -6.477  -6.257   3.536
  180    HA   ASN  24           HA       ASN  24  -5.343  -8.914   2.986
  181   1HB   ASN  24          1HB       ASN  24  -6.754  -8.025   5.367
  182   2HB   ASN  24          2HB       ASN  24  -7.545  -9.402   4.607
  183   1HD2  ASN  24          2HD2      ASN  24  -5.068  -8.395   6.632
  184   2HD2  ASN  24          1HD2      ASN  24  -4.209  -9.889   6.748
  185    H    VAL  25           H        VAL  25  -7.095  -6.676   1.636
  186    HA   VAL  25           HA       VAL  25  -8.705  -6.611   0.034
  187    HB   VAL  25           HB       VAL  25  -8.398  -9.612   0.108
  188   1HG1  VAL  25          1HG1      VAL  25 -10.540  -8.947  -0.880
  189   2HG1  VAL  25          2HG1      VAL  25  -9.690  -7.873  -1.993
  190   3HG1  VAL  25          3HG1      VAL  25  -9.448  -9.617  -2.093
  191   1HG2  VAL  25          1HG2      VAL  25  -6.386  -8.171  -0.473
  192   2HG2  VAL  25          2HG2      VAL  25  -6.849  -9.403  -1.647
  193   3HG2  VAL  25          3HG2      VAL  25  -7.272  -7.714  -1.928
  194    H    GLY  26           H        GLY  26 -10.691  -5.978   0.554
  195   1HA   GLY  26          1HA       GLY  26 -12.369  -7.822   2.139
  196   2HA   GLY  26          2HA       GLY  26 -12.998  -6.738   0.908
  197    H    ASP  27           H        ASP  27 -10.522  -5.547   2.992
  198    HA   ASP  27           HA       ASP  27 -12.189  -4.563   5.071
  199   1HB   ASP  27          1HB       ASP  27 -10.161  -3.051   5.515
  200   2HB   ASP  27          2HB       ASP  27  -9.916  -4.790   5.638
  201    H    THR  28           H        THR  28 -13.161  -2.609   5.360
  202    HA   THR  28           HA       THR  28 -13.761  -1.079   3.015
  203    HB   THR  28           HB       THR  28 -14.444  -0.561   5.916
  204    HG1  THR  28           HG1      THR  28 -15.764  -2.142   5.588
  205   1HG2  THR  28          1HG2      THR  28 -14.623   1.380   4.210
  206   2HG2  THR  28          2HG2      THR  28 -16.022   0.486   3.616
  207   3HG2  THR  28          3HG2      THR  28 -15.973   1.036   5.291
  208    H    ILE  29           H        ILE  29 -12.122   0.094   2.206
  209    HA   ILE  29           HA       ILE  29 -10.327   1.558   3.951
  210    HB   ILE  29           HB       ILE  29  -9.264   2.278   1.789
  211   1HG1  ILE  29          1HG1      ILE  29 -10.436   0.199   0.177
  212   2HG1  ILE  29          2HG1      ILE  29 -11.692   1.303   0.727
  213   1HG2  ILE  29          1HG2      ILE  29  -9.517  -0.536   2.716
  214   2HG2  ILE  29          2HG2      ILE  29  -8.638  -0.223   1.218
  215   3HG2  ILE  29          3HG2      ILE  29  -8.116   0.537   2.721
  216   1HD1  ILE  29          1HD1      ILE  29  -9.160   2.244  -0.582
  217   2HD1  ILE  29          2HD1      ILE  29 -10.623   1.843  -1.483
  218   3HD1  ILE  29          3HD1      ILE  29 -10.647   3.149  -0.299
  219    H    ALA  30           H        ALA  30  -9.959   3.824   3.792
  220    HA   ALA  30           HA       ALA  30 -12.245   5.354   2.736
  221   1HB   ALA  30          1HB       ALA  30 -10.717   6.101   5.218
  222   2HB   ALA  30          2HB       ALA  30 -12.233   6.781   4.626
  223   3HB   ALA  30          3HB       ALA  30 -12.189   5.133   5.251
  224    H    VAL  31           H        VAL  31 -11.437   7.882   3.010
  225    HA   VAL  31           HA       VAL  31  -9.205   8.035   1.148
  226    HB   VAL  31           HB       VAL  31 -10.839  10.349   2.170
  227   1HG1  VAL  31          1HG1      VAL  31  -8.606  10.209   0.526
  228   2HG1  VAL  31          2HG1      VAL  31  -9.960  10.418  -0.584
  229   3HG1  VAL  31          3HG1      VAL  31  -9.695  11.583   0.713
  230   1HG2  VAL  31          1HG2      VAL  31 -11.670   8.147   0.477
  231   2HG2  VAL  31          2HG2      VAL  31 -12.629   9.440   1.198
  232   3HG2  VAL  31          3HG2      VAL  31 -11.810   9.703  -0.341
  233    H    ASP  32           H        ASP  32  -8.394   7.249   3.690
  234    HA   ASP  32           HA       ASP  32  -6.185   8.708   4.235
  235   1HB   ASP  32          1HB       ASP  32  -6.950   9.969   6.365
  236   2HB   ASP  32          2HB       ASP  32  -7.276  10.706   4.800
  237    H    ASP  33           H        ASP  33  -5.990   6.310   4.465
  238    HA   ASP  33           HA       ASP  33  -6.022   5.637   7.296
  239   1HB   ASP  33          1HB       ASP  33  -7.092   3.448   6.901
  240   2HB   ASP  33          2HB       ASP  33  -8.178   4.785   6.533
  241    H    THR  34           H        THR  34  -4.003   5.041   7.705
  242    HA   THR  34           HA       THR  34  -2.074   4.400   5.833
  243    HB   THR  34           HB       THR  34  -1.108   3.116   7.965
  244    HG1  THR  34           HG1      THR  34  -2.199   3.526   9.698
  245   1HG2  THR  34          1HG2      THR  34  -0.187   5.139   6.841
  246   2HG2  THR  34          2HG2      THR  34  -1.233   6.108   7.882
  247   3HG2  THR  34          3HG2      THR  34   0.022   5.092   8.593
  248    H    LEU  35           H        LEU  35  -1.964   2.801   4.487
  249    HA   LEU  35           HA       LEU  35  -3.274   0.268   5.060
  250   1HB   LEU  35          1HB       LEU  35  -1.825   1.254   2.596
  251   2HB   LEU  35          2HB       LEU  35  -2.644  -0.292   2.725
  252    HG   LEU  35           HG       LEU  35  -3.982   2.407   2.928
  253   1HD1  LEU  35          1HD1      LEU  35  -3.096   1.753   0.664
  254   2HD1  LEU  35          2HD1      LEU  35  -4.206   0.384   0.714
  255   3HD1  LEU  35          3HD1      LEU  35  -4.835   2.031   0.751
  256   1HD2  LEU  35          1HD2      LEU  35  -4.914  -0.391   3.306
  257   2HD2  LEU  35          2HD2      LEU  35  -5.399   1.087   4.137
  258   3HD2  LEU  35          3HD2      LEU  35  -5.997   0.754   2.513
  259    H    ILE  36           H        ILE  36  -0.064   1.603   4.462
  260    HA   ILE  36           HA       ILE  36   1.142  -0.495   6.015
  261    HB   ILE  36           HB       ILE  36   2.771  -1.184   4.252
  262   1HG1  ILE  36          1HG1      ILE  36   2.368  -0.856   1.948
  263   2HG1  ILE  36          2HG1      ILE  36   0.772  -0.174   2.233
  264   1HG2  ILE  36          1HG2      ILE  36   0.562  -2.339   4.972
  265   2HG2  ILE  36          2HG2      ILE  36   0.059  -1.961   3.326
  266   3HG2  ILE  36          3HG2      ILE  36   1.488  -2.958   3.606
  267   1HD1  ILE  36          1HD1      ILE  36   3.306   1.184   3.107
  268   2HD1  ILE  36          2HD1      ILE  36   2.586   1.422   1.514
  269   3HD1  ILE  36          3HD1      ILE  36   1.688   1.873   2.964
  270    H    THR  37           H        THR  37   3.696  -0.272   5.604
  271    HA   THR  37           HA       THR  37   4.402   2.555   5.424
  272    HB   THR  37           HB       THR  37   5.397   0.740   7.631
  273    HG1  THR  37           HG1      THR  37   3.274   2.573   7.542
  274   1HG2  THR  37          1HG2      THR  37   6.816   2.721   6.855
  275   2HG2  THR  37          2HG2      THR  37   5.560   3.725   7.579
  276   3HG2  THR  37          3HG2      THR  37   6.454   2.578   8.575
  277    H    LEU  38           H        LEU  38   6.250   2.869   4.293
  278    HA   LEU  38           HA       LEU  38   7.797   0.462   3.598
  279   1HB   LEU  38          1HB       LEU  38   6.965   2.845   2.000
  280   2HB   LEU  38          2HB       LEU  38   8.423   1.978   1.557
  281    HG   LEU  38           HG       LEU  38   6.796   1.050   0.185
  282   1HD1  LEU  38          1HD1      LEU  38   8.054  -0.573   1.845
  283   2HD1  LEU  38          2HD1      LEU  38   6.404  -0.910   2.369
  284   3HD1  LEU  38          3HD1      LEU  38   6.862  -1.159   0.685
  285   1HD2  LEU  38          1HD2      LEU  38   5.001   2.077   1.974
  286   2HD2  LEU  38          2HD2      LEU  38   4.598   1.089   0.569
  287   3HD2  LEU  38          3HD2      LEU  38   4.770   0.336   2.155
  288    H    GLU  39           H        GLU  39  10.060   0.646   3.391
  289    HA   GLU  39           HA       GLU  39  11.379   3.113   4.042
  290   1HB   GLU  39          1HB       GLU  39  10.782   2.499   6.279
  291   2HB   GLU  39          2HB       GLU  39  11.338   0.849   6.034
  292   1HG   GLU  39          1HG       GLU  39  13.629   1.613   5.868
  293   2HG   GLU  39          2HG       GLU  39  13.101   3.289   6.017
  294    H    THR  40           H        THR  40  13.751   2.859   4.100
  295    HA   THR  40           HA       THR  40  14.686   0.460   2.689
  296    HB   THR  40           HB       THR  40  14.799   1.732   0.824
  297    HG1  THR  40           HG1      THR  40  16.993   1.572   1.386
  298   1HG2  THR  40          1HG2      THR  40  13.523   3.598   1.908
  299   2HG2  THR  40          2HG2      THR  40  15.080   4.309   2.333
  300   3HG2  THR  40          3HG2      THR  40  14.652   4.076   0.640
  301    H    ASP  41           H        ASP  41  16.402   3.441   3.440
  302    HA   ASP  41           HA       ASP  41  17.814   2.138   5.638
  303   1HB   ASP  41          1HB       ASP  41  20.006   2.648   4.733
  304   2HB   ASP  41          2HB       ASP  41  19.117   1.663   3.575
  305    H    LYS  42           H        LYS  42  17.382   5.069   3.693
  306    HA   LYS  42           HA       LYS  42  17.641   6.642   6.169
  307   1HB   LYS  42          1HB       LYS  42  19.461   6.714   4.099
  308   2HB   LYS  42          2HB       LYS  42  18.405   8.071   3.732
  309   1HG   LYS  42          1HG       LYS  42  19.892   7.620   6.311
  310   2HG   LYS  42          2HG       LYS  42  20.297   8.792   5.056
  311   1HD   LYS  42          1HD       LYS  42  17.540   8.997   5.996
  312   2HD   LYS  42          2HD       LYS  42  18.738   9.283   7.261
  313   1HE   LYS  42          1HE       LYS  42  19.836  10.941   5.804
  314   2HE   LYS  42          2HE       LYS  42  18.579  10.684   4.594
  315   1HZ   LYS  42          1HZ       LYS  42  17.732  11.389   7.302
  316   2HZ   LYS  42          2HZ       LYS  42  18.430  12.610   6.362
  317   3HZ   LYS  42          3HZ       LYS  42  17.047  11.806   5.813
  318    H    ALA  43           H        ALA  43  15.218   5.707   5.204
  319    HA   ALA  43           HA       ALA  43  13.708   8.076   5.057
  320   1HB   ALA  43          1HB       ALA  43  14.551   6.930   2.497
  321   2HB   ALA  43          2HB       ALA  43  13.956   8.545   2.878
  322   3HB   ALA  43          3HB       ALA  43  12.817   7.223   2.629
  323    H    THR  44           H        THR  44  11.681   7.665   5.709
  324    HA   THR  44           HA       THR  44  10.661   4.915   5.458
  325    HB   THR  44           HB       THR  44   9.890   4.893   7.694
  326    HG1  THR  44           HG1      THR  44   9.094   6.847   8.117
  327   1HG2  THR  44          1HG2      THR  44  12.426   4.718   7.382
  328   2HG2  THR  44          2HG2      THR  44  12.479   6.335   8.082
  329   3HG2  THR  44          3HG2      THR  44  11.798   4.997   9.006
  330    H    MET  45           H        MET  45   8.835   4.905   4.335
  331    HA   MET  45           HA       MET  45   7.088   7.275   4.490
  332   1HB   MET  45          1HB       MET  45   8.207   5.908   2.226
  333   2HB   MET  45          2HB       MET  45   6.452   5.805   2.165
  334   1HG   MET  45          1HG       MET  45   8.128   8.297   2.313
  335   2HG   MET  45          2HG       MET  45   7.151   7.739   0.957
  336   1HE   MET  45          1HE       MET  45   5.663   9.393   0.400
  337   2HE   MET  45          2HE       MET  45   4.563  10.304   1.435
  338   3HE   MET  45          3HE       MET  45   6.287  10.677   1.436
  339    H    ASP  46           H        ASP  46   4.883   6.320   3.222
  340    HA   ASP  46           HA       ASP  46   3.926   3.817   4.033
  341   1HB   ASP  46          1HB       ASP  46   2.487   4.396   5.901
  342   2HB   ASP  46          2HB       ASP  46   4.151   4.810   6.305
  343    H    VAL  47           H        VAL  47   1.463   3.722   3.832
  344    HA   VAL  47           HA       VAL  47   0.580   5.780   1.913
  345    HB   VAL  47           HB       VAL  47  -0.106   2.841   1.855
  346   1HG1  VAL  47          1HG1      VAL  47  -1.616   4.949   0.923
  347   2HG1  VAL  47          2HG1      VAL  47  -0.708   4.442  -0.501
  348   3HG1  VAL  47          3HG1      VAL  47  -1.713   3.279   0.363
  349   1HG2  VAL  47          1HG2      VAL  47   2.249   3.728   1.125
  350   2HG2  VAL  47          2HG2      VAL  47   1.388   2.554   0.129
  351   3HG2  VAL  47          3HG2      VAL  47   1.374   4.262  -0.310
  352    HA   PRO  48           HA       PRO  48  -2.759   5.949   4.954
  353   1HB   PRO  48          1HB       PRO  48  -3.408   8.496   4.611
  354   2HB   PRO  48          2HB       PRO  48  -1.869   8.064   5.371
  355   1HG   PRO  48          1HG       PRO  48  -2.416   8.983   2.582
  356   2HG   PRO  48          2HG       PRO  48  -1.064   9.391   3.651
  357   1HD   PRO  48          1HD       PRO  48  -1.030   7.455   1.628
  358   2HD   PRO  48          2HD       PRO  48   0.149   7.600   2.946
  359    H    ALA  49           H        ALA  49  -3.090   4.928   2.170
  360    HA   ALA  49           HA       ALA  49  -4.740   4.498   0.663
  361   1HB   ALA  49          1HB       ALA  49  -7.092   5.315   1.930
  362   2HB   ALA  49          2HB       ALA  49  -6.011   4.804   3.227
  363   3HB   ALA  49          3HB       ALA  49  -6.394   3.695   1.910
  364    H    GLU  50           H        GLU  50  -6.482   5.485  -0.686
  365    HA   GLU  50           HA       GLU  50  -6.824   8.335  -0.550
  366   1HB   GLU  50          1HB       GLU  50  -4.572   7.512  -1.866
  367   2HB   GLU  50          2HB       GLU  50  -5.741   7.605  -3.177
  368   1HG   GLU  50          1HG       GLU  50  -6.254   9.948  -2.059
  369   2HG   GLU  50          2HG       GLU  50  -4.594   9.759  -1.495
  370    H    VAL  51           H        VAL  51  -8.690   6.356  -0.393
  371    HA   VAL  51           HA       VAL  51 -10.526   7.110  -2.396
  372    HB   VAL  51           HB       VAL  51 -10.780   4.579  -3.171
  373   1HG1  VAL  51          1HG1      VAL  51  -9.792   6.969  -4.273
  374   2HG1  VAL  51          2HG1      VAL  51  -8.702   5.687  -4.800
  375   3HG1  VAL  51          3HG1      VAL  51 -10.430   5.567  -5.129
  376   1HG2  VAL  51          1HG2      VAL  51  -7.835   4.878  -2.575
  377   2HG2  VAL  51          2HG2      VAL  51  -8.939   3.661  -1.935
  378   3HG2  VAL  51          3HG2      VAL  51  -8.509   3.646  -3.644
  379    H    ALA  52           H        ALA  52 -12.613   5.923  -2.196
  380    HA   ALA  52           HA       ALA  52 -12.917   4.812   0.522
  381   1HB   ALA  52          1HB       ALA  52 -14.799   6.571  -1.026
  382   2HB   ALA  52          2HB       ALA  52 -15.175   5.804   0.518
  383   3HB   ALA  52          3HB       ALA  52 -13.885   7.003   0.422
  384    H    GLY  53           H        GLY  53 -12.781   2.649  -0.218
  385   1HA   GLY  53          1HA       GLY  53 -14.039   1.437  -2.305
  386   2HA   GLY  53          2HA       GLY  53 -15.314   1.623  -1.118
  387    H    VAL  54           H        VAL  54 -13.765  -0.727  -2.288
  388    HA   VAL  54           HA       VAL  54 -12.848  -1.925   0.242
  389    HB   VAL  54           HB       VAL  54 -14.638  -3.247  -1.805
  390   1HG1  VAL  54          1HG1      VAL  54 -12.780  -4.418  -0.081
  391   2HG1  VAL  54          2HG1      VAL  54 -14.343  -4.645   0.702
  392   3HG1  VAL  54          3HG1      VAL  54 -14.089  -5.226  -0.943
  393   1HG2  VAL  54          1HG2      VAL  54 -15.157  -1.814   0.703
  394   2HG2  VAL  54          2HG2      VAL  54 -16.229  -2.157  -0.655
  395   3HG2  VAL  54          3HG2      VAL  54 -15.944  -3.388   0.577
  396    H    VAL  55           H        VAL  55 -11.034  -3.170   0.094
  397    HA   VAL  55           HA       VAL  55  -9.524  -3.045  -2.319
  398    HB   VAL  55           HB       VAL  55  -8.938  -4.654   0.164
  399   1HG1  VAL  55          1HG1      VAL  55  -7.762  -5.365  -1.946
  400   2HG1  VAL  55          2HG1      VAL  55  -7.031  -3.759  -1.997
  401   3HG1  VAL  55          3HG1      VAL  55  -6.695  -4.837  -0.642
  402   1HG2  VAL  55          1HG2      VAL  55  -9.159  -2.037   0.225
  403   2HG2  VAL  55          2HG2      VAL  55  -7.829  -2.847   1.050
  404   3HG2  VAL  55          3HG2      VAL  55  -7.564  -2.098  -0.525
  405    H    LYS  56           H        LYS  56  -8.955  -4.634  -3.726
  406    HA   LYS  56           HA       LYS  56 -10.531  -7.120  -3.586
  407   1HB   LYS  56          1HB       LYS  56  -9.405  -6.669  -6.195
  408   2HB   LYS  56          2HB       LYS  56 -11.094  -6.854  -5.741
  409   1HG   LYS  56          1HG       LYS  56  -9.633  -4.245  -5.485
  410   2HG   LYS  56          2HG       LYS  56 -10.460  -4.732  -6.964
  411   1HD   LYS  56          1HD       LYS  56 -11.866  -4.729  -4.311
  412   2HD   LYS  56          2HD       LYS  56 -11.742  -3.265  -5.287
  413   1HE   LYS  56          1HE       LYS  56 -13.661  -4.004  -6.200
  414   2HE   LYS  56          2HE       LYS  56 -12.591  -5.038  -7.146
  415   1HZ   LYS  56          1HZ       LYS  56 -12.985  -6.433  -4.842
  416   2HZ   LYS  56          2HZ       LYS  56 -14.503  -5.750  -5.138
  417   3HZ   LYS  56          3HZ       LYS  56 -13.766  -6.717  -6.315
  418    H    GLU  57           H        GLU  57  -7.471  -5.701  -4.633
  419    HA   GLU  57           HA       GLU  57  -6.257  -8.335  -4.333
  420   1HB   GLU  57          1HB       GLU  57  -5.795  -6.119  -6.240
  421   2HB   GLU  57          2HB       GLU  57  -4.376  -7.017  -5.719
  422   1HG   GLU  57          1HG       GLU  57  -6.782  -8.486  -6.694
  423   2HG   GLU  57          2HG       GLU  57  -5.678  -7.739  -7.847
  424    H    VAL  58           H        VAL  58  -3.801  -8.132  -3.865
  425    HA   VAL  58           HA       VAL  58  -2.958  -5.941  -2.214
  426    HB   VAL  58           HB       VAL  58  -4.370  -7.054  -0.578
  427   1HG1  VAL  58          1HG1      VAL  58  -3.412  -9.409  -1.850
  428   2HG1  VAL  58          2HG1      VAL  58  -3.004  -9.492  -0.135
  429   3HG1  VAL  58          3HG1      VAL  58  -4.679  -9.248  -0.633
  430   1HG2  VAL  58          1HG2      VAL  58  -1.768  -6.348  -0.206
  431   2HG2  VAL  58          2HG2      VAL  58  -2.886  -6.791   1.086
  432   3HG2  VAL  58          3HG2      VAL  58  -1.781  -7.996   0.423
  433    H    LYS  59           H        LYS  59  -0.880  -5.759  -2.644
  434    HA   LYS  59           HA       LYS  59   0.735  -8.194  -2.979
  435   1HB   LYS  59          1HB       LYS  59   1.382  -5.793  -4.623
  436   2HB   LYS  59          2HB       LYS  59   1.659  -7.495  -4.970
  437   1HG   LYS  59          1HG       LYS  59  -1.078  -7.334  -4.942
  438   2HG   LYS  59          2HG       LYS  59  -0.604  -5.787  -5.645
  439   1HD   LYS  59          1HD       LYS  59   0.914  -7.137  -7.184
  440   2HD   LYS  59          2HD       LYS  59   0.025  -8.556  -6.626
  441   1HE   LYS  59          1HE       LYS  59  -1.847  -6.525  -7.339
  442   2HE   LYS  59          2HE       LYS  59  -0.690  -6.713  -8.657
  443   1HZ   LYS  59          1HZ       LYS  59  -1.936  -9.085  -7.428
  444   2HZ   LYS  59          2HZ       LYS  59  -2.773  -8.197  -8.600
  445   3HZ   LYS  59          3HZ       LYS  59  -1.286  -8.905  -8.980
  446    H    VAL  60           H        VAL  60   0.942  -7.396  -0.618
  447    HA   VAL  60           HA       VAL  60   3.539  -6.343  -0.290
  448    HB   VAL  60           HB       VAL  60   2.831  -4.172  -0.668
  449   1HG1  VAL  60          1HG1      VAL  60   0.265  -4.837   0.766
  450   2HG1  VAL  60          2HG1      VAL  60   0.685  -3.240   0.147
  451   3HG1  VAL  60          3HG1      VAL  60   0.485  -4.594  -0.968
  452   1HG2  VAL  60          1HG2      VAL  60   3.784  -4.558   1.707
  453   2HG2  VAL  60          2HG2      VAL  60   3.056  -3.001   1.322
  454   3HG2  VAL  60          3HG2      VAL  60   2.147  -4.195   2.248
  455    H    LYS  61           H        LYS  61   4.253  -6.418   1.868
  456    HA   LYS  61           HA       LYS  61   2.606  -6.961   4.087
  457   1HB   LYS  61          1HB       LYS  61   3.607  -9.405   4.306
  458   2HB   LYS  61          2HB       LYS  61   2.090  -9.106   3.468
  459   1HG   LYS  61          1HG       LYS  61   4.528  -8.967   1.817
  460   2HG   LYS  61          2HG       LYS  61   4.097 -10.559   2.446
  461   1HD   LYS  61          1HD       LYS  61   1.693  -9.512   1.544
  462   2HD   LYS  61          2HD       LYS  61   2.867  -9.001   0.329
  463   1HE   LYS  61          1HE       LYS  61   3.665 -11.488   0.492
  464   2HE   LYS  61          2HE       LYS  61   2.048 -11.753   1.143
  465   1HZ   LYS  61          1HZ       LYS  61   1.256 -10.517  -0.918
  466   2HZ   LYS  61          2HZ       LYS  61   2.810 -10.771  -1.537
  467   3HZ   LYS  61          3HZ       LYS  61   1.832 -12.093  -1.135
  468    H    VAL  62           H        VAL  62   4.017  -8.012   5.918
  469    HA   VAL  62           HA       VAL  62   6.381  -6.383   6.098
  470    HB   VAL  62           HB       VAL  62   5.300  -8.425   8.045
  471   1HG1  VAL  62          1HG1      VAL  62   7.794  -7.197   7.993
  472   2HG1  VAL  62          2HG1      VAL  62   6.861  -6.268   9.166
  473   3HG1  VAL  62          3HG1      VAL  62   7.043  -8.011   9.365
  474   1HG2  VAL  62          1HG2      VAL  62   4.122  -6.066   7.290
  475   2HG2  VAL  62          2HG2      VAL  62   3.865  -6.896   8.825
  476   3HG2  VAL  62          3HG2      VAL  62   5.051  -5.595   8.714
  477    H    GLY  63           H        GLY  63   7.321  -7.611   4.164
  478   1HA   GLY  63          1HA       GLY  63   8.374 -10.242   4.736
  479   2HA   GLY  63          2HA       GLY  63   9.576  -8.963   4.794
  480    H    ASP  64           H        ASP  64   9.108  -7.368   2.742
  481    HA   ASP  64           HA       ASP  64   9.980  -8.859   0.512
  482   1HB   ASP  64          1HB       ASP  64   8.060  -8.496  -0.999
  483   2HB   ASP  64          2HB       ASP  64   7.651  -9.556   0.347
  484    H    LYS  65           H        LYS  65  11.083  -7.562  -0.818
  485    HA   LYS  65           HA       LYS  65  11.248  -4.764  -0.224
  486   1HB   LYS  65          1HB       LYS  65  12.533  -6.287  -2.497
  487   2HB   LYS  65          2HB       LYS  65  13.005  -4.703  -1.896
  488   1HG   LYS  65          1HG       LYS  65  13.058  -6.484   0.298
  489   2HG   LYS  65          2HG       LYS  65  13.882  -7.271  -1.049
  490   1HD   LYS  65          1HD       LYS  65  14.543  -4.429  -0.629
  491   2HD   LYS  65          2HD       LYS  65  15.073  -5.534   0.641
  492   1HE   LYS  65          1HE       LYS  65  15.643  -5.898  -2.297
  493   2HE   LYS  65          2HE       LYS  65  16.764  -5.175  -1.144
  494   1HZ   LYS  65          1HZ       LYS  65  16.408  -7.371   0.135
  495   2HZ   LYS  65          2HZ       LYS  65  15.869  -7.972  -1.352
  496   3HZ   LYS  65          3HZ       LYS  65  17.439  -7.360  -1.205
  497    H    ILE  66           H        ILE  66   9.984  -3.243  -1.033
  498    HA   ILE  66           HA       ILE  66   8.549  -3.781  -3.531
  499    HB   ILE  66           HB       ILE  66   7.520  -3.047  -1.142
  500   1HG1  ILE  66          1HG1      ILE  66   5.479  -2.433  -2.408
  501   2HG1  ILE  66          2HG1      ILE  66   6.444  -2.375  -3.882
  502   1HG2  ILE  66          1HG2      ILE  66   7.854  -0.463  -2.647
  503   2HG2  ILE  66          2HG2      ILE  66   6.737  -0.706  -1.305
  504   3HG2  ILE  66          3HG2      ILE  66   8.474  -0.854  -1.044
  505   1HD1  ILE  66          1HD1      ILE  66   7.004  -4.843  -2.710
  506   2HD1  ILE  66          2HD1      ILE  66   5.258  -4.625  -2.571
  507   3HD1  ILE  66          3HD1      ILE  66   6.035  -4.528  -4.152
  508    H    SER  67           H        SER  67   8.006  -1.647  -4.767
  509    HA   SER  67           HA       SER  67  10.241   0.230  -4.733
  510   1HB   SER  67          1HB       SER  67   9.409  -1.111  -7.308
  511   2HB   SER  67          2HB       SER  67  10.793  -0.053  -7.038
  512    HG   SER  67           HG       SER  67  11.502  -2.174  -7.050
  513    H    GLU  68           H        GLU  68   9.704   2.267  -5.315
  514    HA   GLU  68           HA       GLU  68   7.221   3.302  -5.154
  515   1HB   GLU  68          1HB       GLU  68   9.513   4.252  -6.869
  516   2HB   GLU  68          2HB       GLU  68   8.055   5.199  -6.606
  517   1HG   GLU  68          1HG       GLU  68   8.538   5.578  -4.383
  518   2HG   GLU  68          2HG       GLU  68   9.608   4.181  -4.271
  519    H    GLY  69           H        GLY  69   5.399   3.368  -6.326
  520   1HA   GLY  69          1HA       GLY  69   5.368   3.230  -9.179
  521   2HA   GLY  69          2HA       GLY  69   3.965   3.193  -8.122
  522    H    GLY  70           H        GLY  70   3.940   1.016  -6.762
  523   1HA   GLY  70          1HA       GLY  70   4.754  -1.374  -7.093
  524   2HA   GLY  70          2HA       GLY  70   4.227  -1.139  -8.754
  525    H    LEU  71           H        LEU  71   2.442  -2.291  -9.059
  526    HA   LEU  71           HA       LEU  71  -0.001  -1.662  -7.934
  527   1HB   LEU  71          1HB       LEU  71   0.435  -3.006 -10.030
  528   2HB   LEU  71          2HB       LEU  71   0.720  -4.390  -8.991
  529    HG   LEU  71           HG       LEU  71  -1.528  -4.501  -8.315
  530   1HD1  LEU  71          1HD1      LEU  71  -1.569  -1.646  -9.062
  531   2HD1  LEU  71          2HD1      LEU  71  -3.055  -2.549  -9.347
  532   3HD1  LEU  71          3HD1      LEU  71  -2.361  -2.484  -7.727
  533   1HD2  LEU  71          1HD2      LEU  71  -1.201  -3.867 -11.219
  534   2HD2  LEU  71          2HD2      LEU  71  -1.484  -5.422 -10.438
  535   3HD2  LEU  71          3HD2      LEU  71  -2.792  -4.246 -10.562
  536    H    ILE  72           H        ILE  72  -0.009  -1.538  -5.744
  537    HA   ILE  72           HA       ILE  72   0.777  -3.860  -4.183
  538    HB   ILE  72           HB       ILE  72   0.347  -0.980  -3.622
  539   1HG1  ILE  72          1HG1      ILE  72   2.230  -2.548  -2.020
  540   2HG1  ILE  72          2HG1      ILE  72   2.487  -2.688  -3.756
  541   1HG2  ILE  72          1HG2      ILE  72  -0.495  -3.100  -1.720
  542   2HG2  ILE  72          2HG2      ILE  72   0.460  -1.762  -1.076
  543   3HG2  ILE  72          3HG2      ILE  72  -1.067  -1.441  -1.898
  544   1HD1  ILE  72          1HD1      ILE  72   2.122   0.004  -2.553
  545   2HD1  ILE  72          2HD1      ILE  72   3.669  -0.825  -2.385
  546   3HD1  ILE  72          3HD1      ILE  72   3.024  -0.478  -3.991
  547    H    VAL  73           H        VAL  73  -1.976  -1.661  -3.637
  548    HA   VAL  73           HA       VAL  73  -3.714  -4.038  -3.585
  549    HB   VAL  73           HB       VAL  73  -4.950  -3.143  -1.712
  550   1HG1  VAL  73          1HG1      VAL  73  -2.233  -3.988  -1.605
  551   2HG1  VAL  73          2HG1      VAL  73  -2.516  -2.821  -0.312
  552   3HG1  VAL  73          3HG1      VAL  73  -3.526  -4.263  -0.437
  553   1HG2  VAL  73          1HG2      VAL  73  -4.634  -0.757  -2.227
  554   2HG2  VAL  73          2HG2      VAL  73  -4.277  -1.131  -0.540
  555   3HG2  VAL  73          3HG2      VAL  73  -2.959  -0.876  -1.685
  556    H    VAL  74           H        VAL  74  -5.655  -3.887  -4.523
  557    HA   VAL  74           HA       VAL  74  -6.335  -1.334  -5.833
  558    HB   VAL  74           HB       VAL  74  -7.130  -4.163  -6.564
  559   1HG1  VAL  74          1HG1      VAL  74  -8.559  -1.894  -7.101
  560   2HG1  VAL  74          2HG1      VAL  74  -7.551  -2.049  -8.539
  561   3HG1  VAL  74          3HG1      VAL  74  -8.605  -3.377  -8.055
  562   1HG2  VAL  74          1HG2      VAL  74  -4.989  -2.331  -7.504
  563   2HG2  VAL  74          2HG2      VAL  74  -4.973  -4.085  -7.307
  564   3HG2  VAL  74          3HG2      VAL  74  -5.785  -3.358  -8.695
  565    H    VAL  75           H        VAL  75  -8.315  -0.409  -5.427
  566    HA   VAL  75           HA       VAL  75 -10.150  -1.926  -3.705
  567    HB   VAL  75           HB       VAL  75 -10.762   0.440  -2.817
  568   1HG1  VAL  75          1HG1      VAL  75  -8.414  -1.245  -2.046
  569   2HG1  VAL  75          2HG1      VAL  75  -8.824   0.206  -1.132
  570   3HG1  VAL  75          3HG1      VAL  75  -9.991  -1.108  -1.268
  571   1HG2  VAL  75          1HG2      VAL  75  -8.032   0.866  -3.987
  572   2HG2  VAL  75          2HG2      VAL  75  -9.480   1.855  -4.174
  573   3HG2  VAL  75          3HG2      VAL  75  -8.628   1.823  -2.632
  574    H    GLU  76           H        GLU  76 -12.363  -0.967  -3.621
  575    HA   GLU  76           HA       GLU  76 -13.403  -0.783  -6.265
  576   1HB   GLU  76          1HB       GLU  76 -14.429  -1.604  -3.894
  577   2HB   GLU  76          2HB       GLU  76 -15.137   0.003  -4.001
  578   1HG   GLU  76          1HG       GLU  76 -16.016  -0.588  -6.242
  579   2HG   GLU  76          2HG       GLU  76 -15.409  -2.226  -6.002
  580    H    ALA  77           H        ALA  77 -12.852   1.510  -3.652
  581    HA   ALA  77           HA       ALA  77 -12.897   3.765  -3.533
  582   1HB   ALA  77          1HB       ALA  77 -11.158   3.734  -5.084
  583   2HB   ALA  77          2HB       ALA  77 -12.239   3.344  -6.421
  584   3HB   ALA  77          3HB       ALA  77 -12.290   4.945  -5.685
  585    H    GLU  78           H        GLU  78 -14.550   5.056  -3.187
  586    HA   GLU  78           HA       GLU  78 -16.706   5.825  -3.226
  587   1HB   GLU  78          1HB       GLU  78 -17.250   7.049  -5.285
  588   2HB   GLU  78          2HB       GLU  78 -15.593   7.335  -4.770
  589   1HG   GLU  78          1HG       GLU  78 -14.731   5.930  -6.473
  590   2HG   GLU  78          2HG       GLU  78 -16.335   5.317  -6.869
  591    H    GLY  79           H        GLY  79 -16.769   3.090  -3.314
  592   1HA   GLY  79          1HA       GLY  79 -18.068   1.290  -3.904
  593   2HA   GLY  79          2HA       GLY  79 -18.257   2.031  -5.486
  594    H    THR  80           H        THR  80 -20.173   2.909  -6.014
  595    HA   THR  80           HA       THR  80 -22.136   3.309  -3.855
  596    HB   THR  80           HB       THR  80 -23.300   4.819  -5.468
  597    HG1  THR  80           HG1      THR  80 -20.945   4.465  -7.006
  598   1HG2  THR  80          1HG2      THR  80 -20.451   5.516  -4.816
  599   2HG2  THR  80          2HG2      THR  80 -21.635   6.659  -5.450
  600   3HG2  THR  80          3HG2      THR  80 -21.895   5.901  -3.880
  601    H    ALA  81           H        ALA  81 -22.368   2.773  -7.370
  602    HA   ALA  81           HA       ALA  81 -23.574   1.295  -8.611
  603   1HB   ALA  81          1HB       ALA  81 -23.525  -0.900  -7.994
  604   2HB   ALA  81          2HB       ALA  81 -22.324  -0.262  -6.871
  605   3HB   ALA  81          3HB       ALA  81 -23.975  -0.557  -6.324

  No H/Q in entry =         605
  Start of MODEL    4
    1    H1   ALA   1           H1       ALA   1 -13.817   5.838  -9.005
    2    H2   ALA   1           H2       ALA   1 -13.174   6.180 -10.556
    3    H3   ALA   1           H3       ALA   1 -14.871   6.024 -10.346
    4    HA   ALA   1           HA       ALA   1 -14.807   3.805 -10.147
    5   1HB   ALA   1          1HB       ALA   1 -13.964   3.143 -12.138
    6   2HB   ALA   1          2HB       ALA   1 -12.382   3.860 -11.832
    7   3HB   ALA   1          3HB       ALA   1 -13.725   4.877 -12.351
    8    H    LEU   2           H        LEU   2 -12.994   1.861 -10.393
    9    HA   LEU   2           HA       LEU   2 -12.034   1.427  -7.843
   10   1HB   LEU   2          1HB       LEU   2 -11.019   0.300 -10.453
   11   2HB   LEU   2          2HB       LEU   2 -10.588  -0.325  -8.872
   12    HG   LEU   2           HG       LEU   2 -13.431  -0.230  -9.030
   13   1HD1  LEU   2          1HD1      LEU   2 -12.835  -0.254 -11.527
   14   2HD1  LEU   2          2HD1      LEU   2 -12.298  -1.908 -11.238
   15   3HD1  LEU   2          3HD1      LEU   2 -13.975  -1.458 -10.930
   16   1HD2  LEU   2          1HD2      LEU   2 -11.467  -1.850  -8.010
   17   2HD2  LEU   2          2HD2      LEU   2 -13.194  -2.209  -8.018
   18   3HD2  LEU   2          3HD2      LEU   2 -12.156  -2.840  -9.297
   19    H    VAL   3           H        VAL   3  -9.582   0.886  -7.466
   20    HA   VAL   3           HA       VAL   3  -7.858   2.985  -8.542
   21    HB   VAL   3           HB       VAL   3  -8.698   2.737  -5.678
   22   1HG1  VAL   3          1HG1      VAL   3  -6.264   2.444  -5.587
   23   2HG1  VAL   3          2HG1      VAL   3  -6.056   3.924  -6.528
   24   3HG1  VAL   3          3HG1      VAL   3  -6.761   3.998  -4.912
   25   1HG2  VAL   3          1HG2      VAL   3  -8.808   4.689  -7.795
   26   2HG2  VAL   3          2HG2      VAL   3  -9.683   4.636  -6.266
   27   3HG2  VAL   3          3HG2      VAL   3  -8.079   5.363  -6.337
   28    H    GLU   4           H        GLU   4  -5.575   2.669  -7.941
   29    HA   GLU   4           HA       GLU   4  -4.924  -0.127  -7.307
   30   1HB   GLU   4          1HB       GLU   4  -3.175   1.268  -9.257
   31   2HB   GLU   4          2HB       GLU   4  -3.628  -0.427  -9.165
   32   1HG   GLU   4          1HG       GLU   4  -5.949   0.379  -9.942
   33   2HG   GLU   4          2HG       GLU   4  -5.101   1.849 -10.422
   34    H    LEU   5           H        LEU   5  -4.289   0.419  -5.214
   35    HA   LEU   5           HA       LEU   5  -2.786   2.553  -4.366
   36   1HB   LEU   5          1HB       LEU   5  -3.676   0.185  -3.241
   37   2HB   LEU   5          2HB       LEU   5  -1.931   0.075  -3.093
   38    HG   LEU   5           HG       LEU   5  -3.151   1.064  -1.116
   39   1HD1  LEU   5          1HD1      LEU   5  -0.693   1.695  -2.272
   40   2HD1  LEU   5          2HD1      LEU   5  -1.390   3.241  -1.787
   41   3HD1  LEU   5          3HD1      LEU   5  -1.186   1.954  -0.599
   42   1HD2  LEU   5          1HD2      LEU   5  -4.374   2.622  -3.044
   43   2HD2  LEU   5          2HD2      LEU   5  -4.430   2.881  -1.301
   44   3HD2  LEU   5          3HD2      LEU   5  -3.228   3.723  -2.279
   45    H    LYS   6           H        LYS   6  -0.529   2.807  -3.868
   46    HA   LYS   6           HA       LYS   6   1.330   1.079  -5.299
   47   1HB   LYS   6          1HB       LYS   6   1.057   4.037  -5.844
   48   2HB   LYS   6          2HB       LYS   6   2.396   3.045  -6.400
   49   1HG   LYS   6          1HG       LYS   6   0.287   1.626  -7.336
   50   2HG   LYS   6          2HG       LYS   6  -0.343   3.273  -7.425
   51   1HD   LYS   6          1HD       LYS   6   2.171   3.585  -8.432
   52   2HD   LYS   6          2HD       LYS   6   1.760   1.965  -8.998
   53   1HE   LYS   6          1HE       LYS   6  -0.120   4.282  -9.331
   54   2HE   LYS   6          2HE       LYS   6   1.157   3.953 -10.501
   55   1HZ   LYS   6          1HZ       LYS   6  -0.783   1.871  -9.699
   56   2HZ   LYS   6          2HZ       LYS   6  -1.122   2.961 -10.946
   57   3HZ   LYS   6          3HZ       LYS   6   0.204   1.918 -11.072
   58    H    VAL   7           H        VAL   7   3.477   1.247  -4.623
   59    HA   VAL   7           HA       VAL   7   3.964   1.641  -1.943
   60    HB   VAL   7           HB       VAL   7   5.931   1.876  -4.227
   61   1HG1  VAL   7          1HG1      VAL   7   6.701   2.816  -2.018
   62   2HG1  VAL   7          2HG1      VAL   7   6.556   1.183  -1.369
   63   3HG1  VAL   7          3HG1      VAL   7   7.687   1.513  -2.681
   64   1HG2  VAL   7          1HG2      VAL   7   4.601  -0.240  -4.075
   65   2HG2  VAL   7          2HG2      VAL   7   6.347  -0.442  -3.956
   66   3HG2  VAL   7          3HG2      VAL   7   5.350  -0.518  -2.502
   67    HA   PRO   8           HA       PRO   8   4.046   6.037  -1.441
   68   1HB   PRO   8          1HB       PRO   8   5.550   6.209   0.824
   69   2HB   PRO   8          2HB       PRO   8   3.849   5.729   0.814
   70   1HG   PRO   8          1HG       PRO   8   6.298   4.022   0.981
   71   2HG   PRO   8          2HG       PRO   8   4.757   3.855   1.839
   72   1HD   PRO   8          1HD       PRO   8   5.412   2.348  -0.319
   73   2HD   PRO   8          2HD       PRO   8   3.740   2.798   0.064
   74    H    ASP   9           H        ASP   9   5.933   7.618  -0.432
   75    HA   ASP   9           HA       ASP   9   8.076   7.439  -2.416
   76   1HB   ASP   9          1HB       ASP   9   6.524   9.476  -2.121
   77   2HB   ASP   9          2HB       ASP   9   7.463   9.811  -0.671
   78    H    ILE  10           H        ILE  10   8.985   5.707  -0.925
   79    HA   ILE  10           HA       ILE  10  10.040   6.417   1.598
   80    HB   ILE  10           HB       ILE  10  11.619   4.412   1.122
   81   1HG1  ILE  10          1HG1      ILE  10  10.981   2.914  -0.613
   82   2HG1  ILE  10          2HG1      ILE  10   9.527   3.836  -0.975
   83   1HG2  ILE  10          1HG2      ILE  10   9.540   4.510   2.555
   84   2HG2  ILE  10          2HG2      ILE  10   8.671   3.832   1.175
   85   3HG2  ILE  10          3HG2      ILE  10   9.982   2.922   1.929
   86   1HD1  ILE  10          1HD1      ILE  10  12.275   4.970  -1.365
   87   2HD1  ILE  10          2HD1      ILE  10  11.455   4.018  -2.603
   88   3HD1  ILE  10          3HD1      ILE  10  10.745   5.531  -2.039
   89    H    GLY  11           H        GLY  11  10.999   7.374  -1.492
   90   1HA   GLY  11          1HA       GLY  11  13.084   8.979  -0.646
   91   2HA   GLY  11          2HA       GLY  11  12.860   8.438  -2.302
   92    H    GLY  12           H        GLY  12  13.657   6.175  -2.756
   93   1HA   GLY  12          1HA       GLY  12  15.349   4.644  -1.324
   94   2HA   GLY  12          2HA       GLY  12  16.374   6.000  -1.766
   95    H    HIS  13           H        HIS  13  14.047   3.779  -3.299
   96    HA   HIS  13           HA       HIS  13  14.869   3.999  -5.912
   97   1HB   HIS  13          1HB       HIS  13  16.306   1.812  -5.973
   98   2HB   HIS  13          2HB       HIS  13  17.069   3.346  -5.569
   99    HD1  HIS  13           HD1      HIS  13  18.900   2.460  -4.078
  100    HD2  HIS  13           HD2      HIS  13  15.118   1.175  -2.932
  101    HE1  HIS  13           HE1      HIS  13  19.216   1.351  -1.843
  102    HE2  HIS  13           HE2      HIS  13  16.900   0.656  -1.131
  103    H    GLU  14           H        GLU  14  14.527   1.795  -7.145
  104    HA   GLU  14           HA       GLU  14  11.952   0.827  -6.257
  105   1HB   GLU  14          1HB       GLU  14  13.557   0.105  -8.721
  106   2HB   GLU  14          2HB       GLU  14  11.880  -0.330  -8.423
  107   1HG   GLU  14          1HG       GLU  14  11.750   2.351  -8.140
  108   2HG   GLU  14          2HG       GLU  14  13.045   2.207  -9.328
  109    H    ASN  15           H        ASN  15  13.021  -0.121  -4.326
  110    HA   ASN  15           HA       ASN  15  12.928  -2.853  -4.302
  111   1HB   ASN  15          1HB       ASN  15  15.475  -3.297  -3.950
  112   2HB   ASN  15          2HB       ASN  15  14.841  -3.214  -5.591
  113   1HD2  ASN  15          2HD2      ASN  15  15.565  -1.676  -6.945
  114   2HD2  ASN  15          1HD2      ASN  15  16.747  -0.487  -6.529
  115    H    VAL  16           H        VAL  16  11.845  -1.510  -2.551
  116    HA   VAL  16           HA       VAL  16  13.664  -1.267  -0.243
  117    HB   VAL  16           HB       VAL  16  11.773   0.296   0.630
  118   1HG1  VAL  16          1HG1      VAL  16  13.958   0.882  -1.299
  119   2HG1  VAL  16          2HG1      VAL  16  12.862   2.187  -0.845
  120   3HG1  VAL  16          3HG1      VAL  16  13.790   1.343   0.395
  121   1HG2  VAL  16          1HG2      VAL  16  10.547  -0.369  -1.679
  122   2HG2  VAL  16          2HG2      VAL  16  10.249   1.133  -0.807
  123   3HG2  VAL  16          3HG2      VAL  16  11.366   1.113  -2.174
  124    H    ASP  17           H        ASP  17  13.133  -2.263   1.619
  125    HA   ASP  17           HA       ASP  17  11.086  -4.273   1.528
  126   1HB   ASP  17          1HB       ASP  17  13.208  -3.475   3.485
  127   2HB   ASP  17          2HB       ASP  17  11.900  -4.529   4.014
  128    H    ILE  18           H        ILE  18   9.097  -4.218   2.389
  129    HA   ILE  18           HA       ILE  18   7.990  -1.771   3.277
  130    HB   ILE  18           HB       ILE  18   6.924  -4.595   3.269
  131   1HG1  ILE  18          1HG1      ILE  18   5.763  -2.381   1.673
  132   2HG1  ILE  18          2HG1      ILE  18   7.354  -2.961   1.191
  133   1HG2  ILE  18          1HG2      ILE  18   5.506  -2.058   4.067
  134   2HG2  ILE  18          2HG2      ILE  18   4.696  -3.581   3.701
  135   3HG2  ILE  18          3HG2      ILE  18   5.800  -3.477   5.072
  136   1HD1  ILE  18          1HD1      ILE  18   5.649  -5.194   1.647
  137   2HD1  ILE  18          2HD1      ILE  18   4.844  -4.054   0.569
  138   3HD1  ILE  18          3HD1      ILE  18   6.440  -4.682   0.158
  139    H    ILE  19           H        ILE  19   6.846  -1.512   5.376
  140    HA   ILE  19           HA       ILE  19   8.294  -2.924   7.523
  141    HB   ILE  19           HB       ILE  19   9.126  -1.087   8.463
  142   1HG1  ILE  19          1HG1      ILE  19   6.598   0.504   7.997
  143   2HG1  ILE  19          2HG1      ILE  19   6.861  -0.531   9.395
  144   1HG2  ILE  19          1HG2      ILE  19   9.123  -0.567   5.844
  145   2HG2  ILE  19          2HG2      ILE  19   8.216   0.832   6.415
  146   3HG2  ILE  19          3HG2      ILE  19   9.830   0.510   7.042
  147   1HD1  ILE  19          1HD1      ILE  19   8.848   0.844   9.955
  148   2HD1  ILE  19          2HD1      ILE  19   8.394   1.939   8.648
  149   3HD1  ILE  19          3HD1      ILE  19   7.314   1.712  10.024
  150    H    ALA  20           H        ALA  20   5.275  -1.957   6.292
  151    HA   ALA  20           HA       ALA  20   3.976  -3.130   8.623
  152   1HB   ALA  20          1HB       ALA  20   4.119  -0.565   8.794
  153   2HB   ALA  20          2HB       ALA  20   2.891  -0.563   7.528
  154   3HB   ALA  20          3HB       ALA  20   2.560  -1.342   9.075
  155    H    VAL  21           H        VAL  21   1.906  -3.975   8.211
  156    HA   VAL  21           HA       VAL  21   0.983  -3.912   5.432
  157    HB   VAL  21           HB       VAL  21   2.356  -5.945   5.672
  158   1HG1  VAL  21          1HG1      VAL  21   1.744  -6.148   8.167
  159   2HG1  VAL  21          2HG1      VAL  21   0.325  -7.025   7.591
  160   3HG1  VAL  21          3HG1      VAL  21   1.943  -7.626   7.225
  161   1HG2  VAL  21          1HG2      VAL  21  -0.203  -5.729   4.624
  162   2HG2  VAL  21          2HG2      VAL  21   0.981  -6.983   4.260
  163   3HG2  VAL  21          3HG2      VAL  21  -0.225  -7.249   5.518
  164    H    GLU  22           H        GLU  22  -1.157  -3.652   5.273
  165    HA   GLU  22           HA       GLU  22  -2.923  -4.622   7.366
  166   1HB   GLU  22          1HB       GLU  22  -3.126  -1.726   6.585
  167   2HB   GLU  22          2HB       GLU  22  -3.872  -2.547   7.948
  168   1HG   GLU  22          1HG       GLU  22  -1.635  -2.833   8.953
  169   2HG   GLU  22          2HG       GLU  22  -0.950  -1.909   7.616
  170    H    VAL  23           H        VAL  23  -2.690  -5.545   4.787
  171    HA   VAL  23           HA       VAL  23  -5.282  -4.746   3.666
  172    HB   VAL  23           HB       VAL  23  -4.256  -5.110   1.359
  173   1HG1  VAL  23          1HG1      VAL  23  -3.684  -2.752   3.117
  174   2HG1  VAL  23          2HG1      VAL  23  -3.186  -2.763   1.424
  175   3HG1  VAL  23          3HG1      VAL  23  -4.891  -2.925   1.843
  176   1HG2  VAL  23          1HG2      VAL  23  -2.171  -6.152   2.158
  177   2HG2  VAL  23          2HG2      VAL  23  -1.870  -4.748   1.135
  178   3HG2  VAL  23          3HG2      VAL  23  -1.701  -4.616   2.886
  179    H    ASN  24           H        ASN  24  -6.564  -6.445   3.398
  180    HA   ASN  24           HA       ASN  24  -5.374  -9.058   2.783
  181   1HB   ASN  24          1HB       ASN  24  -6.199  -8.524   5.288
  182   2HB   ASN  24          2HB       ASN  24  -7.722  -9.064   4.588
  183   1HD2  ASN  24          2HD2      ASN  24  -7.978 -11.025   5.437
  184   2HD2  ASN  24          1HD2      ASN  24  -6.845 -12.322   5.303
  185    H    VAL  25           H        VAL  25  -7.216  -6.783   1.567
  186    HA   VAL  25           HA       VAL  25  -8.811  -6.695  -0.047
  187    HB   VAL  25           HB       VAL  25  -8.437  -9.689  -0.101
  188   1HG1  VAL  25          1HG1      VAL  25 -10.598  -8.978  -1.058
  189   2HG1  VAL  25          2HG1      VAL  25  -9.733  -7.907  -2.161
  190   3HG1  VAL  25          3HG1      VAL  25  -9.510  -9.653  -2.272
  191   1HG2  VAL  25          1HG2      VAL  25  -6.473  -8.119  -0.626
  192   2HG2  VAL  25          2HG2      VAL  25  -6.857  -9.387  -1.789
  193   3HG2  VAL  25          3HG2      VAL  25  -7.364  -7.727  -2.096
  194    H    GLY  26           H        GLY  26 -10.819  -6.147   0.466
  195   1HA   GLY  26          1HA       GLY  26 -12.419  -8.050   2.065
  196   2HA   GLY  26          2HA       GLY  26 -13.099  -7.052   0.789
  197    H    ASP  27           H        ASP  27 -10.702  -5.692   2.880
  198    HA   ASP  27           HA       ASP  27 -12.485  -4.676   4.856
  199   1HB   ASP  27          1HB       ASP  27  -9.615  -4.355   4.181
  200   2HB   ASP  27          2HB       ASP  27 -10.357  -3.037   5.083
  201    H    THR  28           H        THR  28 -12.708  -2.297   5.268
  202    HA   THR  28           HA       THR  28 -13.453  -0.971   2.761
  203    HB   THR  28           HB       THR  28 -14.227  -0.134   5.554
  204    HG1  THR  28           HG1      THR  28 -15.401  -1.859   5.587
  205   1HG2  THR  28          1HG2      THR  28 -14.573   1.452   3.619
  206   2HG2  THR  28          2HG2      THR  28 -15.750   0.289   3.008
  207   3HG2  THR  28          3HG2      THR  28 -15.997   1.052   4.579
  208    H    ILE  29           H        ILE  29 -11.892   0.289   1.979
  209    HA   ILE  29           HA       ILE  29 -10.098   1.701   3.796
  210    HB   ILE  29           HB       ILE  29  -8.817   2.282   1.786
  211   1HG1  ILE  29          1HG1      ILE  29 -10.062   0.530  -0.104
  212   2HG1  ILE  29          2HG1      ILE  29 -11.263   1.674   0.480
  213   1HG2  ILE  29          1HG2      ILE  29  -8.628   0.049   3.035
  214   2HG2  ILE  29          2HG2      ILE  29  -9.429  -0.649   1.627
  215   3HG2  ILE  29          3HG2      ILE  29  -7.879   0.173   1.442
  216   1HD1  ILE  29          1HD1      ILE  29  -9.649   3.504  -0.072
  217   2HD1  ILE  29          2HD1      ILE  29  -8.645   2.287  -0.855
  218   3HD1  ILE  29          3HD1      ILE  29 -10.271   2.607  -1.456
  219    H    ALA  30           H        ALA  30 -10.015   3.884   4.027
  220    HA   ALA  30           HA       ALA  30 -12.162   5.419   2.731
  221   1HB   ALA  30          1HB       ALA  30 -12.603   6.057   4.818
  222   2HB   ALA  30          2HB       ALA  30 -11.108   6.993   4.762
  223   3HB   ALA  30          3HB       ALA  30 -11.102   5.357   5.422
  224    H    VAL  31           H        VAL  31 -11.363   7.954   2.924
  225    HA   VAL  31           HA       VAL  31  -9.145   8.066   1.043
  226    HB   VAL  31           HB       VAL  31  -9.811  10.552   0.996
  227   1HG1  VAL  31          1HG1      VAL  31 -11.480   8.289  -0.038
  228   2HG1  VAL  31          2HG1      VAL  31 -11.863   9.966  -0.429
  229   3HG1  VAL  31          3HG1      VAL  31 -10.305   9.286  -0.897
  230   1HG2  VAL  31          1HG2      VAL  31 -11.206  10.186   3.147
  231   2HG2  VAL  31          2HG2      VAL  31 -11.841  11.232   1.877
  232   3HG2  VAL  31          3HG2      VAL  31 -12.438   9.581   2.039
  233    H    ASP  32           H        ASP  32  -8.400   7.415   3.680
  234    HA   ASP  32           HA       ASP  32  -6.200   8.959   4.141
  235   1HB   ASP  32          1HB       ASP  32  -7.045  10.217   6.261
  236   2HB   ASP  32          2HB       ASP  32  -7.331  10.926   4.675
  237    H    ASP  33           H        ASP  33  -6.054   6.511   4.378
  238    HA   ASP  33           HA       ASP  33  -5.987   5.912   7.234
  239   1HB   ASP  33          1HB       ASP  33  -7.018   3.701   6.904
  240   2HB   ASP  33          2HB       ASP  33  -8.133   4.999   6.485
  241    H    THR  34           H        THR  34  -4.052   5.135   7.732
  242    HA   THR  34           HA       THR  34  -2.085   4.578   5.813
  243    HB   THR  34           HB       THR  34  -1.060   3.373   7.952
  244    HG1  THR  34           HG1      THR  34  -1.847   4.537   9.794
  245   1HG2  THR  34          1HG2      THR  34  -0.218   5.412   6.814
  246   2HG2  THR  34          2HG2      THR  34  -1.311   6.357   7.828
  247   3HG2  THR  34          3HG2      THR  34  -0.019   5.410   8.569
  248    H    LEU  35           H        LEU  35  -1.943   2.944   4.514
  249    HA   LEU  35           HA       LEU  35  -3.235   0.415   5.135
  250   1HB   LEU  35          1HB       LEU  35  -1.887   1.525   2.679
  251   2HB   LEU  35          2HB       LEU  35  -2.354  -0.162   2.794
  252    HG   LEU  35           HG       LEU  35  -4.325   2.086   3.156
  253   1HD1  LEU  35          1HD1      LEU  35  -3.142   2.088   0.906
  254   2HD1  LEU  35          2HD1      LEU  35  -3.929   0.536   0.616
  255   3HD1  LEU  35          3HD1      LEU  35  -4.902   1.982   0.883
  256   1HD2  LEU  35          1HD2      LEU  35  -4.604  -0.857   2.574
  257   2HD2  LEU  35          2HD2      LEU  35  -5.053  -0.021   4.060
  258   3HD2  LEU  35          3HD2      LEU  35  -5.935   0.298   2.566
  259    H    ILE  36           H        ILE  36  -0.026   1.740   4.485
  260    HA   ILE  36           HA       ILE  36   1.167  -0.348   6.098
  261    HB   ILE  36           HB       ILE  36   2.881  -0.940   4.373
  262   1HG1  ILE  36          1HG1      ILE  36   2.475  -0.599   2.047
  263   2HG1  ILE  36          2HG1      ILE  36   0.897   0.117   2.352
  264   1HG2  ILE  36          1HG2      ILE  36   0.575  -2.115   4.961
  265   2HG2  ILE  36          2HG2      ILE  36   0.310  -1.835   3.242
  266   3HG2  ILE  36          3HG2      ILE  36   1.708  -2.767   3.780
  267   1HD1  ILE  36          1HD1      ILE  36   3.511   1.356   3.182
  268   2HD1  ILE  36          2HD1      ILE  36   2.662   1.726   1.681
  269   3HD1  ILE  36          3HD1      ILE  36   1.910   2.096   3.233
  270    H    THR  37           H        THR  37   3.715  -0.058   5.833
  271    HA   THR  37           HA       THR  37   4.462   2.739   5.590
  272    HB   THR  37           HB       THR  37   4.793   1.131   8.132
  273    HG1  THR  37           HG1      THR  37   3.009   2.192   8.482
  274   1HG2  THR  37          1HG2      THR  37   6.864   2.397   7.550
  275   2HG2  THR  37          2HG2      THR  37   5.902   3.873   7.620
  276   3HG2  THR  37          3HG2      THR  37   6.095   2.878   9.063
  277    H    LEU  38           H        LEU  38   6.304   2.803   4.446
  278    HA   LEU  38           HA       LEU  38   7.987   0.385   4.453
  279   1HB   LEU  38          1HB       LEU  38   7.269   2.310   2.271
  280   2HB   LEU  38          2HB       LEU  38   8.687   1.281   2.146
  281    HG   LEU  38           HG       LEU  38   6.630  -0.460   2.854
  282   1HD1  LEU  38          1HD1      LEU  38   5.454   1.836   1.735
  283   2HD1  LEU  38          2HD1      LEU  38   5.414   0.585   0.492
  284   3HD1  LEU  38          3HD1      LEU  38   4.697   0.280   2.074
  285   1HD2  LEU  38          1HD2      LEU  38   7.947   0.189   0.231
  286   2HD2  LEU  38          2HD2      LEU  38   8.375  -1.081   1.377
  287   3HD2  LEU  38          3HD2      LEU  38   6.872  -1.188   0.463
  288    H    GLU  39           H        GLU  39  10.257   1.037   3.383
  289    HA   GLU  39           HA       GLU  39  11.363   3.548   4.042
  290   1HB   GLU  39          1HB       GLU  39  10.985   2.841   6.339
  291   2HB   GLU  39          2HB       GLU  39  11.841   1.335   6.043
  292   1HG   GLU  39          1HG       GLU  39  13.236   3.938   5.621
  293   2HG   GLU  39          2HG       GLU  39  13.028   3.302   7.251
  294    H    THR  40           H        THR  40  13.714   3.598   3.780
  295    HA   THR  40           HA       THR  40  14.681   1.322   2.180
  296    HB   THR  40           HB       THR  40  15.805   2.794   0.735
  297    HG1  THR  40           HG1      THR  40  15.232   5.001   2.397
  298   1HG2  THR  40          1HG2      THR  40  13.082   3.162   1.098
  299   2HG2  THR  40          2HG2      THR  40  13.751   4.792   1.000
  300   3HG2  THR  40          3HG2      THR  40  14.045   3.637  -0.301
  301    H    ASP  41           H        ASP  41  15.989   4.117   3.956
  302    HA   ASP  41           HA       ASP  41  17.707   2.363   5.501
  303   1HB   ASP  41          1HB       ASP  41  18.841   4.501   3.684
  304   2HB   ASP  41          2HB       ASP  41  19.760   3.624   4.904
  305    H    LYS  42           H        LYS  42  16.798   5.697   4.709
  306    HA   LYS  42           HA       LYS  42  16.703   6.282   7.573
  307   1HB   LYS  42          1HB       LYS  42  17.819   8.466   7.204
  308   2HB   LYS  42          2HB       LYS  42  18.879   7.094   6.913
  309   1HG   LYS  42          1HG       LYS  42  17.419   8.511   4.703
  310   2HG   LYS  42          2HG       LYS  42  19.021   8.996   5.262
  311   1HD   LYS  42          1HD       LYS  42  19.285   6.281   4.902
  312   2HD   LYS  42          2HD       LYS  42  18.224   6.755   3.575
  313   1HE   LYS  42          1HE       LYS  42  20.602   8.447   4.096
  314   2HE   LYS  42          2HE       LYS  42  20.883   6.852   3.399
  315   1HZ   LYS  42          1HZ       LYS  42  18.979   8.827   2.268
  316   2HZ   LYS  42          2HZ       LYS  42  20.582   8.669   1.749
  317   3HZ   LYS  42          3HZ       LYS  42  19.500   7.382   1.558
  318    H    ALA  43           H        ALA  43  14.747   5.846   5.363
  319    HA   ALA  43           HA       ALA  43  13.122   8.199   5.911
  320   1HB   ALA  43          1HB       ALA  43  14.063   7.418   3.187
  321   2HB   ALA  43          2HB       ALA  43  13.918   9.020   3.911
  322   3HB   ALA  43          3HB       ALA  43  12.473   8.155   3.387
  323    H    THR  44           H        THR  44  11.613   7.046   7.022
  324    HA   THR  44           HA       THR  44  10.488   4.640   5.814
  325    HB   THR  44           HB       THR  44   9.450   4.212   7.912
  326    HG1  THR  44           HG1      THR  44  10.145   6.870   8.610
  327   1HG2  THR  44          1HG2      THR  44  12.259   4.993   7.941
  328   2HG2  THR  44          2HG2      THR  44  11.486   5.019   9.525
  329   3HG2  THR  44          3HG2      THR  44  11.471   3.542   8.562
  330    H    MET  45           H        MET  45   8.833   4.826   4.477
  331    HA   MET  45           HA       MET  45   7.042   7.138   4.758
  332   1HB   MET  45          1HB       MET  45   8.327   6.030   2.523
  333   2HB   MET  45          2HB       MET  45   6.626   5.620   2.340
  334   1HG   MET  45          1HG       MET  45   7.078   7.700   1.233
  335   2HG   MET  45          2HG       MET  45   6.049   7.994   2.633
  336   1HE   MET  45          1HE       MET  45   6.680  10.494   2.041
  337   2HE   MET  45          2HE       MET  45   6.494  10.306   3.784
  338   3HE   MET  45          3HE       MET  45   7.834  11.253   3.138
  339    H    ASP  46           H        ASP  46   4.816   6.463   3.563
  340    HA   ASP  46           HA       ASP  46   3.789   3.886   4.172
  341   1HB   ASP  46          1HB       ASP  46   2.157   4.666   5.923
  342   2HB   ASP  46          2HB       ASP  46   3.832   4.603   6.465
  343    H    VAL  47           H        VAL  47   1.351   3.847   3.860
  344    HA   VAL  47           HA       VAL  47   0.560   5.980   1.986
  345    HB   VAL  47           HB       VAL  47  -0.063   3.033   1.765
  346   1HG1  VAL  47          1HG1      VAL  47  -1.599   5.205   0.877
  347   2HG1  VAL  47          2HG1      VAL  47  -0.755   4.599  -0.549
  348   3HG1  VAL  47          3HG1      VAL  47  -1.761   3.513   0.409
  349   1HG2  VAL  47          1HG2      VAL  47   2.245   4.092   1.080
  350   2HG2  VAL  47          2HG2      VAL  47   1.453   2.897   0.053
  351   3HG2  VAL  47          3HG2      VAL  47   1.333   4.613  -0.338
  352    HA   PRO  48           HA       PRO  48  -2.919   6.018   4.852
  353   1HB   PRO  48          1HB       PRO  48  -3.606   8.562   4.507
  354   2HB   PRO  48          2HB       PRO  48  -2.110   8.141   5.349
  355   1HG   PRO  48          1HG       PRO  48  -2.501   9.162   2.580
  356   2HG   PRO  48          2HG       PRO  48  -1.180   9.473   3.718
  357   1HD   PRO  48          1HD       PRO  48  -1.180   7.606   1.599
  358   2HD   PRO  48          2HD       PRO  48   0.022   7.736   2.897
  359    H    ALA  49           H        ALA  49  -3.146   4.976   2.100
  360    HA   ALA  49           HA       ALA  49  -4.753   4.479   0.564
  361   1HB   ALA  49          1HB       ALA  49  -7.124   4.780   1.278
  362   2HB   ALA  49          2HB       ALA  49  -6.127   3.906   2.441
  363   3HB   ALA  49          3HB       ALA  49  -6.533   5.600   2.724
  364    H    GLU  50           H        GLU  50  -6.694   5.544  -0.704
  365    HA   GLU  50           HA       GLU  50  -6.692   8.399  -0.829
  366   1HB   GLU  50          1HB       GLU  50  -4.535   7.510  -2.030
  367   2HB   GLU  50          2HB       GLU  50  -5.658   7.135  -3.330
  368   1HG   GLU  50          1HG       GLU  50  -6.318   9.445  -3.488
  369   2HG   GLU  50          2HG       GLU  50  -5.317   9.858  -2.097
  370    H    VAL  51           H        VAL  51  -8.735   6.594  -0.471
  371    HA   VAL  51           HA       VAL  51 -10.651   7.466  -2.268
  372    HB   VAL  51           HB       VAL  51 -11.006   4.979  -3.250
  373   1HG1  VAL  51          1HG1      VAL  51 -10.169   7.529  -4.213
  374   2HG1  VAL  51          2HG1      VAL  51  -9.312   6.271  -5.102
  375   3HG1  VAL  51          3HG1      VAL  51 -11.075   6.272  -5.053
  376   1HG2  VAL  51          1HG2      VAL  51  -8.702   4.421  -2.210
  377   2HG2  VAL  51          2HG2      VAL  51  -9.038   3.900  -3.862
  378   3HG2  VAL  51          3HG2      VAL  51  -8.046   5.330  -3.571
  379    H    ALA  52           H        ALA  52 -12.730   6.184  -2.111
  380    HA   ALA  52           HA       ALA  52 -12.890   4.929   0.555
  381   1HB   ALA  52          1HB       ALA  52 -14.914   6.613  -0.894
  382   2HB   ALA  52          2HB       ALA  52 -15.196   5.791   0.642
  383   3HB   ALA  52          3HB       ALA  52 -13.983   7.069   0.535
  384    H    GLY  53           H        GLY  53 -12.674   2.793  -0.215
  385   1HA   GLY  53          1HA       GLY  53 -13.898   1.573  -2.325
  386   2HA   GLY  53          2HA       GLY  53 -15.156   1.656  -1.109
  387    H    VAL  54           H        VAL  54 -14.064  -0.720  -2.209
  388    HA   VAL  54           HA       VAL  54 -12.871  -1.909   0.212
  389    HB   VAL  54           HB       VAL  54 -14.631  -3.204  -1.876
  390   1HG1  VAL  54          1HG1      VAL  54 -13.207  -4.286   0.535
  391   2HG1  VAL  54          2HG1      VAL  54 -14.670  -5.053  -0.084
  392   3HG1  VAL  54          3HG1      VAL  54 -13.242  -4.919  -1.111
  393   1HG2  VAL  54          1HG2      VAL  54 -15.654  -1.549  -0.201
  394   2HG2  VAL  54          2HG2      VAL  54 -16.391  -3.146  -0.340
  395   3HG2  VAL  54          3HG2      VAL  54 -15.322  -2.783   1.015
  396    H    VAL  55           H        VAL  55 -11.185  -3.408  -0.011
  397    HA   VAL  55           HA       VAL  55  -9.603  -3.096  -2.401
  398    HB   VAL  55           HB       VAL  55  -9.043  -4.772   0.045
  399   1HG1  VAL  55          1HG1      VAL  55  -7.868  -5.489  -2.057
  400   2HG1  VAL  55          2HG1      VAL  55  -7.125  -3.888  -2.112
  401   3HG1  VAL  55          3HG1      VAL  55  -6.792  -4.966  -0.757
  402   1HG2  VAL  55          1HG2      VAL  55  -9.231  -2.205   0.243
  403   2HG2  VAL  55          2HG2      VAL  55  -7.805  -3.001   0.908
  404   3HG2  VAL  55          3HG2      VAL  55  -7.710  -2.180  -0.650
  405    H    LYS  56           H        LYS  56  -9.000  -4.647  -3.835
  406    HA   LYS  56           HA       LYS  56 -10.613  -7.113  -3.837
  407   1HB   LYS  56          1HB       LYS  56  -9.327  -6.416  -6.367
  408   2HB   LYS  56          2HB       LYS  56 -10.989  -6.888  -6.049
  409   1HG   LYS  56          1HG       LYS  56 -10.126  -4.136  -5.318
  410   2HG   LYS  56          2HG       LYS  56 -10.398  -4.529  -7.014
  411   1HD   LYS  56          1HD       LYS  56 -12.419  -3.617  -5.971
  412   2HD   LYS  56          2HD       LYS  56 -12.655  -5.283  -6.501
  413   1HE   LYS  56          1HE       LYS  56 -12.200  -6.030  -4.178
  414   2HE   LYS  56          2HE       LYS  56 -12.124  -4.338  -3.689
  415   1HZ   LYS  56          1HZ       LYS  56 -14.499  -5.479  -5.033
  416   2HZ   LYS  56          2HZ       LYS  56 -14.311  -5.521  -3.353
  417   3HZ   LYS  56          3HZ       LYS  56 -14.384  -4.036  -4.159
  418    H    GLU  57           H        GLU  57  -7.530  -5.716  -4.858
  419    HA   GLU  57           HA       GLU  57  -6.351  -8.361  -4.638
  420   1HB   GLU  57          1HB       GLU  57  -5.745  -5.994  -6.322
  421   2HB   GLU  57          2HB       GLU  57  -4.399  -7.025  -5.856
  422   1HG   GLU  57          1HG       GLU  57  -6.165  -8.879  -6.697
  423   2HG   GLU  57          2HG       GLU  57  -6.606  -7.520  -7.729
  424    H    VAL  58           H        VAL  58  -3.917  -8.250  -4.066
  425    HA   VAL  58           HA       VAL  58  -3.064  -6.212  -2.252
  426    HB   VAL  58           HB       VAL  58  -4.629  -7.329  -0.753
  427   1HG1  VAL  58          1HG1      VAL  58  -3.674  -9.671  -2.061
  428   2HG1  VAL  58          2HG1      VAL  58  -3.386  -9.833  -0.328
  429   3HG1  VAL  58          3HG1      VAL  58  -5.014  -9.507  -0.924
  430   1HG2  VAL  58          1HG2      VAL  58  -2.171  -6.608  -0.109
  431   2HG2  VAL  58          2HG2      VAL  58  -3.229  -7.401   1.058
  432   3HG2  VAL  58          3HG2      VAL  58  -1.999  -8.335   0.206
  433    H    LYS  59           H        LYS  59  -0.926  -6.161  -2.362
  434    HA   LYS  59           HA       LYS  59   0.599  -8.628  -2.585
  435   1HB   LYS  59          1HB       LYS  59   0.783  -6.398  -4.614
  436   2HB   LYS  59          2HB       LYS  59   1.891  -7.761  -4.512
  437   1HG   LYS  59          1HG       LYS  59   0.520  -8.630  -6.070
  438   2HG   LYS  59          2HG       LYS  59  -0.442  -9.083  -4.661
  439   1HD   LYS  59          1HD       LYS  59  -1.984  -8.079  -6.100
  440   2HD   LYS  59          2HD       LYS  59  -1.582  -6.805  -4.948
  441   1HE   LYS  59          1HE       LYS  59  -1.497  -5.726  -7.009
  442   2HE   LYS  59          2HE       LYS  59   0.192  -6.098  -6.668
  443   1HZ   LYS  59          1HZ       LYS  59  -0.372  -8.244  -8.008
  444   2HZ   LYS  59          2HZ       LYS  59  -1.610  -7.290  -8.654
  445   3HZ   LYS  59          3HZ       LYS  59   0.004  -6.808  -8.817
  446    H    VAL  60           H        VAL  60   0.999  -7.814  -0.388
  447    HA   VAL  60           HA       VAL  60   3.517  -6.542  -0.228
  448    HB   VAL  60           HB       VAL  60   2.652  -4.429  -0.479
  449   1HG1  VAL  60          1HG1      VAL  60   0.144  -5.383   0.884
  450   2HG1  VAL  60          2HG1      VAL  60   0.430  -3.708   0.410
  451   3HG1  VAL  60          3HG1      VAL  60   0.360  -4.974  -0.819
  452   1HG2  VAL  60          1HG2      VAL  60   3.610  -4.838   1.916
  453   2HG2  VAL  60          2HG2      VAL  60   2.837  -3.302   1.522
  454   3HG2  VAL  60          3HG2      VAL  60   1.949  -4.531   2.422
  455    H    LYS  61           H        LYS  61   4.400  -6.629   1.850
  456    HA   LYS  61           HA       LYS  61   2.862  -7.536   4.100
  457   1HB   LYS  61          1HB       LYS  61   3.561  -9.539   2.439
  458   2HB   LYS  61          2HB       LYS  61   5.015  -9.457   3.425
  459   1HG   LYS  61          1HG       LYS  61   3.897 -10.881   4.742
  460   2HG   LYS  61          2HG       LYS  61   3.121  -9.415   5.345
  461   1HD   LYS  61          1HD       LYS  61   1.813 -10.360   2.955
  462   2HD   LYS  61          2HD       LYS  61   1.882 -11.632   4.177
  463   1HE   LYS  61          1HE       LYS  61   1.172  -9.415   5.637
  464   2HE   LYS  61          2HE       LYS  61   0.316  -9.170   4.115
  465   1HZ   LYS  61          1HZ       LYS  61  -0.610 -11.416   4.356
  466   2HZ   LYS  61          2HZ       LYS  61   0.154 -11.570   5.857
  467   3HZ   LYS  61          3HZ       LYS  61  -1.053 -10.404   5.637
  468    H    VAL  62           H        VAL  62   4.949  -8.672   5.576
  469    HA   VAL  62           HA       VAL  62   6.670  -6.320   5.941
  470    HB   VAL  62           HB       VAL  62   5.995  -8.526   7.892
  471   1HG1  VAL  62          1HG1      VAL  62   8.076  -6.520   7.881
  472   2HG1  VAL  62          2HG1      VAL  62   7.006  -6.333   9.270
  473   3HG1  VAL  62          3HG1      VAL  62   7.821  -7.871   8.985
  474   1HG2  VAL  62          1HG2      VAL  62   4.148  -6.929   7.295
  475   2HG2  VAL  62          2HG2      VAL  62   4.590  -6.962   9.002
  476   3HG2  VAL  62          3HG2      VAL  62   5.142  -5.639   7.974
  477    H    GLY  63           H        GLY  63   8.332  -6.775   4.521
  478   1HA   GLY  63          1HA       GLY  63   9.880  -9.222   5.114
  479   2HA   GLY  63          2HA       GLY  63  10.645  -7.660   4.858
  480    H    ASP  64           H        ASP  64   8.890  -6.897   2.667
  481    HA   ASP  64           HA       ASP  64  10.023  -8.656   0.600
  482   1HB   ASP  64          1HB       ASP  64   7.944  -8.170  -0.755
  483   2HB   ASP  64          2HB       ASP  64   7.707  -9.214   0.643
  484    H    LYS  65           H        LYS  65  10.855  -7.674  -1.190
  485    HA   LYS  65           HA       LYS  65  11.555  -4.915  -0.968
  486   1HB   LYS  65          1HB       LYS  65  12.126  -7.126  -2.882
  487   2HB   LYS  65          2HB       LYS  65  12.366  -5.477  -3.443
  488   1HG   LYS  65          1HG       LYS  65  13.569  -5.665  -0.899
  489   2HG   LYS  65          2HG       LYS  65  14.064  -7.085  -1.821
  490   1HD   LYS  65          1HD       LYS  65  14.410  -5.252  -3.715
  491   2HD   LYS  65          2HD       LYS  65  14.619  -4.209  -2.307
  492   1HE   LYS  65          1HE       LYS  65  16.538  -5.260  -1.642
  493   2HE   LYS  65          2HE       LYS  65  16.067  -6.803  -2.354
  494   1HZ   LYS  65          1HZ       LYS  65  16.364  -5.527  -4.567
  495   2HZ   LYS  65          2HZ       LYS  65  17.306  -4.468  -3.644
  496   3HZ   LYS  65          3HZ       LYS  65  17.731  -6.102  -3.753
  497    H    ILE  66           H        ILE  66  10.600  -3.176  -1.836
  498    HA   ILE  66           HA       ILE  66   8.573  -3.593  -3.912
  499    HB   ILE  66           HB       ILE  66   7.948  -3.000  -1.298
  500   1HG1  ILE  66          1HG1      ILE  66   5.692  -2.629  -2.155
  501   2HG1  ILE  66          2HG1      ILE  66   6.342  -2.366  -3.772
  502   1HG2  ILE  66          1HG2      ILE  66   7.899  -0.411  -2.829
  503   2HG2  ILE  66          2HG2      ILE  66   6.930  -0.715  -1.395
  504   3HG2  ILE  66          3HG2      ILE  66   8.688  -0.749  -1.292
  505   1HD1  ILE  66          1HD1      ILE  66   7.373  -4.817  -2.922
  506   2HD1  ILE  66          2HD1      ILE  66   5.669  -4.816  -2.464
  507   3HD1  ILE  66          3HD1      ILE  66   6.130  -4.530  -4.143
  508    H    SER  67           H        SER  67   7.894  -1.418  -4.898
  509    HA   SER  67           HA       SER  67  10.035   0.553  -4.964
  510   1HB   SER  67          1HB       SER  67   9.078  -0.737  -7.524
  511   2HB   SER  67          2HB       SER  67  10.388   0.426  -7.333
  512    HG   SER  67           HG       SER  67  10.315  -2.303  -6.717
  513    H    GLU  68           H        GLU  68   9.302   2.581  -5.335
  514    HA   GLU  68           HA       GLU  68   6.746   3.389  -4.980
  515   1HB   GLU  68          1HB       GLU  68   8.570   4.786  -6.931
  516   2HB   GLU  68          2HB       GLU  68   7.334   5.506  -5.910
  517   1HG   GLU  68          1HG       GLU  68   9.020   6.015  -4.550
  518   2HG   GLU  68          2HG       GLU  68   8.954   4.320  -4.069
  519    H    GLY  69           H        GLY  69   5.181   2.150  -5.992
  520   1HA   GLY  69          1HA       GLY  69   4.890   2.662  -8.880
  521   2HA   GLY  69          2HA       GLY  69   3.560   2.374  -7.772
  522    H    GLY  70           H        GLY  70   3.868   0.138  -6.557
  523   1HA   GLY  70          1HA       GLY  70   4.809  -2.126  -6.918
  524   2HA   GLY  70          2HA       GLY  70   4.583  -1.842  -8.636
  525    H    LEU  71           H        LEU  71   1.962  -0.474  -7.969
  526    HA   LEU  71           HA       LEU  71  -0.239  -0.990  -7.642
  527   1HB   LEU  71          1HB       LEU  71   0.093  -1.942  -9.832
  528   2HB   LEU  71          2HB       LEU  71   0.737  -3.418  -9.141
  529    HG   LEU  71           HG       LEU  71  -1.363  -4.187  -8.484
  530   1HD1  LEU  71          1HD1      LEU  71  -2.029  -1.325  -8.324
  531   2HD1  LEU  71          2HD1      LEU  71  -3.339  -2.383  -8.848
  532   3HD1  LEU  71          3HD1      LEU  71  -2.536  -2.672  -7.304
  533   1HD2  LEU  71          1HD2      LEU  71  -1.043  -4.077 -10.958
  534   2HD2  LEU  71          2HD2      LEU  71  -2.728  -4.118 -10.437
  535   3HD2  LEU  71          3HD2      LEU  71  -2.003  -2.598 -10.959
  536    H    ILE  72           H        ILE  72   0.771  -1.282  -5.297
  537    HA   ILE  72           HA       ILE  72   0.989  -3.708  -4.045
  538    HB   ILE  72           HB       ILE  72   0.188  -0.986  -3.149
  539   1HG1  ILE  72          1HG1      ILE  72   2.190  -2.664  -1.751
  540   2HG1  ILE  72          2HG1      ILE  72   2.545  -2.239  -3.423
  541   1HG2  ILE  72          1HG2      ILE  72  -0.501  -3.457  -1.665
  542   2HG2  ILE  72          2HG2      ILE  72   0.259  -2.160  -0.740
  543   3HG2  ILE  72          3HG2      ILE  72  -1.243  -1.858  -1.614
  544   1HD1  ILE  72          1HD1      ILE  72   1.641   0.047  -1.916
  545   2HD1  ILE  72          2HD1      ILE  72   3.049  -0.716  -1.177
  546   3HD1  ILE  72          3HD1      ILE  72   3.115  -0.179  -2.855
  547    H    VAL  73           H        VAL  73  -1.964  -1.818  -3.472
  548    HA   VAL  73           HA       VAL  73  -3.528  -4.279  -3.901
  549    HB   VAL  73           HB       VAL  73  -4.997  -3.671  -2.069
  550   1HG1  VAL  73          1HG1      VAL  73  -2.231  -4.348  -1.767
  551   2HG1  VAL  73          2HG1      VAL  73  -2.766  -3.403  -0.377
  552   3HG1  VAL  73          3HG1      VAL  73  -3.619  -4.882  -0.820
  553   1HG2  VAL  73          1HG2      VAL  73  -3.206  -1.262  -1.794
  554   2HG2  VAL  73          2HG2      VAL  73  -4.936  -1.287  -2.137
  555   3HG2  VAL  73          3HG2      VAL  73  -4.345  -1.783  -0.552
  556    H    VAL  74           H        VAL  74  -5.759  -3.962  -4.493
  557    HA   VAL  74           HA       VAL  74  -6.244  -1.384  -5.854
  558    HB   VAL  74           HB       VAL  74  -7.194  -4.135  -6.691
  559   1HG1  VAL  74          1HG1      VAL  74  -8.423  -1.725  -7.173
  560   2HG1  VAL  74          2HG1      VAL  74  -7.435  -1.961  -8.614
  561   3HG1  VAL  74          3HG1      VAL  74  -8.608  -3.189  -8.138
  562   1HG2  VAL  74          1HG2      VAL  74  -4.807  -3.792  -7.103
  563   2HG2  VAL  74          2HG2      VAL  74  -5.718  -3.851  -8.613
  564   3HG2  VAL  74          3HG2      VAL  74  -5.170  -2.302  -7.975
  565    H    VAL  75           H        VAL  75  -8.084  -0.326  -5.313
  566    HA   VAL  75           HA       VAL  75 -10.025  -1.782  -3.664
  567    HB   VAL  75           HB       VAL  75 -10.547   0.422  -2.624
  568   1HG1  VAL  75          1HG1      VAL  75  -7.953  -0.999  -2.332
  569   2HG1  VAL  75          2HG1      VAL  75  -8.209   0.483  -1.414
  570   3HG1  VAL  75          3HG1      VAL  75  -9.306  -0.881  -1.209
  571   1HG2  VAL  75          1HG2      VAL  75  -8.121   1.255  -4.192
  572   2HG2  VAL  75          2HG2      VAL  75  -9.737   1.959  -4.238
  573   3HG2  VAL  75          3HG2      VAL  75  -8.732   2.151  -2.802
  574    H    GLU  76           H        GLU  76 -12.211  -0.813  -3.620
  575    HA   GLU  76           HA       GLU  76 -13.221  -0.605  -6.274
  576   1HB   GLU  76          1HB       GLU  76 -14.293  -1.532  -4.014
  577   2HB   GLU  76          2HB       GLU  76 -14.908   0.115  -3.925
  578   1HG   GLU  76          1HG       GLU  76 -16.614  -0.966  -5.010
  579   2HG   GLU  76          2HG       GLU  76 -15.689  -0.314  -6.361
  580    H    ALA  77           H        ALA  77 -12.703   1.675  -3.636
  581    HA   ALA  77           HA       ALA  77 -12.750   3.930  -3.513
  582   1HB   ALA  77          1HB       ALA  77 -11.066   4.159  -5.009
  583   2HB   ALA  77          2HB       ALA  77 -11.959   3.376  -6.310
  584   3HB   ALA  77          3HB       ALA  77 -12.336   5.039  -5.861
  585    H    GLU  78           H        GLU  78 -14.442   5.159  -3.116
  586    HA   GLU  78           HA       GLU  78 -16.606   5.898  -3.132
  587   1HB   GLU  78          1HB       GLU  78 -17.213   7.064  -5.253
  588   2HB   GLU  78          2HB       GLU  78 -15.624   7.486  -4.629
  589   1HG   GLU  78          1HG       GLU  78 -14.542   6.119  -6.261
  590   2HG   GLU  78          2HG       GLU  78 -16.085   5.453  -6.797
  591    H    GLY  79           H        GLY  79 -16.867   3.306  -3.023
  592   1HA   GLY  79          1HA       GLY  79 -18.296   1.565  -3.452
  593   2HA   GLY  79          2HA       GLY  79 -18.044   1.933  -5.152
  594    H    THR  80           H        THR  80 -19.634   3.721  -2.513
  595    HA   THR  80           HA       THR  80 -21.948   4.096  -4.273
  596    HB   THR  80           HB       THR  80 -22.509   2.197  -2.848
  597    HG1  THR  80           HG1      THR  80 -24.426   2.981  -2.173
  598   1HG2  THR  80          1HG2      THR  80 -21.821   4.035  -0.577
  599   2HG2  THR  80          2HG2      THR  80 -22.822   2.594  -0.393
  600   3HG2  THR  80          3HG2      THR  80 -21.150   2.443  -0.934
  601    H    ALA  81           H        ALA  81 -23.500   5.735  -3.295
  602    HA   ALA  81           HA       ALA  81 -21.934   7.873  -2.005
  603   1HB   ALA  81          1HB       ALA  81 -24.376   8.604  -3.492
  604   2HB   ALA  81          2HB       ALA  81 -22.811   9.413  -3.405
  605   3HB   ALA  81          3HB       ALA  81 -23.023   8.013  -4.457

  No H/Q in entry =         605
  Start of MODEL    5
    1    H1   ALA   1           H1       ALA   1 -13.753   4.349  -9.816
    2    H2   ALA   1           H2       ALA   1 -14.301   3.700 -11.304
    3    H3   ALA   1           H3       ALA   1 -15.254   4.861 -10.473
    4    HA   ALA   1           HA       ALA   1 -15.957   3.424  -8.933
    5   1HB   ALA   1          1HB       ALA   1 -16.343   2.723 -11.481
    6   2HB   ALA   1          2HB       ALA   1 -17.000   1.806 -10.125
    7   3HB   ALA   1          3HB       ALA   1 -15.515   1.272 -10.913
    8    H    LEU   2           H        LEU   2 -12.839   2.566 -10.201
    9    HA   LEU   2           HA       LEU   2 -12.305   1.053  -7.748
   10   1HB   LEU   2          1HB       LEU   2 -11.654   0.142 -10.549
   11   2HB   LEU   2          2HB       LEU   2 -10.958  -0.573  -9.107
   12    HG   LEU   2           HG       LEU   2 -13.860  -0.504  -8.981
   13   1HD1  LEU   2          1HD1      LEU   2 -12.635  -1.308 -11.489
   14   2HD1  LEU   2          2HD1      LEU   2 -13.576  -2.600 -10.744
   15   3HD1  LEU   2          3HD1      LEU   2 -14.333  -1.045 -11.089
   16   1HD2  LEU   2          1HD2      LEU   2 -11.817  -2.720  -8.869
   17   2HD2  LEU   2          2HD2      LEU   2 -12.468  -1.827  -7.494
   18   3HD2  LEU   2          3HD2      LEU   2 -13.522  -2.875  -8.444
   19    H    VAL   3           H        VAL   3  -9.814   0.508  -7.746
   20    HA   VAL   3           HA       VAL   3  -8.125   2.476  -8.979
   21    HB   VAL   3           HB       VAL   3  -8.916   2.748  -6.096
   22   1HG1  VAL   3          1HG1      VAL   3  -6.333   3.764  -7.285
   23   2HG1  VAL   3          2HG1      VAL   3  -6.972   4.205  -5.703
   24   3HG1  VAL   3          3HG1      VAL   3  -6.493   2.536  -6.026
   25   1HG2  VAL   3          1HG2      VAL   3  -8.948   4.407  -8.530
   26   2HG2  VAL   3          2HG2      VAL   3 -10.071   4.356  -7.172
   27   3HG2  VAL   3          3HG2      VAL   3  -8.552   5.240  -7.026
   28    H    GLU   4           H        GLU   4  -5.869   2.204  -8.402
   29    HA   GLU   4           HA       GLU   4  -5.252  -0.393  -7.165
   30   1HB   GLU   4          1HB       GLU   4  -3.632   0.622  -9.470
   31   2HB   GLU   4          2HB       GLU   4  -3.832  -1.025  -8.893
   32   1HG   GLU   4          1HG       GLU   4  -5.181  -1.266 -10.648
   33   2HG   GLU   4          2HG       GLU   4  -6.366  -0.411  -9.661
   34    H    LEU   5           H        LEU   5  -4.461   0.426  -5.249
   35    HA   LEU   5           HA       LEU   5  -2.908   2.737  -4.985
   36   1HB   LEU   5          1HB       LEU   5  -3.817   0.625  -3.287
   37   2HB   LEU   5          2HB       LEU   5  -2.113   0.908  -2.968
   38    HG   LEU   5           HG       LEU   5  -4.264   3.028  -2.894
   39   1HD1  LEU   5          1HD1      LEU   5  -3.172   1.196  -0.858
   40   2HD1  LEU   5          2HD1      LEU   5  -3.343   2.886  -0.382
   41   3HD1  LEU   5          3HD1      LEU   5  -4.746   1.984  -0.955
   42   1HD2  LEU   5          1HD2      LEU   5  -1.309   3.076  -2.350
   43   2HD2  LEU   5          2HD2      LEU   5  -2.233   4.073  -3.474
   44   3HD2  LEU   5          3HD2      LEU   5  -2.414   4.307  -1.734
   45    H    LYS   6           H        LYS   6  -0.609   2.795  -4.231
   46    HA   LYS   6           HA       LYS   6   1.055   0.699  -5.393
   47   1HB   LYS   6          1HB       LYS   6   1.384   3.614  -6.110
   48   2HB   LYS   6          2HB       LYS   6   2.393   2.285  -6.662
   49   1HG   LYS   6          1HG       LYS   6  -0.045   1.427  -7.459
   50   2HG   LYS   6          2HG       LYS   6  -0.241   3.175  -7.602
   51   1HD   LYS   6          1HD       LYS   6   1.668   3.327  -9.052
   52   2HD   LYS   6          2HD       LYS   6   2.057   1.627  -8.789
   53   1HE   LYS   6          1HE       LYS   6  -0.473   1.397  -9.676
   54   2HE   LYS   6          2HE       LYS   6   0.018   2.861 -10.526
   55   1HZ   LYS   6          1HZ       LYS   6   1.954   1.634 -11.369
   56   2HZ   LYS   6          2HZ       LYS   6   1.389   0.228 -10.619
   57   3HZ   LYS   6          3HZ       LYS   6   0.493   0.939 -11.865
   58    H    VAL   7           H        VAL   7   3.433   1.236  -4.999
   59    HA   VAL   7           HA       VAL   7   3.815   1.549  -2.191
   60    HB   VAL   7           HB       VAL   7   5.918   1.433  -4.354
   61   1HG1  VAL   7          1HG1      VAL   7   6.729   2.117  -2.139
   62   2HG1  VAL   7          2HG1      VAL   7   6.048   0.642  -1.453
   63   3HG1  VAL   7          3HG1      VAL   7   7.361   0.543  -2.626
   64   1HG2  VAL   7          1HG2      VAL   7   4.074  -0.427  -4.209
   65   2HG2  VAL   7          2HG2      VAL   7   5.769  -0.849  -4.445
   66   3HG2  VAL   7          3HG2      VAL   7   5.046  -0.976  -2.843
   67    HA   PRO   8           HA       PRO   8   4.419   5.929  -1.998
   68   1HB   PRO   8          1HB       PRO   8   6.112   6.027   0.165
   69   2HB   PRO   8          2HB       PRO   8   4.354   5.886   0.273
   70   1HG   PRO   8          1HG       PRO   8   6.445   3.770   0.522
   71   2HG   PRO   8          2HG       PRO   8   4.921   3.955   1.409
   72   1HD   PRO   8          1HD       PRO   8   5.227   2.181  -0.605
   73   2HD   PRO   8          2HD       PRO   8   3.680   2.978  -0.270
   74    H    ASP   9           H        ASP   9   6.535   7.342  -1.212
   75    HA   ASP   9           HA       ASP   9   8.465   6.848  -3.338
   76   1HB   ASP   9          1HB       ASP   9   7.507   9.063  -3.245
   77   2HB   ASP   9          2HB       ASP   9   7.960   9.231  -1.552
   78    H    ILE  10           H        ILE  10   8.188   6.373   0.005
   79    HA   ILE  10           HA       ILE  10   9.695   6.173   1.736
   80    HB   ILE  10           HB       ILE  10  11.475   4.363   0.990
   81   1HG1  ILE  10          1HG1      ILE  10  10.363   2.974  -0.851
   82   2HG1  ILE  10          2HG1      ILE  10   9.461   4.430  -1.257
   83   1HG2  ILE  10          1HG2      ILE  10   9.261   4.258   2.385
   84   2HG2  ILE  10          2HG2      ILE  10   8.641   3.435   0.951
   85   3HG2  ILE  10          3HG2      ILE  10  10.035   2.781   1.815
   86   1HD1  ILE  10          1HD1      ILE  10  11.969   5.399  -1.218
   87   2HD1  ILE  10          2HD1      ILE  10  12.267   3.743  -1.747
   88   3HD1  ILE  10          3HD1      ILE  10  11.165   4.777  -2.658
   89    H    GLY  11           H        GLY  11  10.382   8.469   0.157
   90   1HA   GLY  11          1HA       GLY  11  12.697   9.343   1.225
   91   2HA   GLY  11          2HA       GLY  11  12.161   9.857  -0.366
   92    H    GLY  12           H        GLY  12  12.476   7.240  -1.591
   93   1HA   GLY  12          1HA       GLY  12  14.539   5.729  -1.615
   94   2HA   GLY  12          2HA       GLY  12  15.419   7.244  -1.761
   95    H    HIS  13           H        HIS  13  14.167   4.697  -3.449
   96    HA   HIS  13           HA       HIS  13  13.392   6.107  -5.836
   97   1HB   HIS  13          1HB       HIS  13  15.340   4.707  -7.046
   98   2HB   HIS  13          2HB       HIS  13  15.546   6.371  -6.516
   99    HD1  HIS  13           HD1      HIS  13  18.109   5.956  -6.284
  100    HD2  HIS  13           HD2      HIS  13  15.754   3.625  -3.777
  101    HE1  HIS  13           HE1      HIS  13  19.689   4.991  -4.582
  102    HE2  HIS  13           HE2      HIS  13  18.232   3.633  -3.038
  103    H    GLU  14           H        GLU  14  15.050   3.001  -5.733
  104    HA   GLU  14           HA       GLU  14  12.467   1.638  -6.024
  105   1HB   GLU  14          1HB       GLU  14  14.877   0.909  -7.677
  106   2HB   GLU  14          2HB       GLU  14  13.222   0.348  -7.871
  107   1HG   GLU  14          1HG       GLU  14  12.517   2.357  -8.801
  108   2HG   GLU  14          2HG       GLU  14  13.908   3.243  -8.177
  109    H    ASN  15           H        ASN  15  12.945  -0.861  -6.041
  110    HA   ASN  15           HA       ASN  15  13.342  -2.601  -4.613
  111   1HB   ASN  15          1HB       ASN  15  15.714  -3.169  -4.392
  112   2HB   ASN  15          2HB       ASN  15  15.347  -2.620  -6.024
  113   1HD2  ASN  15          2HD2      ASN  15  17.214  -2.128  -3.229
  114   2HD2  ASN  15          1HD2      ASN  15  18.058  -0.714  -3.754
  115    H    VAL  16           H        VAL  16  12.305  -2.124  -2.717
  116    HA   VAL  16           HA       VAL  16  14.026  -1.473  -0.477
  117    HB   VAL  16           HB       VAL  16  12.615   0.282   0.435
  118   1HG1  VAL  16          1HG1      VAL  16  13.537   0.851  -2.378
  119   2HG1  VAL  16          2HG1      VAL  16  13.128   2.080  -1.184
  120   3HG1  VAL  16          3HG1      VAL  16  14.489   0.996  -0.900
  121   1HG2  VAL  16          1HG2      VAL  16  10.564  -0.604  -0.910
  122   2HG2  VAL  16          2HG2      VAL  16  10.690   1.109  -0.527
  123   3HG2  VAL  16          3HG2      VAL  16  11.116   0.535  -2.137
  124    H    ASP  17           H        ASP  17  13.339  -2.383   1.422
  125    HA   ASP  17           HA       ASP  17  11.252  -4.358   1.185
  126   1HB   ASP  17          1HB       ASP  17  13.149  -3.651   3.426
  127   2HB   ASP  17          2HB       ASP  17  11.954  -4.941   3.536
  128    H    ILE  18           H        ILE  18   9.229  -4.245   1.935
  129    HA   ILE  18           HA       ILE  18   8.123  -1.825   2.846
  130    HB   ILE  18           HB       ILE  18   7.070  -4.655   2.856
  131   1HG1  ILE  18          1HG1      ILE  18   5.972  -2.400   1.244
  132   2HG1  ILE  18          2HG1      ILE  18   7.496  -3.128   0.746
  133   1HG2  ILE  18          1HG2      ILE  18   5.625  -2.128   3.634
  134   2HG2  ILE  18          2HG2      ILE  18   4.835  -3.664   3.280
  135   3HG2  ILE  18          3HG2      ILE  18   5.935  -3.534   4.651
  136   1HD1  ILE  18          1HD1      ILE  18   5.473  -5.112   1.330
  137   2HD1  ILE  18          2HD1      ILE  18   4.976  -3.989   0.065
  138   3HD1  ILE  18          3HD1      ILE  18   6.475  -4.903  -0.103
  139    H    ILE  19           H        ILE  19   6.930  -1.599   4.979
  140    HA   ILE  19           HA       ILE  19   8.434  -2.997   7.096
  141    HB   ILE  19           HB       ILE  19   9.290  -1.169   8.021
  142   1HG1  ILE  19          1HG1      ILE  19   6.753   0.424   7.624
  143   2HG1  ILE  19          2HG1      ILE  19   7.052  -0.612   9.011
  144   1HG2  ILE  19          1HG2      ILE  19   9.258  -0.649   5.416
  145   2HG2  ILE  19          2HG2      ILE  19   8.325   0.738   5.976
  146   3HG2  ILE  19          3HG2      ILE  19   9.948   0.458   6.599
  147   1HD1  ILE  19          1HD1      ILE  19   9.071   0.770   9.492
  148   2HD1  ILE  19          2HD1      ILE  19   8.530   1.877   8.231
  149   3HD1  ILE  19          3HD1      ILE  19   7.527   1.606   9.657
  150    H    ALA  20           H        ALA  20   5.383  -2.161   5.913
  151    HA   ALA  20           HA       ALA  20   4.174  -3.259   8.326
  152   1HB   ALA  20          1HB       ALA  20   4.257  -0.681   8.383
  153   2HB   ALA  20          2HB       ALA  20   2.968  -0.774   7.182
  154   3HB   ALA  20          3HB       ALA  20   2.742  -1.495   8.775
  155    H    VAL  21           H        VAL  21   1.958  -3.937   8.032
  156    HA   VAL  21           HA       VAL  21   0.963  -4.071   5.305
  157    HB   VAL  21           HB       VAL  21   2.386  -6.045   5.435
  158   1HG1  VAL  21          1HG1      VAL  21   2.035  -6.162   8.011
  159   2HG1  VAL  21          2HG1      VAL  21   0.670  -7.198   7.592
  160   3HG1  VAL  21          3HG1      VAL  21   2.302  -7.646   7.095
  161   1HG2  VAL  21          1HG2      VAL  21  -0.427  -6.061   4.920
  162   2HG2  VAL  21          2HG2      VAL  21   0.855  -6.965   4.117
  163   3HG2  VAL  21          3HG2      VAL  21   0.066  -7.635   5.545
  164    H    GLU  22           H        GLU  22  -1.155  -3.701   5.334
  165    HA   GLU  22           HA       GLU  22  -2.807  -4.803   7.459
  166   1HB   GLU  22          1HB       GLU  22  -2.854  -1.843   6.859
  167   2HB   GLU  22          2HB       GLU  22  -3.822  -2.692   8.056
  168   1HG   GLU  22          1HG       GLU  22  -1.507  -3.365   9.041
  169   2HG   GLU  22          2HG       GLU  22  -0.930  -1.978   8.119
  170    H    VAL  23           H        VAL  23  -2.716  -5.584   4.831
  171    HA   VAL  23           HA       VAL  23  -5.354  -4.708   3.886
  172    HB   VAL  23           HB       VAL  23  -4.411  -5.055   1.512
  173   1HG1  VAL  23          1HG1      VAL  23  -5.139  -2.898   2.501
  174   2HG1  VAL  23          2HG1      VAL  23  -3.485  -2.639   3.057
  175   3HG1  VAL  23          3HG1      VAL  23  -3.831  -2.730   1.331
  176   1HG2  VAL  23          1HG2      VAL  23  -2.212  -5.942   2.562
  177   2HG2  VAL  23          2HG2      VAL  23  -2.128  -4.902   1.139
  178   3HG2  VAL  23          3HG2      VAL  23  -1.809  -4.233   2.740
  179    H    ASN  24           H        ASN  24  -6.666  -6.388   3.756
  180    HA   ASN  24           HA       ASN  24  -5.555  -9.004   2.988
  181   1HB   ASN  24          1HB       ASN  24  -6.252  -8.573   5.500
  182   2HB   ASN  24          2HB       ASN  24  -7.869  -8.865   4.868
  183   1HD2  ASN  24          2HD2      ASN  24  -8.022 -10.741   6.132
  184   2HD2  ASN  24          1HD2      ASN  24  -7.212 -12.199   5.683
  185    H    VAL  25           H        VAL  25  -7.333  -6.664   1.812
  186    HA   VAL  25           HA       VAL  25  -9.000  -6.481   0.277
  187    HB   VAL  25           HB       VAL  25  -8.538  -9.449  -0.022
  188   1HG1  VAL  25          1HG1      VAL  25 -10.734  -8.621  -0.902
  189   2HG1  VAL  25          2HG1      VAL  25  -9.829  -7.577  -1.997
  190   3HG1  VAL  25          3HG1      VAL  25  -9.671  -9.329  -2.119
  191   1HG2  VAL  25          1HG2      VAL  25  -6.570  -7.957  -0.420
  192   2HG2  VAL  25          2HG2      VAL  25  -7.065  -8.909  -1.819
  193   3HG2  VAL  25          3HG2      VAL  25  -7.485  -7.199  -1.722
  194    H    GLY  26           H        GLY  26 -10.959  -5.978   1.031
  195   1HA   GLY  26          1HA       GLY  26 -12.453  -8.047   2.516
  196   2HA   GLY  26          2HA       GLY  26 -13.216  -7.135   1.224
  197    H    ASP  27           H        ASP  27 -10.983  -5.344   3.084
  198    HA   ASP  27           HA       ASP  27 -13.045  -4.397   4.926
  199   1HB   ASP  27          1HB       ASP  27 -10.353  -4.886   5.272
  200   2HB   ASP  27          2HB       ASP  27 -10.412  -3.133   5.112
  201    H    THR  28           H        THR  28 -13.783  -2.304   4.988
  202    HA   THR  28           HA       THR  28 -13.709  -0.853   2.532
  203    HB   THR  28           HB       THR  28 -14.760   0.148   5.180
  204    HG1  THR  28           HG1      THR  28 -15.994  -1.558   3.285
  205   1HG2  THR  28          1HG2      THR  28 -14.674   1.729   3.232
  206   2HG2  THR  28          2HG2      THR  28 -15.826   0.667   2.424
  207   3HG2  THR  28          3HG2      THR  28 -16.269   1.462   3.934
  208    H    ILE  29           H        ILE  29 -12.376   0.715   1.915
  209    HA   ILE  29           HA       ILE  29 -10.502   1.805   3.903
  210    HB   ILE  29           HB       ILE  29  -9.059   2.367   1.965
  211   1HG1  ILE  29          1HG1      ILE  29 -10.181   0.581   0.045
  212   2HG1  ILE  29          2HG1      ILE  29 -11.430   1.723   0.527
  213   1HG2  ILE  29          1HG2      ILE  29  -9.086   0.131   3.302
  214   2HG2  ILE  29          2HG2      ILE  29  -9.662  -0.552   1.780
  215   3HG2  ILE  29          3HG2      ILE  29  -8.104   0.271   1.845
  216   1HD1  ILE  29          1HD1      ILE  29  -8.781   2.859  -0.084
  217   2HD1  ILE  29          2HD1      ILE  29  -9.696   2.195  -1.438
  218   3HD1  ILE  29          3HD1      ILE  29 -10.396   3.472  -0.442
  219    H    ALA  30           H        ALA  30  -9.914   4.035   3.767
  220    HA   ALA  30           HA       ALA  30 -11.906   5.723   2.404
  221   1HB   ALA  30          1HB       ALA  30 -12.545   5.834   4.658
  222   2HB   ALA  30          2HB       ALA  30 -11.603   7.299   4.385
  223   3HB   ALA  30          3HB       ALA  30 -10.875   5.925   5.217
  224    H    VAL  31           H        VAL  31 -11.040   8.151   2.601
  225    HA   VAL  31           HA       VAL  31  -8.516   8.130   1.177
  226    HB   VAL  31           HB       VAL  31 -10.157  10.560   1.868
  227   1HG1  VAL  31          1HG1      VAL  31  -7.706  10.446   0.789
  228   2HG1  VAL  31          2HG1      VAL  31  -8.678  10.295  -0.675
  229   3HG1  VAL  31          3HG1      VAL  31  -8.884  11.693   0.380
  230   1HG2  VAL  31          1HG2      VAL  31 -11.517   8.754   0.757
  231   2HG2  VAL  31          2HG2      VAL  31 -11.427  10.282  -0.118
  232   3HG2  VAL  31          3HG2      VAL  31 -10.446   8.911  -0.635
  233    H    ASP  32           H        ASP  32  -7.999   7.353   3.723
  234    HA   ASP  32           HA       ASP  32  -5.900   8.822   4.586
  235   1HB   ASP  32          1HB       ASP  32  -6.938   9.995   6.646
  236   2HB   ASP  32          2HB       ASP  32  -7.093  10.782   5.077
  237    H    ASP  33           H        ASP  33  -5.688   6.422   4.749
  238    HA   ASP  33           HA       ASP  33  -5.902   5.650   7.524
  239   1HB   ASP  33          1HB       ASP  33  -7.116   3.550   7.083
  240   2HB   ASP  33          2HB       ASP  33  -8.103   4.961   6.714
  241    H    THR  34           H        THR  34  -3.741   5.348   7.663
  242    HA   THR  34           HA       THR  34  -1.963   4.420   5.825
  243    HB   THR  34           HB       THR  34  -0.877   3.325   7.990
  244    HG1  THR  34           HG1      THR  34  -2.593   3.615   9.365
  245   1HG2  THR  34          1HG2      THR  34  -0.092   5.315   6.684
  246   2HG2  THR  34          2HG2      THR  34  -1.074   6.304   7.765
  247   3HG2  THR  34          3HG2      THR  34   0.254   5.341   8.414
  248    H    LEU  35           H        LEU  35  -1.870   2.690   4.635
  249    HA   LEU  35           HA       LEU  35  -3.165   0.225   5.517
  250   1HB   LEU  35          1HB       LEU  35  -2.038   1.145   2.878
  251   2HB   LEU  35          2HB       LEU  35  -2.522  -0.518   3.154
  252    HG   LEU  35           HG       LEU  35  -4.283   1.927   3.157
  253   1HD1  LEU  35          1HD1      LEU  35  -3.556   0.689   1.013
  254   2HD1  LEU  35          2HD1      LEU  35  -4.654  -0.577   1.563
  255   3HD1  LEU  35          3HD1      LEU  35  -5.266   1.047   1.251
  256   1HD2  LEU  35          1HD2      LEU  35  -4.717  -0.778   4.314
  257   2HD2  LEU  35          2HD2      LEU  35  -5.295   0.795   4.864
  258   3HD2  LEU  35          3HD2      LEU  35  -6.060   0.008   3.484
  259    H    ILE  36           H        ILE  36  -0.033   1.488   4.503
  260    HA   ILE  36           HA       ILE  36   1.291  -0.572   6.067
  261    HB   ILE  36           HB       ILE  36   2.896  -1.124   4.243
  262   1HG1  ILE  36          1HG1      ILE  36   2.338  -0.722   1.931
  263   2HG1  ILE  36          2HG1      ILE  36   0.846   0.093   2.379
  264   1HG2  ILE  36          1HG2      ILE  36   0.539  -2.259   4.846
  265   2HG2  ILE  36          2HG2      ILE  36   0.333  -1.982   3.118
  266   3HG2  ILE  36          3HG2      ILE  36   1.700  -2.930   3.701
  267   1HD1  ILE  36          1HD1      ILE  36   3.501   1.157   3.251
  268   2HD1  ILE  36          2HD1      ILE  36   2.872   1.485   1.636
  269   3HD1  ILE  36          3HD1      ILE  36   1.967   2.005   3.057
  270    H    THR  37           H        THR  37   3.832  -0.186   5.558
  271    HA   THR  37           HA       THR  37   4.473   2.623   5.339
  272    HB   THR  37           HB       THR  37   4.956   1.034   7.866
  273    HG1  THR  37           HG1      THR  37   3.249   2.104   8.408
  274   1HG2  THR  37          1HG2      THR  37   6.978   2.344   7.155
  275   2HG2  THR  37          2HG2      THR  37   5.993   3.796   7.326
  276   3HG2  THR  37          3HG2      THR  37   6.299   2.769   8.726
  277    H    LEU  38           H        LEU  38   6.271   2.754   4.136
  278    HA   LEU  38           HA       LEU  38   7.973   0.358   3.998
  279   1HB   LEU  38          1HB       LEU  38   7.172   2.380   1.942
  280   2HB   LEU  38          2HB       LEU  38   8.636   1.434   1.736
  281    HG   LEU  38           HG       LEU  38   6.812  -0.513   2.302
  282   1HD1  LEU  38          1HD1      LEU  38   5.342   1.826   1.474
  283   2HD1  LEU  38          2HD1      LEU  38   5.116   0.488   0.345
  284   3HD1  LEU  38          3HD1      LEU  38   4.754   0.267   2.057
  285   1HD2  LEU  38          1HD2      LEU  38   7.840   0.644  -0.261
  286   2HD2  LEU  38          2HD2      LEU  38   8.303  -0.850   0.555
  287   3HD2  LEU  38          3HD2      LEU  38   6.746  -0.740  -0.265
  288    H    GLU  39           H        GLU  39  10.249   0.803   3.301
  289    HA   GLU  39           HA       GLU  39  11.378   3.361   3.926
  290   1HB   GLU  39          1HB       GLU  39  11.077   2.655   6.189
  291   2HB   GLU  39          2HB       GLU  39  11.724   1.058   5.842
  292   1HG   GLU  39          1HG       GLU  39  13.927   2.004   5.471
  293   2HG   GLU  39          2HG       GLU  39  13.292   3.627   5.741
  294    H    THR  40           H        THR  40  13.776   3.315   3.762
  295    HA   THR  40           HA       THR  40  14.671   1.129   2.003
  296    HB   THR  40           HB       THR  40  15.796   2.659   0.613
  297    HG1  THR  40           HG1      THR  40  16.760   4.239   1.573
  298   1HG2  THR  40          1HG2      THR  40  13.201   2.810   0.615
  299   2HG2  THR  40          2HG2      THR  40  13.488   4.413   1.290
  300   3HG2  THR  40          3HG2      THR  40  14.155   3.988  -0.286
  301    H    ASP  41           H        ASP  41  15.941   3.814   3.954
  302    HA   ASP  41           HA       ASP  41  17.483   2.186   5.651
  303   1HB   ASP  41          1HB       ASP  41  18.699   2.848   3.093
  304   2HB   ASP  41          2HB       ASP  41  19.655   3.444   4.447
  305    H    LYS  42           H        LYS  42  17.123   5.329   4.094
  306    HA   LYS  42           HA       LYS  42  17.878   6.597   6.646
  307   1HB   LYS  42          1HB       LYS  42  18.404   7.352   3.816
  308   2HB   LYS  42          2HB       LYS  42  18.129   8.650   4.969
  309   1HG   LYS  42          1HG       LYS  42  19.940   6.877   6.184
  310   2HG   LYS  42          2HG       LYS  42  20.485   7.102   4.521
  311   1HD   LYS  42          1HD       LYS  42  20.764   9.393   4.788
  312   2HD   LYS  42          2HD       LYS  42  19.686   9.459   6.184
  313   1HE   LYS  42          1HE       LYS  42  21.835   9.718   7.080
  314   2HE   LYS  42          2HE       LYS  42  21.423   8.030   7.383
  315   1HZ   LYS  42          1HZ       LYS  42  22.714   8.361   4.864
  316   2HZ   LYS  42          2HZ       LYS  42  23.671   8.960   6.123
  317   3HZ   LYS  42          3HZ       LYS  42  23.131   7.357   6.160
  318    H    ALA  43           H        ALA  43  15.383   6.168   4.323
  319    HA   ALA  43           HA       ALA  43  13.712   8.061   5.825
  320   1HB   ALA  43          1HB       ALA  43  14.607   8.630   3.312
  321   2HB   ALA  43          2HB       ALA  43  13.148   9.295   4.046
  322   3HB   ALA  43          3HB       ALA  43  13.040   7.890   2.985
  323    H    THR  44           H        THR  44  11.524   7.544   5.972
  324    HA   THR  44           HA       THR  44  10.728   4.912   4.928
  325    HB   THR  44           HB       THR  44   9.918   4.172   6.976
  326    HG1  THR  44           HG1      THR  44   9.455   5.546   8.697
  327   1HG2  THR  44          1HG2      THR  44  12.526   4.948   6.979
  328   2HG2  THR  44          2HG2      THR  44  11.901   5.746   8.421
  329   3HG2  THR  44          3HG2      THR  44  11.741   3.999   8.242
  330    H    MET  45           H        MET  45   8.666   4.780   4.157
  331    HA   MET  45           HA       MET  45   7.000   7.197   4.435
  332   1HB   MET  45          1HB       MET  45   7.861   5.721   2.053
  333   2HB   MET  45          2HB       MET  45   6.135   6.041   2.105
  334   1HG   MET  45          1HG       MET  45   7.536   8.408   2.853
  335   2HG   MET  45          2HG       MET  45   8.212   7.787   1.349
  336   1HE   MET  45          1HE       MET  45   7.455  10.293   1.284
  337   2HE   MET  45          2HE       MET  45   6.736  10.210  -0.325
  338   3HE   MET  45          3HE       MET  45   5.796  10.839   1.029
  339    H    ASP  46           H        ASP  46   4.705   6.470   3.359
  340    HA   ASP  46           HA       ASP  46   3.735   3.908   4.095
  341   1HB   ASP  46          1HB       ASP  46   2.251   4.629   5.944
  342   2HB   ASP  46          2HB       ASP  46   3.956   4.767   6.365
  343    H    VAL  47           H        VAL  47   1.393   3.722   3.710
  344    HA   VAL  47           HA       VAL  47   0.407   5.914   2.004
  345    HB   VAL  47           HB       VAL  47  -0.076   2.966   1.577
  346   1HG1  VAL  47          1HG1      VAL  47  -1.783   4.895   0.883
  347   2HG1  VAL  47          2HG1      VAL  47  -0.683   5.002  -0.492
  348   3HG1  VAL  47          3HG1      VAL  47  -1.492   3.479  -0.130
  349   1HG2  VAL  47          1HG2      VAL  47   2.260   3.988   1.080
  350   2HG2  VAL  47          2HG2      VAL  47   1.481   2.982  -0.140
  351   3HG2  VAL  47          3HG2      VAL  47   1.447   4.737  -0.294
  352    HA   PRO  48           HA       PRO  48  -3.096   5.538   4.761
  353   1HB   PRO  48          1HB       PRO  48  -4.277   7.840   4.147
  354   2HB   PRO  48          2HB       PRO  48  -2.733   7.819   5.008
  355   1HG   PRO  48          1HG       PRO  48  -3.300   8.422   2.147
  356   2HG   PRO  48          2HG       PRO  48  -2.079   9.120   3.223
  357   1HD   PRO  48          1HD       PRO  48  -1.671   7.076   1.328
  358   2HD   PRO  48          2HD       PRO  48  -0.545   7.570   2.606
  359    H    ALA  49           H        ALA  49  -3.117   4.199   2.107
  360    HA   ALA  49           HA       ALA  49  -4.724   3.024   0.961
  361   1HB   ALA  49          1HB       ALA  49  -6.851   4.843   2.050
  362   2HB   ALA  49          2HB       ALA  49  -6.209   3.481   2.968
  363   3HB   ALA  49          3HB       ALA  49  -7.021   3.201   1.428
  364    H    GLU  50           H        GLU  50  -5.415   6.500   1.088
  365    HA   GLU  50           HA       GLU  50  -5.813   8.042  -0.525
  366   1HB   GLU  50          1HB       GLU  50  -3.457   7.383  -1.064
  367   2HB   GLU  50          2HB       GLU  50  -4.099   6.253  -2.248
  368   1HG   GLU  50          1HG       GLU  50  -3.794   7.949  -3.672
  369   2HG   GLU  50          2HG       GLU  50  -5.331   8.521  -3.025
  370    H    VAL  51           H        VAL  51  -7.975   6.640  -0.281
  371    HA   VAL  51           HA       VAL  51  -9.202   6.727  -2.820
  372    HB   VAL  51           HB       VAL  51  -9.762   4.043  -2.380
  373   1HG1  VAL  51          1HG1      VAL  51  -7.888   5.351  -4.341
  374   2HG1  VAL  51          2HG1      VAL  51  -8.548   3.726  -4.503
  375   3HG1  VAL  51          3HG1      VAL  51  -9.625   5.122  -4.531
  376   1HG2  VAL  51          1HG2      VAL  51  -7.517   4.262  -0.972
  377   2HG2  VAL  51          2HG2      VAL  51  -7.860   2.842  -1.960
  378   3HG2  VAL  51          3HG2      VAL  51  -6.794   4.107  -2.573
  379    H    ALA  52           H        ALA  52 -11.355   5.100  -2.537
  380    HA   ALA  52           HA       ALA  52 -12.453   5.381   0.137
  381   1HB   ALA  52          1HB       ALA  52 -12.783   7.603  -0.710
  382   2HB   ALA  52          2HB       ALA  52 -13.518   6.962  -2.183
  383   3HB   ALA  52          3HB       ALA  52 -14.336   6.768  -0.632
  384    H    GLY  53           H        GLY  53 -12.304   2.998  -0.655
  385   1HA   GLY  53          1HA       GLY  53 -13.809   1.828  -2.581
  386   2HA   GLY  53          2HA       GLY  53 -14.998   2.212  -1.347
  387    H    VAL  54           H        VAL  54 -13.790  -0.344  -2.464
  388    HA   VAL  54           HA       VAL  54 -12.958  -1.542   0.099
  389    HB   VAL  54           HB       VAL  54 -14.760  -2.790  -1.984
  390   1HG1  VAL  54          1HG1      VAL  54 -13.318  -3.871   0.362
  391   2HG1  VAL  54          2HG1      VAL  54 -14.981  -4.409   0.135
  392   3HG1  VAL  54          3HG1      VAL  54 -13.791  -4.659  -1.143
  393   1HG2  VAL  54          1HG2      VAL  54 -15.878  -1.058  -0.653
  394   2HG2  VAL  54          2HG2      VAL  54 -16.504  -2.666  -0.288
  395   3HG2  VAL  54          3HG2      VAL  54 -15.385  -1.881   0.826
  396    H    VAL  55           H        VAL  55 -11.205  -2.887   0.022
  397    HA   VAL  55           HA       VAL  55  -9.626  -2.887  -2.345
  398    HB   VAL  55           HB       VAL  55  -9.211  -4.506   0.167
  399   1HG1  VAL  55          1HG1      VAL  55  -8.020  -5.336  -1.878
  400   2HG1  VAL  55          2HG1      VAL  55  -7.211  -3.771  -1.973
  401   3HG1  VAL  55          3HG1      VAL  55  -6.946  -4.815  -0.577
  402   1HG2  VAL  55          1HG2      VAL  55  -9.282  -1.912   0.259
  403   2HG2  VAL  55          2HG2      VAL  55  -7.945  -2.766   1.030
  404   3HG2  VAL  55          3HG2      VAL  55  -7.717  -2.013  -0.548
  405    H    LYS  56           H        LYS  56  -9.077  -4.515  -3.707
  406    HA   LYS  56           HA       LYS  56 -10.758  -6.936  -3.607
  407   1HB   LYS  56          1HB       LYS  56  -9.629  -6.459  -6.219
  408   2HB   LYS  56          2HB       LYS  56 -11.317  -6.647  -5.763
  409   1HG   LYS  56          1HG       LYS  56  -9.873  -4.045  -5.409
  410   2HG   LYS  56          2HG       LYS  56 -10.625  -4.493  -6.942
  411   1HD   LYS  56          1HD       LYS  56 -12.091  -4.455  -4.309
  412   2HD   LYS  56          2HD       LYS  56 -12.050  -3.086  -5.422
  413   1HE   LYS  56          1HE       LYS  56 -13.422  -4.094  -6.927
  414   2HE   LYS  56          2HE       LYS  56 -12.823  -5.709  -6.555
  415   1HZ   LYS  56          1HZ       LYS  56 -14.533  -4.181  -4.682
  416   2HZ   LYS  56          2HZ       LYS  56 -15.175  -5.205  -5.865
  417   3HZ   LYS  56          3HZ       LYS  56 -14.174  -5.834  -4.654
  418    H    GLU  57           H        GLU  57  -7.673  -5.572  -4.644
  419    HA   GLU  57           HA       GLU  57  -6.519  -8.239  -4.430
  420   1HB   GLU  57          1HB       GLU  57  -6.009  -5.961  -6.238
  421   2HB   GLU  57          2HB       GLU  57  -4.595  -6.871  -5.725
  422   1HG   GLU  57          1HG       GLU  57  -5.385  -8.854  -6.700
  423   2HG   GLU  57          2HG       GLU  57  -7.017  -8.211  -6.878
  424    H    VAL  58           H        VAL  58  -4.072  -8.131  -3.903
  425    HA   VAL  58           HA       VAL  58  -3.187  -6.029  -2.169
  426    HB   VAL  58           HB       VAL  58  -4.715  -7.124  -0.615
  427   1HG1  VAL  58          1HG1      VAL  58  -3.736  -9.493  -1.866
  428   2HG1  VAL  58          2HG1      VAL  58  -3.433  -9.595  -0.131
  429   3HG1  VAL  58          3HG1      VAL  58  -5.070  -9.312  -0.725
  430   1HG2  VAL  58          1HG2      VAL  58  -2.139  -6.454  -0.115
  431   2HG2  VAL  58          2HG2      VAL  58  -3.295  -6.949   1.122
  432   3HG2  VAL  58          3HG2      VAL  58  -2.164  -8.124   0.451
  433    H    LYS  59           H        LYS  59  -1.045  -5.974  -2.257
  434    HA   LYS  59           HA       LYS  59   0.482  -8.438  -2.529
  435   1HB   LYS  59          1HB       LYS  59   0.668  -6.149  -4.486
  436   2HB   LYS  59          2HB       LYS  59   1.778  -7.513  -4.424
  437   1HG   LYS  59          1HG       LYS  59   0.420  -8.389  -5.977
  438   2HG   LYS  59          2HG       LYS  59  -0.598  -8.800  -4.593
  439   1HD   LYS  59          1HD       LYS  59  -2.218  -7.507  -5.382
  440   2HD   LYS  59          2HD       LYS  59  -1.141  -6.111  -5.345
  441   1HE   LYS  59          1HE       LYS  59  -2.055  -6.465  -7.581
  442   2HE   LYS  59          2HE       LYS  59  -0.305  -6.686  -7.562
  443   1HZ   LYS  59          1HZ       LYS  59  -1.818  -9.102  -7.102
  444   2HZ   LYS  59          2HZ       LYS  59  -2.054  -8.421  -8.632
  445   3HZ   LYS  59          3HZ       LYS  59  -0.494  -8.829  -8.120
  446    H    VAL  60           H        VAL  60   0.923  -7.722  -0.315
  447    HA   VAL  60           HA       VAL  60   3.425  -6.430  -0.129
  448    HB   VAL  60           HB       VAL  60   2.504  -4.323  -0.339
  449   1HG1  VAL  60          1HG1      VAL  60   0.089  -5.259   1.201
  450   2HG1  VAL  60          2HG1      VAL  60   0.327  -3.631   0.566
  451   3HG1  VAL  60          3HG1      VAL  60   0.191  -4.999  -0.542
  452   1HG2  VAL  60          1HG2      VAL  60   3.683  -4.564   1.862
  453   2HG2  VAL  60          2HG2      VAL  60   2.537  -3.227   1.776
  454   3HG2  VAL  60          3HG2      VAL  60   2.099  -4.711   2.622
  455    H    LYS  61           H        LYS  61   4.259  -6.421   2.029
  456    HA   LYS  61           HA       LYS  61   2.727  -7.506   4.199
  457   1HB   LYS  61          1HB       LYS  61   3.651  -9.407   2.505
  458   2HB   LYS  61          2HB       LYS  61   5.029  -9.257   3.587
  459   1HG   LYS  61          1HG       LYS  61   4.008 -10.550   5.058
  460   2HG   LYS  61          2HG       LYS  61   2.700  -9.371   5.189
  461   1HD   LYS  61          1HD       LYS  61   1.379 -10.472   3.638
  462   2HD   LYS  61          2HD       LYS  61   2.755 -11.293   2.898
  463   1HE   LYS  61          1HE       LYS  61   1.603 -12.958   4.097
  464   2HE   LYS  61          2HE       LYS  61   2.999 -12.545   5.091
  465   1HZ   LYS  61          1HZ       LYS  61   0.511 -11.095   5.585
  466   2HZ   LYS  61          2HZ       LYS  61   0.582 -12.707   6.088
  467   3HZ   LYS  61          3HZ       LYS  61   1.708 -11.590   6.674
  468    H    VAL  62           H        VAL  62   4.910  -8.563   5.664
  469    HA   VAL  62           HA       VAL  62   6.458  -6.099   6.107
  470    HB   VAL  62           HB       VAL  62   5.810  -8.301   8.072
  471   1HG1  VAL  62          1HG1      VAL  62   8.004  -7.112   8.394
  472   2HG1  VAL  62          2HG1      VAL  62   7.080  -5.629   8.635
  473   3HG1  VAL  62          3HG1      VAL  62   6.874  -6.987   9.741
  474   1HG2  VAL  62          1HG2      VAL  62   4.045  -6.504   7.201
  475   2HG2  VAL  62          2HG2      VAL  62   4.085  -7.059   8.875
  476   3HG2  VAL  62          3HG2      VAL  62   4.839  -5.526   8.436
  477    H    GLY  63           H        GLY  63   7.929  -6.880   4.396
  478   1HA   GLY  63          1HA       GLY  63   9.680  -9.072   5.298
  479   2HA   GLY  63          2HA       GLY  63  10.368  -7.507   4.897
  480    H    ASP  64           H        ASP  64   8.799  -6.901   2.636
  481    HA   ASP  64           HA       ASP  64   9.831  -8.917   0.755
  482   1HB   ASP  64          1HB       ASP  64   7.847  -8.398  -0.702
  483   2HB   ASP  64          2HB       ASP  64   7.459  -9.247   0.791
  484    H    LYS  65           H        LYS  65  10.858  -8.158  -1.028
  485    HA   LYS  65           HA       LYS  65  11.756  -5.453  -1.005
  486   1HB   LYS  65          1HB       LYS  65  12.188  -7.811  -2.802
  487   2HB   LYS  65          2HB       LYS  65  12.706  -6.214  -3.323
  488   1HG   LYS  65          1HG       LYS  65  13.633  -6.574  -0.679
  489   2HG   LYS  65          2HG       LYS  65  14.018  -8.039  -1.583
  490   1HD   LYS  65          1HD       LYS  65  14.549  -5.501  -2.982
  491   2HD   LYS  65          2HD       LYS  65  15.561  -5.820  -1.572
  492   1HE   LYS  65          1HE       LYS  65  15.159  -8.027  -3.516
  493   2HE   LYS  65          2HE       LYS  65  16.198  -6.688  -4.001
  494   1HZ   LYS  65          1HZ       LYS  65  16.925  -7.383  -1.414
  495   2HZ   LYS  65          2HZ       LYS  65  16.780  -8.834  -2.269
  496   3HZ   LYS  65          3HZ       LYS  65  17.813  -7.619  -2.833
  497    H    ILE  66           H        ILE  66  10.496  -3.828  -1.597
  498    HA   ILE  66           HA       ILE  66   9.066  -4.027  -4.141
  499    HB   ILE  66           HB       ILE  66   7.806  -3.995  -1.575
  500   1HG1  ILE  66          1HG1      ILE  66   5.821  -4.421  -2.863
  501   2HG1  ILE  66          2HG1      ILE  66   6.562  -3.742  -4.311
  502   1HG2  ILE  66          1HG2      ILE  66   7.890  -1.554  -1.653
  503   2HG2  ILE  66          2HG2      ILE  66   7.085  -1.579  -3.219
  504   3HG2  ILE  66          3HG2      ILE  66   6.236  -2.152  -1.785
  505   1HD1  ILE  66          1HD1      ILE  66   7.772  -6.098  -2.928
  506   2HD1  ILE  66          2HD1      ILE  66   6.439  -6.291  -4.070
  507   3HD1  ILE  66          3HD1      ILE  66   7.960  -5.567  -4.599
  508    H    SER  67           H        SER  67   8.268  -1.781  -4.839
  509    HA   SER  67           HA       SER  67   9.806   0.435  -3.782
  510   1HB   SER  67          1HB       SER  67  10.387   0.724  -6.465
  511   2HB   SER  67          2HB       SER  67  11.507   0.160  -5.226
  512    HG   SER  67           HG       SER  67   9.768  -1.621  -6.553
  513    H    GLU  68           H        GLU  68   9.274   2.491  -4.866
  514    HA   GLU  68           HA       GLU  68   6.641   3.109  -4.909
  515   1HB   GLU  68          1HB       GLU  68   7.310   5.002  -6.522
  516   2HB   GLU  68          2HB       GLU  68   8.101   4.925  -4.955
  517   1HG   GLU  68          1HG       GLU  68  10.022   5.052  -6.046
  518   2HG   GLU  68          2HG       GLU  68   9.727   3.399  -6.584
  519    H    GLY  69           H        GLY  69   5.073   2.065  -5.975
  520   1HA   GLY  69          1HA       GLY  69   5.243   1.993  -8.901
  521   2HA   GLY  69          2HA       GLY  69   3.771   1.886  -7.954
  522    H    GLY  70           H        GLY  70   3.619  -0.137  -6.538
  523   1HA   GLY  70          1HA       GLY  70   4.689  -2.448  -6.421
  524   2HA   GLY  70          2HA       GLY  70   4.552  -2.413  -8.174
  525    H    LEU  71           H        LEU  71   1.932  -0.895  -7.787
  526    HA   LEU  71           HA       LEU  71  -0.293  -1.315  -7.449
  527   1HB   LEU  71          1HB       LEU  71   0.018  -2.446  -9.536
  528   2HB   LEU  71          2HB       LEU  71   0.675  -3.861  -8.737
  529    HG   LEU  71           HG       LEU  71  -1.406  -4.619  -8.056
  530   1HD1  LEU  71          1HD1      LEU  71  -2.113  -1.758  -8.006
  531   2HD1  LEU  71          2HD1      LEU  71  -3.414  -2.867  -8.443
  532   3HD1  LEU  71          3HD1      LEU  71  -2.567  -3.063  -6.909
  533   1HD2  LEU  71          1HD2      LEU  71  -1.900  -3.151 -10.640
  534   2HD2  LEU  71          2HD2      LEU  71  -1.234  -4.775 -10.461
  535   3HD2  LEU  71          3HD2      LEU  71  -2.905  -4.450  -9.999
  536    H    ILE  72           H        ILE  72   0.648  -1.427  -5.064
  537    HA   ILE  72           HA       ILE  72   0.782  -3.749  -3.616
  538    HB   ILE  72           HB       ILE  72   0.004  -0.955  -2.937
  539   1HG1  ILE  72          1HG1      ILE  72   2.005  -2.533  -1.427
  540   2HG1  ILE  72          2HG1      ILE  72   2.362  -2.214  -3.122
  541   1HG2  ILE  72          1HG2      ILE  72  -0.710  -3.312  -1.297
  542   2HG2  ILE  72          2HG2      ILE  72   0.096  -1.989  -0.450
  543   3HG2  ILE  72          3HG2      ILE  72  -1.408  -1.692  -1.322
  544   1HD1  ILE  72          1HD1      ILE  72   1.436   0.149  -1.745
  545   2HD1  ILE  72          2HD1      ILE  72   2.871  -0.552  -0.993
  546   3HD1  ILE  72          3HD1      ILE  72   2.895  -0.111  -2.700
  547    H    VAL  73           H        VAL  73  -2.157  -1.721  -3.469
  548    HA   VAL  73           HA       VAL  73  -3.755  -4.172  -3.707
  549    HB   VAL  73           HB       VAL  73  -5.190  -3.537  -1.872
  550   1HG1  VAL  73          1HG1      VAL  73  -2.480  -4.307  -1.614
  551   2HG1  VAL  73          2HG1      VAL  73  -2.855  -3.225  -0.273
  552   3HG1  VAL  73          3HG1      VAL  73  -3.828  -4.672  -0.538
  553   1HG2  VAL  73          1HG2      VAL  73  -4.970  -1.096  -2.112
  554   2HG2  VAL  73          2HG2      VAL  73  -4.729  -1.627  -0.448
  555   3HG2  VAL  73          3HG2      VAL  73  -3.340  -1.191  -1.443
  556    H    VAL  74           H        VAL  74  -5.760  -3.971  -4.595
  557    HA   VAL  74           HA       VAL  74  -6.345  -1.409  -5.929
  558    HB   VAL  74           HB       VAL  74  -7.253  -4.228  -6.579
  559   1HG1  VAL  74          1HG1      VAL  74  -8.820  -2.181  -7.090
  560   2HG1  VAL  74          2HG1      VAL  74  -7.696  -1.931  -8.423
  561   3HG1  VAL  74          3HG1      VAL  74  -8.575  -3.453  -8.285
  562   1HG2  VAL  74          1HG2      VAL  74  -5.179  -2.410  -7.737
  563   2HG2  VAL  74          2HG2      VAL  74  -5.051  -4.111  -7.287
  564   3HG2  VAL  74          3HG2      VAL  74  -5.947  -3.646  -8.731
  565    H    VAL  75           H        VAL  75  -8.273  -0.378  -5.541
  566    HA   VAL  75           HA       VAL  75 -10.159  -1.739  -3.749
  567    HB   VAL  75           HB       VAL  75 -10.620   0.668  -2.907
  568   1HG1  VAL  75          1HG1      VAL  75  -8.280  -1.054  -2.161
  569   2HG1  VAL  75          2HG1      VAL  75  -8.691   0.399  -1.250
  570   3HG1  VAL  75          3HG1      VAL  75  -9.851  -0.924  -1.371
  571   1HG2  VAL  75          1HG2      VAL  75  -8.757   1.349  -4.745
  572   2HG2  VAL  75          2HG2      VAL  75  -9.146   2.313  -3.320
  573   3HG2  VAL  75          3HG2      VAL  75  -7.762   1.220  -3.294
  574    H    GLU  76           H        GLU  76 -12.311  -0.659  -3.668
  575    HA   GLU  76           HA       GLU  76 -13.169  -0.030  -6.398
  576   1HB   GLU  76          1HB       GLU  76 -14.217  -1.687  -4.327
  577   2HB   GLU  76          2HB       GLU  76 -15.381  -0.406  -4.632
  578   1HG   GLU  76          1HG       GLU  76 -15.243  -0.985  -7.065
  579   2HG   GLU  76          2HG       GLU  76 -14.285  -2.390  -6.602
  580    H    ALA  77           H        ALA  77 -11.929   2.068  -5.183
  581    HA   ALA  77           HA       ALA  77 -13.062   3.833  -3.579
  582   1HB   ALA  77          1HB       ALA  77 -11.779   5.444  -4.526
  583   2HB   ALA  77          2HB       ALA  77 -12.185   4.953  -6.171
  584   3HB   ALA  77          3HB       ALA  77 -11.036   4.006  -5.225
  585    H    GLU  78           H        GLU  78 -14.639   5.386  -3.528
  586    HA   GLU  78           HA       GLU  78 -16.757   6.158  -3.863
  587   1HB   GLU  78          1HB       GLU  78 -17.101   7.294  -5.925
  588   2HB   GLU  78          2HB       GLU  78 -15.381   7.396  -5.574
  589   1HG   GLU  78          1HG       GLU  78 -14.838   5.827  -7.226
  590   2HG   GLU  78          2HG       GLU  78 -16.507   5.276  -7.372
  591    H    GLY  79           H        GLY  79 -16.325   3.254  -4.044
  592   1HA   GLY  79          1HA       GLY  79 -17.642   1.408  -4.373
  593   2HA   GLY  79          2HA       GLY  79 -17.707   1.960  -6.040
  594    H    THR  80           H        THR  80 -19.839   1.074  -6.151
  595    HA   THR  80           HA       THR  80 -21.854   2.830  -4.914
  596    HB   THR  80           HB       THR  80 -21.685   2.970  -7.391
  597    HG1  THR  80           HG1      THR  80 -23.857   2.924  -7.679
  598   1HG2  THR  80          1HG2      THR  80 -21.133   0.493  -7.665
  599   2HG2  THR  80          2HG2      THR  80 -22.870   0.227  -7.525
  600   3HG2  THR  80          3HG2      THR  80 -22.234   1.229  -8.830
  601    H    ALA  81           H        ALA  81 -20.852  -0.450  -5.478
  602    HA   ALA  81           HA       ALA  81 -23.306  -1.613  -4.498
  603   1HB   ALA  81          1HB       ALA  81 -21.029  -2.530  -5.930
  604   2HB   ALA  81          2HB       ALA  81 -22.545  -3.373  -5.614
  605   3HB   ALA  81          3HB       ALA  81 -21.204  -3.516  -4.477

  No H/Q in entry =         605
  Start of MODEL    6
    1    H1   ALA   1           H1       ALA   1 -13.701   4.502 -10.893
    2    H2   ALA   1           H2       ALA   1 -12.879   3.527 -12.041
    3    H3   ALA   1           H3       ALA   1 -14.440   4.146 -12.398
    4    HA   ALA   1           HA       ALA   1 -15.408   2.841 -10.706
    5   1HB   ALA   1          1HB       ALA   1 -15.333   1.790 -12.827
    6   2HB   ALA   1          2HB       ALA   1 -13.630   1.372 -12.636
    7   3HB   ALA   1          3HB       ALA   1 -14.850   0.571 -11.647
    8    H    LEU   2           H        LEU   2 -12.382   1.089 -11.136
    9    HA   LEU   2           HA       LEU   2 -12.216   0.788  -8.221
   10   1HB   LEU   2          1HB       LEU   2 -10.929  -0.787 -10.452
   11   2HB   LEU   2          2HB       LEU   2 -10.671  -1.091  -8.745
   12    HG   LEU   2           HG       LEU   2 -13.427  -1.164  -8.993
   13   1HD1  LEU   2          1HD1      LEU   2 -12.195  -1.808 -11.552
   14   2HD1  LEU   2          2HD1      LEU   2 -13.211  -3.103 -10.920
   15   3HD1  LEU   2          3HD1      LEU   2 -13.883  -1.489 -11.152
   16   1HD2  LEU   2          1HD2      LEU   2 -11.497  -2.705  -7.937
   17   2HD2  LEU   2          2HD2      LEU   2 -13.174  -3.224  -8.103
   18   3HD2  LEU   2          3HD2      LEU   2 -11.976  -3.714  -9.302
   19    H    VAL   3           H        VAL   3  -9.779   0.352  -7.566
   20    HA   VAL   3           HA       VAL   3  -8.005   2.295  -8.835
   21    HB   VAL   3           HB       VAL   3  -9.087   2.502  -6.054
   22   1HG1  VAL   3          1HG1      VAL   3  -6.678   2.234  -5.682
   23   2HG1  VAL   3          2HG1      VAL   3  -6.360   3.540  -6.826
   24   3HG1  VAL   3          3HG1      VAL   3  -7.213   3.877  -5.319
   25   1HG2  VAL   3          1HG2      VAL   3  -9.084   4.053  -8.442
   26   2HG2  VAL   3          2HG2      VAL   3  -9.947   4.340  -6.932
   27   3HG2  VAL   3          3HG2      VAL   3  -8.317   4.979  -7.151
   28    H    GLU   4           H        GLU   4  -5.774   2.133  -8.047
   29    HA   GLU   4           HA       GLU   4  -5.106  -0.433  -6.801
   30   1HB   GLU   4          1HB       GLU   4  -3.086  -0.126  -8.651
   31   2HB   GLU   4          2HB       GLU   4  -4.432  -1.246  -8.783
   32   1HG   GLU   4          1HG       GLU   4  -4.364  -0.137 -10.834
   33   2HG   GLU   4          2HG       GLU   4  -5.679   0.637  -9.950
   34    H    LEU   5           H        LEU   5  -3.885  -0.033  -5.083
   35    HA   LEU   5           HA       LEU   5  -2.664   2.491  -4.629
   36   1HB   LEU   5          1HB       LEU   5  -3.474   0.558  -2.981
   37   2HB   LEU   5          2HB       LEU   5  -1.779   0.113  -3.081
   38    HG   LEU   5           HG       LEU   5  -1.414   2.671  -2.527
   39   1HD1  LEU   5          1HD1      LEU   5  -4.219   2.102  -1.651
   40   2HD1  LEU   5          2HD1      LEU   5  -3.208   3.252  -0.775
   41   3HD1  LEU   5          3HD1      LEU   5  -3.574   3.519  -2.479
   42   1HD2  LEU   5          1HD2      LEU   5  -2.207   0.598  -0.485
   43   2HD2  LEU   5          2HD2      LEU   5  -0.603   0.812  -1.187
   44   3HD2  LEU   5          3HD2      LEU   5  -1.288   2.067  -0.156
   45    H    LYS   6           H        LYS   6  -0.360   2.820  -4.155
   46    HA   LYS   6           HA       LYS   6   1.454   1.018  -5.563
   47   1HB   LYS   6          1HB       LYS   6   1.396   3.980  -6.142
   48   2HB   LYS   6          2HB       LYS   6   2.412   2.770  -6.906
   49   1HG   LYS   6          1HG       LYS   6  -0.064   1.783  -7.426
   50   2HG   LYS   6          2HG       LYS   6  -0.359   3.523  -7.459
   51   1HD   LYS   6          1HD       LYS   6   2.081   2.798  -8.853
   52   2HD   LYS   6          2HD       LYS   6   0.666   1.981  -9.522
   53   1HE   LYS   6          1HE       LYS   6   0.270   3.859 -10.655
   54   2HE   LYS   6          2HE       LYS   6  -0.201   4.575  -9.114
   55   1HZ   LYS   6          1HZ       LYS   6   2.644   4.550  -9.787
   56   2HZ   LYS   6          2HZ       LYS   6   1.655   5.636 -10.626
   57   3HZ   LYS   6          3HZ       LYS   6   1.745   5.704  -8.938
   58    H    VAL   7           H        VAL   7   3.546   1.057  -4.856
   59    HA   VAL   7           HA       VAL   7   4.186   1.496  -2.267
   60    HB   VAL   7           HB       VAL   7   6.076   1.859  -4.602
   61   1HG1  VAL   7          1HG1      VAL   7   6.897   2.709  -2.392
   62   2HG1  VAL   7          2HG1      VAL   7   6.757   1.059  -1.787
   63   3HG1  VAL   7          3HG1      VAL   7   7.868   1.422  -3.108
   64   1HG2  VAL   7          1HG2      VAL   7   4.862  -0.284  -4.617
   65   2HG2  VAL   7          2HG2      VAL   7   6.587  -0.488  -4.337
   66   3HG2  VAL   7          3HG2      VAL   7   5.457  -0.611  -2.990
   67    HA   PRO   8           HA       PRO   8   4.247   5.891  -1.725
   68   1HB   PRO   8          1HB       PRO   8   5.538   6.057   0.633
   69   2HB   PRO   8          2HB       PRO   8   3.879   5.459   0.499
   70   1HG   PRO   8          1HG       PRO   8   6.429   3.919   0.784
   71   2HG   PRO   8          2HG       PRO   8   4.856   3.630   1.548
   72   1HD   PRO   8          1HD       PRO   8   5.761   2.253  -0.631
   73   2HD   PRO   8          2HD       PRO   8   4.042   2.504  -0.277
   74    H    ASP   9           H        ASP   9   6.030   7.471  -0.598
   75    HA   ASP   9           HA       ASP   9   8.324   7.324  -2.407
   76   1HB   ASP   9          1HB       ASP   9   6.631   9.421  -1.402
   77   2HB   ASP   9          2HB       ASP   9   8.313   9.776  -1.020
   78    H    ILE  10           H        ILE  10   9.497   5.766  -1.153
   79    HA   ILE  10           HA       ILE  10  10.238   6.383   1.553
   80    HB   ILE  10           HB       ILE  10  11.908   4.445   1.144
   81   1HG1  ILE  10          1HG1      ILE  10  11.455   2.976  -0.668
   82   2HG1  ILE  10          2HG1      ILE  10   9.985   3.840  -1.100
   83   1HG2  ILE  10          1HG2      ILE  10   9.809   4.385   2.470
   84   2HG2  ILE  10          2HG2      ILE  10   8.955   3.888   1.008
   85   3HG2  ILE  10          3HG2      ILE  10  10.206   2.850   1.696
   86   1HD1  ILE  10          1HD1      ILE  10  11.402   5.776  -1.754
   87   2HD1  ILE  10          2HD1      ILE  10  12.820   4.764  -1.477
   88   3HD1  ILE  10          3HD1      ILE  10  11.652   4.324  -2.725
   89    H    GLY  11           H        GLY  11  11.201   7.792  -1.228
   90   1HA   GLY  11          1HA       GLY  11  13.506   8.949  -0.017
   91   2HA   GLY  11          2HA       GLY  11  12.935   9.242  -1.652
   92    H    GLY  12           H        GLY  12  14.314   6.469   0.140
   93   1HA   GLY  12          1HA       GLY  12  15.802   4.852  -0.586
   94   2HA   GLY  12          2HA       GLY  12  16.781   6.271  -0.918
   95    H    HIS  13           H        HIS  13  14.573   3.920  -2.310
   96    HA   HIS  13           HA       HIS  13  14.561   4.842  -4.948
   97   1HB   HIS  13          1HB       HIS  13  16.238   3.283  -5.950
   98   2HB   HIS  13          2HB       HIS  13  16.954   4.550  -4.960
   99    HD1  HIS  13           HD1      HIS  13  16.381   0.855  -5.061
  100    HD2  HIS  13           HD2      HIS  13  18.259   3.671  -2.651
  101    HE1  HIS  13           HE1      HIS  13  17.789  -0.470  -3.452
  102    HE2  HIS  13           HE2      HIS  13  18.843   1.252  -1.944
  103    H    GLU  14           H        GLU  14  14.479   2.661  -6.476
  104    HA   GLU  14           HA       GLU  14  12.084   1.390  -5.702
  105   1HB   GLU  14          1HB       GLU  14  14.081   0.760  -7.875
  106   2HB   GLU  14          2HB       GLU  14  12.567  -0.113  -7.678
  107   1HG   GLU  14          1HG       GLU  14  11.468   2.213  -7.810
  108   2HG   GLU  14          2HG       GLU  14  13.012   2.729  -8.488
  109    H    ASN  15           H        ASN  15  11.960  -1.119  -5.884
  110    HA   ASN  15           HA       ASN  15  12.199  -3.013  -4.625
  111   1HB   ASN  15          1HB       ASN  15  14.517  -4.012  -4.830
  112   2HB   ASN  15          2HB       ASN  15  13.741  -3.568  -6.346
  113   1HD2  ASN  15          2HD2      ASN  15  16.435  -3.158  -4.336
  114   2HD2  ASN  15          1HD2      ASN  15  17.245  -1.946  -5.263
  115    H    VAL  16           H        VAL  16  11.677  -1.916  -2.619
  116    HA   VAL  16           HA       VAL  16  13.992  -1.803  -0.797
  117    HB   VAL  16           HB       VAL  16  12.858  -0.121   0.535
  118   1HG1  VAL  16          1HG1      VAL  16  13.480   0.351  -2.310
  119   2HG1  VAL  16          2HG1      VAL  16  12.617   1.641  -1.472
  120   3HG1  VAL  16          3HG1      VAL  16  14.172   1.076  -0.859
  121   1HG2  VAL  16          1HG2      VAL  16  10.556  -1.019  -0.712
  122   2HG2  VAL  16          2HG2      VAL  16  10.686   0.353   0.386
  123   3HG2  VAL  16          3HG2      VAL  16  10.785   0.606  -1.356
  124    H    ASP  17           H        ASP  17  12.936  -1.837   1.607
  125    HA   ASP  17           HA       ASP  17  11.357  -4.314   1.636
  126   1HB   ASP  17          1HB       ASP  17  13.519  -3.233   3.358
  127   2HB   ASP  17          2HB       ASP  17  12.255  -4.159   4.161
  128    H    ILE  18           H        ILE  18   9.282  -4.139   2.151
  129    HA   ILE  18           HA       ILE  18   8.022  -1.818   3.027
  130    HB   ILE  18           HB       ILE  18   7.221  -4.720   3.068
  131   1HG1  ILE  18          1HG1      ILE  18   5.825  -2.493   1.638
  132   2HG1  ILE  18          2HG1      ILE  18   7.346  -3.114   1.003
  133   1HG2  ILE  18          1HG2      ILE  18   5.535  -2.416   4.037
  134   2HG2  ILE  18          2HG2      ILE  18   4.940  -4.041   3.699
  135   3HG2  ILE  18          3HG2      ILE  18   6.109  -3.782   4.992
  136   1HD1  ILE  18          1HD1      ILE  18   5.471  -5.225   1.665
  137   2HD1  ILE  18          2HD1      ILE  18   4.841  -4.095   0.466
  138   3HD1  ILE  18          3HD1      ILE  18   6.368  -4.927   0.177
  139    H    ILE  19           H        ILE  19   6.831  -1.584   5.189
  140    HA   ILE  19           HA       ILE  19   8.386  -2.810   7.351
  141    HB   ILE  19           HB       ILE  19   9.333  -0.958   8.147
  142   1HG1  ILE  19          1HG1      ILE  19   7.887   1.364   7.747
  143   2HG1  ILE  19          2HG1      ILE  19   6.635   0.174   8.045
  144   1HG2  ILE  19          1HG2      ILE  19   8.566  -0.102   5.399
  145   2HG2  ILE  19          2HG2      ILE  19   9.392   1.022   6.468
  146   3HG2  ILE  19          3HG2      ILE  19  10.148  -0.515   6.058
  147   1HD1  ILE  19          1HD1      ILE  19   7.965  -0.490  10.096
  148   2HD1  ILE  19          2HD1      ILE  19   8.907   0.977   9.818
  149   3HD1  ILE  19          3HD1      ILE  19   7.174   1.087  10.134
  150    H    ALA  20           H        ALA  20   5.409  -2.443   6.169
  151    HA   ALA  20           HA       ALA  20   4.168  -3.195   8.615
  152   1HB   ALA  20          1HB       ALA  20   4.395  -0.672   8.798
  153   2HB   ALA  20          2HB       ALA  20   3.195  -0.581   7.511
  154   3HB   ALA  20          3HB       ALA  20   2.785  -1.347   9.045
  155    H    VAL  21           H        VAL  21   2.014  -3.906   8.344
  156    HA   VAL  21           HA       VAL  21   0.981  -3.916   5.601
  157    HB   VAL  21           HB       VAL  21   1.238  -6.388   7.324
  158   1HG1  VAL  21          1HG1      VAL  21   0.014  -6.000   4.594
  159   2HG1  VAL  21          2HG1      VAL  21   0.321  -7.564   5.348
  160   3HG1  VAL  21          3HG1      VAL  21  -0.828  -6.445   6.079
  161   1HG2  VAL  21          1HG2      VAL  21   3.330  -5.567   6.201
  162   2HG2  VAL  21          2HG2      VAL  21   2.818  -7.190   5.734
  163   3HG2  VAL  21          3HG2      VAL  21   2.519  -5.826   4.656
  164    H    GLU  22           H        GLU  22  -1.054  -3.222   5.605
  165    HA   GLU  22           HA       GLU  22  -2.879  -4.080   7.703
  166   1HB   GLU  22          1HB       GLU  22  -2.083  -1.224   7.227
  167   2HB   GLU  22          2HB       GLU  22  -3.679  -1.615   7.852
  168   1HG   GLU  22          1HG       GLU  22  -1.064  -2.393   9.124
  169   2HG   GLU  22          2HG       GLU  22  -2.100  -1.059   9.630
  170    H    VAL  23           H        VAL  23  -3.212  -5.148   5.421
  171    HA   VAL  23           HA       VAL  23  -5.492  -3.754   4.234
  172    HB   VAL  23           HB       VAL  23  -4.665  -4.614   1.956
  173   1HG1  VAL  23          1HG1      VAL  23  -4.870  -2.254   2.515
  174   2HG1  VAL  23          2HG1      VAL  23  -3.289  -2.288   3.294
  175   3HG1  VAL  23          3HG1      VAL  23  -3.419  -2.540   1.554
  176   1HG2  VAL  23          1HG2      VAL  23  -2.122  -4.685   3.562
  177   2HG2  VAL  23          2HG2      VAL  23  -2.829  -5.970   2.583
  178   3HG2  VAL  23          3HG2      VAL  23  -2.142  -4.545   1.804
  179    H    ASN  24           H        ASN  24  -7.128  -5.074   4.504
  180    HA   ASN  24           HA       ASN  24  -6.706  -7.946   4.019
  181   1HB   ASN  24          1HB       ASN  24  -8.774  -6.787   5.883
  182   2HB   ASN  24          2HB       ASN  24  -8.330  -8.479   5.686
  183   1HD2  ASN  24          2HD2      ASN  24  -6.680  -9.294   6.838
  184   2HD2  ASN  24          1HD2      ASN  24  -5.713  -8.383   7.943
  185    H    VAL  25           H        VAL  25  -7.350  -8.017   1.953
  186    HA   VAL  25           HA       VAL  25  -9.227  -6.686   0.548
  187    HB   VAL  25           HB       VAL  25  -8.805  -9.673   0.391
  188   1HG1  VAL  25          1HG1      VAL  25 -10.835  -8.790  -0.778
  189   2HG1  VAL  25          2HG1      VAL  25  -9.761  -7.805  -1.769
  190   3HG1  VAL  25          3HG1      VAL  25  -9.655  -9.564  -1.835
  191   1HG2  VAL  25          1HG2      VAL  25  -7.036  -7.516  -0.126
  192   2HG2  VAL  25          2HG2      VAL  25  -6.778  -9.238  -0.402
  193   3HG2  VAL  25          3HG2      VAL  25  -7.481  -8.237  -1.672
  194    H    GLY  26           H        GLY  26 -11.277  -6.193   0.924
  195   1HA   GLY  26          1HA       GLY  26 -13.000  -8.242   2.173
  196   2HA   GLY  26          2HA       GLY  26 -13.563  -7.106   0.957
  197    H    ASP  27           H        ASP  27 -11.722  -5.095   2.500
  198    HA   ASP  27           HA       ASP  27 -13.707  -4.491   4.594
  199   1HB   ASP  27          1HB       ASP  27 -10.796  -4.654   4.705
  200   2HB   ASP  27          2HB       ASP  27 -11.405  -3.114   5.302
  201    H    THR  28           H        THR  28 -14.156  -2.264   4.989
  202    HA   THR  28           HA       THR  28 -14.332  -0.715   2.610
  203    HB   THR  28           HB       THR  28 -14.781   0.327   5.403
  204    HG1  THR  28           HG1      THR  28 -16.070  -1.363   5.507
  205   1HG2  THR  28          1HG2      THR  28 -15.345   1.320   2.771
  206   2HG2  THR  28          2HG2      THR  28 -16.835   1.100   3.687
  207   3HG2  THR  28          3HG2      THR  28 -15.542   2.106   4.338
  208    H    ILE  29           H        ILE  29 -13.315   1.213   2.067
  209    HA   ILE  29           HA       ILE  29 -11.023   2.019   3.705
  210    HB   ILE  29           HB       ILE  29  -9.659   2.308   1.635
  211   1HG1  ILE  29          1HG1      ILE  29 -11.318   0.338   0.179
  212   2HG1  ILE  29          2HG1      ILE  29 -11.985   1.962   0.289
  213   1HG2  ILE  29          1HG2      ILE  29 -10.426  -0.212   2.897
  214   2HG2  ILE  29          2HG2      ILE  29  -9.678  -0.403   1.312
  215   3HG2  ILE  29          3HG2      ILE  29  -8.827   0.465   2.590
  216   1HD1  ILE  29          1HD1      ILE  29  -9.212   1.391  -0.706
  217   2HD1  ILE  29          2HD1      ILE  29 -10.626   1.487  -1.760
  218   3HD1  ILE  29          3HD1      ILE  29 -10.120   2.896  -0.829
  219    H    ALA  30           H        ALA  30 -10.272   4.166   3.324
  220    HA   ALA  30           HA       ALA  30 -12.112   5.884   1.812
  221   1HB   ALA  30          1HB       ALA  30 -11.099   6.644   4.540
  222   2HB   ALA  30          2HB       ALA  30 -12.356   7.426   3.583
  223   3HB   ALA  30          3HB       ALA  30 -12.646   5.837   4.289
  224    H    VAL  31           H        VAL  31 -11.064   8.298   2.141
  225    HA   VAL  31           HA       VAL  31  -8.444   8.034   0.898
  226    HB   VAL  31           HB       VAL  31 -10.013  10.579   1.268
  227   1HG1  VAL  31          1HG1      VAL  31  -7.660   9.736  -0.366
  228   2HG1  VAL  31          2HG1      VAL  31  -8.716  11.022  -0.950
  229   3HG1  VAL  31          3HG1      VAL  31  -7.893  11.193   0.600
  230   1HG2  VAL  31          1HG2      VAL  31 -10.845   8.344  -0.191
  231   2HG2  VAL  31          2HG2      VAL  31 -11.475   9.989  -0.303
  232   3HG2  VAL  31          3HG2      VAL  31 -10.184   9.464  -1.383
  233    H    ASP  32           H        ASP  32  -8.256   7.383   3.518
  234    HA   ASP  32           HA       ASP  32  -6.200   8.942   4.484
  235   1HB   ASP  32          1HB       ASP  32  -7.478   9.992   6.487
  236   2HB   ASP  32          2HB       ASP  32  -7.525  10.811   4.929
  237    H    ASP  33           H        ASP  33  -6.002   6.471   4.546
  238    HA   ASP  33           HA       ASP  33  -6.243   5.672   7.318
  239   1HB   ASP  33          1HB       ASP  33  -7.162   3.356   6.345
  240   2HB   ASP  33          2HB       ASP  33  -8.236   4.639   6.890
  241    H    THR  34           H        THR  34  -4.186   5.196   7.709
  242    HA   THR  34           HA       THR  34  -2.207   4.538   5.956
  243    HB   THR  34           HB       THR  34  -1.395   3.134   8.101
  244    HG1  THR  34           HG1      THR  34  -3.144   3.412   9.376
  245   1HG2  THR  34          1HG2      THR  34  -0.224   5.042   7.141
  246   2HG2  THR  34          2HG2      THR  34  -1.382   6.129   7.911
  247   3HG2  THR  34          3HG2      THR  34  -0.311   5.138   8.901
  248    H    LEU  35           H        LEU  35  -1.908   2.962   4.590
  249    HA   LEU  35           HA       LEU  35  -3.269   0.409   4.995
  250   1HB   LEU  35          1HB       LEU  35  -1.829   1.584   2.616
  251   2HB   LEU  35          2HB       LEU  35  -2.484  -0.042   2.646
  252    HG   LEU  35           HG       LEU  35  -3.991   2.562   2.711
  253   1HD1  LEU  35          1HD1      LEU  35  -3.986   0.177   0.872
  254   2HD1  LEU  35          2HD1      LEU  35  -5.149   1.500   0.781
  255   3HD1  LEU  35          3HD1      LEU  35  -3.435   1.812   0.510
  256   1HD2  LEU  35          1HD2      LEU  35  -4.768  -0.088   3.750
  257   2HD2  LEU  35          2HD2      LEU  35  -5.357   1.519   4.176
  258   3HD2  LEU  35          3HD2      LEU  35  -5.948   0.722   2.719
  259    H    ILE  36           H        ILE  36  -0.061   1.804   4.589
  260    HA   ILE  36           HA       ILE  36   1.130  -0.344   6.067
  261    HB   ILE  36           HB       ILE  36   2.825  -0.911   4.289
  262   1HG1  ILE  36          1HG1      ILE  36   2.509  -0.455   2.045
  263   2HG1  ILE  36          2HG1      ILE  36   0.787  -0.144   2.234
  264   1HG2  ILE  36          1HG2      ILE  36   0.634  -2.150   5.016
  265   2HG2  ILE  36          2HG2      ILE  36   0.177  -1.834   3.344
  266   3HG2  ILE  36          3HG2      ILE  36   1.642  -2.753   3.701
  267   1HD1  ILE  36          1HD1      ILE  36   2.976   1.694   3.173
  268   2HD1  ILE  36          2HD1      ILE  36   2.109   1.851   1.644
  269   3HD1  ILE  36          3HD1      ILE  36   1.244   2.022   3.171
  270    H    THR  37           H        THR  37   3.714  -0.063   5.726
  271    HA   THR  37           HA       THR  37   4.388   2.765   5.591
  272    HB   THR  37           HB       THR  37   4.927   1.018   7.998
  273    HG1  THR  37           HG1      THR  37   3.246   1.985   8.743
  274   1HG2  THR  37          1HG2      THR  37   6.696   2.849   7.111
  275   2HG2  THR  37          2HG2      THR  37   5.650   3.856   8.111
  276   3HG2  THR  37          3HG2      THR  37   6.447   2.447   8.811
  277    H    LEU  38           H        LEU  38   5.876   2.756   4.048
  278    HA   LEU  38           HA       LEU  38   7.713   0.510   3.794
  279   1HB   LEU  38          1HB       LEU  38   6.351   1.714   1.909
  280   2HB   LEU  38          2HB       LEU  38   7.678   2.856   1.957
  281    HG   LEU  38           HG       LEU  38   9.104   0.611   1.741
  282   1HD1  LEU  38          1HD1      LEU  38   7.004  -0.748   1.765
  283   2HD1  LEU  38          2HD1      LEU  38   6.590  -0.022   0.213
  284   3HD1  LEU  38          3HD1      LEU  38   8.041  -1.015   0.363
  285   1HD2  LEU  38          1HD2      LEU  38   8.024   2.591  -0.110
  286   2HD2  LEU  38          2HD2      LEU  38   9.665   1.963   0.049
  287   3HD2  LEU  38          3HD2      LEU  38   8.469   1.072  -0.889
  288    H    GLU  39           H        GLU  39   9.992   0.830   3.503
  289    HA   GLU  39           HA       GLU  39  11.242   3.328   4.054
  290   1HB   GLU  39          1HB       GLU  39  10.556   2.831   6.338
  291   2HB   GLU  39          2HB       GLU  39  11.295   1.239   6.239
  292   1HG   GLU  39          1HG       GLU  39  13.474   2.530   5.754
  293   2HG   GLU  39          2HG       GLU  39  12.609   3.916   6.416
  294    H    THR  40           H        THR  40  13.427   3.298   3.601
  295    HA   THR  40           HA       THR  40  14.415   0.777   2.463
  296    HB   THR  40           HB       THR  40  15.698   2.023   0.955
  297    HG1  THR  40           HG1      THR  40  16.012   4.312   1.276
  298   1HG2  THR  40          1HG2      THR  40  13.002   2.660   1.134
  299   2HG2  THR  40          2HG2      THR  40  13.826   4.206   0.930
  300   3HG2  THR  40          3HG2      THR  40  14.070   2.916  -0.247
  301    H    ASP  41           H        ASP  41  15.722   3.654   4.087
  302    HA   ASP  41           HA       ASP  41  17.011   2.227   6.142
  303   1HB   ASP  41          1HB       ASP  41  19.382   2.634   5.393
  304   2HB   ASP  41          2HB       ASP  41  18.526   1.388   4.491
  305    H    LYS  42           H        LYS  42  17.004   5.091   4.086
  306    HA   LYS  42           HA       LYS  42  17.474   6.720   6.496
  307   1HB   LYS  42          1HB       LYS  42  19.023   6.621   4.125
  308   2HB   LYS  42          2HB       LYS  42  18.183   8.165   4.125
  309   1HG   LYS  42          1HG       LYS  42  20.182   8.620   5.211
  310   2HG   LYS  42          2HG       LYS  42  19.032   8.405   6.533
  311   1HD   LYS  42          1HD       LYS  42  20.304   6.790   7.377
  312   2HD   LYS  42          2HD       LYS  42  20.116   5.860   5.889
  313   1HE   LYS  42          1HE       LYS  42  22.444   6.133   6.212
  314   2HE   LYS  42          2HE       LYS  42  21.988   7.250   4.926
  315   1HZ   LYS  42          1HZ       LYS  42  21.873   8.367   7.588
  316   2HZ   LYS  42          2HZ       LYS  42  23.426   7.921   7.089
  317   3HZ   LYS  42          3HZ       LYS  42  22.523   9.016   6.168
  318    H    ALA  43           H        ALA  43  14.933   5.868   5.504
  319    HA   ALA  43           HA       ALA  43  13.485   8.237   5.623
  320   1HB   ALA  43          1HB       ALA  43  14.376   7.510   2.917
  321   2HB   ALA  43          2HB       ALA  43  12.661   7.894   3.069
  322   3HB   ALA  43          3HB       ALA  43  13.876   9.070   3.570
  323    H    THR  44           H        THR  44  11.455   7.744   6.180
  324    HA   THR  44           HA       THR  44  10.451   5.057   5.502
  325    HB   THR  44           HB       THR  44   9.189   5.139   7.638
  326    HG1  THR  44           HG1      THR  44   9.457   7.572   7.674
  327   1HG2  THR  44          1HG2      THR  44  12.167   5.305   7.702
  328   2HG2  THR  44          2HG2      THR  44  11.243   5.141   9.195
  329   3HG2  THR  44          3HG2      THR  44  11.115   3.910   7.940
  330    H    MET  45           H        MET  45   8.808   5.145   4.123
  331    HA   MET  45           HA       MET  45   6.911   7.389   4.362
  332   1HB   MET  45          1HB       MET  45   8.552   7.024   2.236
  333   2HB   MET  45          2HB       MET  45   7.149   6.100   1.718
  334   1HG   MET  45          1HG       MET  45   7.259   9.010   2.463
  335   2HG   MET  45          2HG       MET  45   6.933   8.315   0.878
  336   1HE   MET  45          1HE       MET  45   5.761  10.295   3.121
  337   2HE   MET  45          2HE       MET  45   4.006  10.222   2.967
  338   3HE   MET  45          3HE       MET  45   4.805   9.425   4.321
  339    H    ASP  46           H        ASP  46   4.857   6.854   4.673
  340    HA   ASP  46           HA       ASP  46   4.058   4.058   4.204
  341   1HB   ASP  46          1HB       ASP  46   2.240   4.651   5.943
  342   2HB   ASP  46          2HB       ASP  46   3.883   4.390   6.521
  343    H    VAL  47           H        VAL  47   1.533   3.918   4.015
  344    HA   VAL  47           HA       VAL  47   0.682   6.025   2.135
  345    HB   VAL  47           HB       VAL  47   0.100   3.065   1.996
  346   1HG1  VAL  47          1HG1      VAL  47  -1.344   5.348   0.901
  347   2HG1  VAL  47          2HG1      VAL  47  -0.837   4.196  -0.336
  348   3HG1  VAL  47          3HG1      VAL  47  -1.826   3.657   1.021
  349   1HG2  VAL  47          1HG2      VAL  47   2.331   3.826   1.197
  350   2HG2  VAL  47          2HG2      VAL  47   1.332   3.101  -0.063
  351   3HG2  VAL  47          3HG2      VAL  47   1.511   4.854   0.022
  352    HA   PRO  48           HA       PRO  48  -2.694   6.182   5.115
  353   1HB   PRO  48          1HB       PRO  48  -3.513   8.654   4.572
  354   2HB   PRO  48          2HB       PRO  48  -1.973   8.372   5.395
  355   1HG   PRO  48          1HG       PRO  48  -2.498   9.084   2.545
  356   2HG   PRO  48          2HG       PRO  48  -1.188   9.616   3.612
  357   1HD   PRO  48          1HD       PRO  48  -1.023   7.576   1.705
  358   2HD   PRO  48          2HD       PRO  48   0.120   7.853   3.032
  359    H    ALA  49           H        ALA  49  -3.021   4.854   2.514
  360    HA   ALA  49           HA       ALA  49  -4.604   4.308   0.962
  361   1HB   ALA  49          1HB       ALA  49  -6.984   4.401   1.972
  362   2HB   ALA  49          2HB       ALA  49  -5.787   3.321   2.687
  363   3HB   ALA  49          3HB       ALA  49  -6.152   4.867   3.454
  364    H    GLU  50           H        GLU  50  -4.357   5.852  -0.619
  365    HA   GLU  50           HA       GLU  50  -5.849   8.337  -0.388
  366   1HB   GLU  50          1HB       GLU  50  -3.397   7.764  -1.486
  367   2HB   GLU  50          2HB       GLU  50  -4.433   7.848  -2.903
  368   1HG   GLU  50          1HG       GLU  50  -4.283  10.003  -0.812
  369   2HG   GLU  50          2HG       GLU  50  -3.309   9.985  -2.281
  370    H    VAL  51           H        VAL  51  -7.762   6.756  -0.386
  371    HA   VAL  51           HA       VAL  51  -9.413   7.202  -2.491
  372    HB   VAL  51           HB       VAL  51  -8.127   6.098  -4.104
  373   1HG1  VAL  51          1HG1      VAL  51  -6.974   4.779  -1.951
  374   2HG1  VAL  51          2HG1      VAL  51  -7.694   3.493  -2.925
  375   3HG1  VAL  51          3HG1      VAL  51  -6.542   4.613  -3.651
  376   1HG2  VAL  51          1HG2      VAL  51 -10.543   5.280  -3.910
  377   2HG2  VAL  51          2HG2      VAL  51  -9.433   4.312  -4.881
  378   3HG2  VAL  51          3HG2      VAL  51  -9.857   3.795  -3.249
  379    H    ALA  52           H        ALA  52 -11.426   6.186  -2.260
  380    HA   ALA  52           HA       ALA  52 -11.762   4.746   0.266
  381   1HB   ALA  52          1HB       ALA  52 -13.118   6.848  -0.560
  382   2HB   ALA  52          2HB       ALA  52 -13.910   5.559   0.347
  383   3HB   ALA  52          3HB       ALA  52 -14.066   5.624  -1.410
  384    H    GLY  53           H        GLY  53 -14.100   3.391  -0.162
  385   1HA   GLY  53          1HA       GLY  53 -13.629   1.654  -2.482
  386   2HA   GLY  53          2HA       GLY  53 -15.133   1.774  -1.592
  387    H    VAL  54           H        VAL  54 -13.480  -0.544  -2.370
  388    HA   VAL  54           HA       VAL  54 -12.713  -1.624   0.249
  389    HB   VAL  54           HB       VAL  54 -14.602  -2.989  -1.679
  390   1HG1  VAL  54          1HG1      VAL  54 -12.977  -4.493  -0.508
  391   2HG1  VAL  54          2HG1      VAL  54 -13.671  -3.955   1.021
  392   3HG1  VAL  54          3HG1      VAL  54 -14.671  -4.821  -0.145
  393   1HG2  VAL  54          1HG2      VAL  54 -15.055  -1.843   1.075
  394   2HG2  VAL  54          2HG2      VAL  54 -15.740  -1.261  -0.441
  395   3HG2  VAL  54          3HG2      VAL  54 -16.217  -2.836   0.194
  396    H    VAL  55           H        VAL  55 -10.956  -2.951   0.172
  397    HA   VAL  55           HA       VAL  55  -9.434  -3.063  -2.214
  398    HB   VAL  55           HB       VAL  55  -9.028  -4.663   0.314
  399   1HG1  VAL  55          1HG1      VAL  55  -7.849  -5.552  -1.682
  400   2HG1  VAL  55          2HG1      VAL  55  -7.064  -3.984  -1.880
  401   3HG1  VAL  55          3HG1      VAL  55  -6.748  -4.952  -0.441
  402   1HG2  VAL  55          1HG2      VAL  55  -9.061  -2.048   0.350
  403   2HG2  VAL  55          2HG2      VAL  55  -7.779  -2.929   1.180
  404   3HG2  VAL  55          3HG2      VAL  55  -7.474  -2.214  -0.403
  405    H    LYS  56           H        LYS  56  -8.874  -4.768  -3.508
  406    HA   LYS  56           HA       LYS  56 -10.629  -7.134  -3.371
  407   1HB   LYS  56          1HB       LYS  56  -9.508  -6.764  -5.994
  408   2HB   LYS  56          2HB       LYS  56 -11.198  -6.873  -5.524
  409   1HG   LYS  56          1HG       LYS  56  -9.746  -4.293  -5.164
  410   2HG   LYS  56          2HG       LYS  56 -10.297  -4.771  -6.769
  411   1HD   LYS  56          1HD       LYS  56 -12.040  -4.560  -4.314
  412   2HD   LYS  56          2HD       LYS  56 -11.942  -3.359  -5.604
  413   1HE   LYS  56          1HE       LYS  56 -13.607  -4.463  -6.591
  414   2HE   LYS  56          2HE       LYS  56 -12.429  -5.726  -6.945
  415   1HZ   LYS  56          1HZ       LYS  56 -13.522  -5.900  -4.294
  416   2HZ   LYS  56          2HZ       LYS  56 -14.695  -6.054  -5.503
  417   3HZ   LYS  56          3HZ       LYS  56 -13.362  -7.097  -5.477
  418    H    GLU  57           H        GLU  57  -7.541  -5.892  -4.568
  419    HA   GLU  57           HA       GLU  57  -6.409  -8.527  -4.038
  420   1HB   GLU  57          1HB       GLU  57  -6.035  -6.667  -6.323
  421   2HB   GLU  57          2HB       GLU  57  -4.643  -7.610  -5.805
  422   1HG   GLU  57          1HG       GLU  57  -5.456  -9.507  -6.659
  423   2HG   GLU  57          2HG       GLU  57  -7.094  -9.174  -6.096
  424    H    VAL  58           H        VAL  58  -4.008  -8.471  -3.660
  425    HA   VAL  58           HA       VAL  58  -2.947  -6.019  -2.521
  426    HB   VAL  58           HB       VAL  58  -4.141  -6.881  -0.605
  427   1HG1  VAL  58          1HG1      VAL  58  -3.473  -9.395  -1.690
  428   2HG1  VAL  58          2HG1      VAL  58  -2.745  -9.314  -0.086
  429   3HG1  VAL  58          3HG1      VAL  58  -4.477  -9.047  -0.282
  430   1HG2  VAL  58          1HG2      VAL  58  -1.311  -6.551  -0.708
  431   2HG2  VAL  58          2HG2      VAL  58  -2.423  -6.172   0.608
  432   3HG2  VAL  58          3HG2      VAL  58  -1.699  -7.777   0.500
  433    H    LYS  59           H        LYS  59  -0.765  -5.951  -2.605
  434    HA   LYS  59           HA       LYS  59   0.720  -8.414  -3.153
  435   1HB   LYS  59          1HB       LYS  59   1.354  -5.988  -4.776
  436   2HB   LYS  59          2HB       LYS  59   1.653  -7.681  -5.142
  437   1HG   LYS  59          1HG       LYS  59  -1.169  -6.732  -5.013
  438   2HG   LYS  59          2HG       LYS  59  -0.190  -6.307  -6.415
  439   1HD   LYS  59          1HD       LYS  59   0.223  -8.614  -6.907
  440   2HD   LYS  59          2HD       LYS  59  -0.541  -9.121  -5.398
  441   1HE   LYS  59          1HE       LYS  59  -2.623  -8.910  -6.233
  442   2HE   LYS  59          2HE       LYS  59  -2.220  -7.457  -7.147
  443   1HZ   LYS  59          1HZ       LYS  59  -0.859  -9.594  -8.312
  444   2HZ   LYS  59          2HZ       LYS  59  -2.456 -10.098  -8.074
  445   3HZ   LYS  59          3HZ       LYS  59  -2.137  -8.695  -8.963
  446    H    VAL  60           H        VAL  60   0.929  -7.524  -0.763
  447    HA   VAL  60           HA       VAL  60   3.589  -6.438  -0.598
  448    HB   VAL  60           HB       VAL  60   2.826  -4.301  -0.530
  449   1HG1  VAL  60          1HG1      VAL  60   0.510  -4.885  -1.033
  450   2HG1  VAL  60          2HG1      VAL  60   0.219  -5.214   0.676
  451   3HG1  VAL  60          3HG1      VAL  60   0.603  -3.576   0.147
  452   1HG2  VAL  60          1HG2      VAL  60   3.550  -5.104   1.895
  453   2HG2  VAL  60          2HG2      VAL  60   3.016  -3.456   1.574
  454   3HG2  VAL  60          3HG2      VAL  60   1.894  -4.626   2.269
  455    H    LYS  61           H        LYS  61   4.611  -6.923   1.294
  456    HA   LYS  61           HA       LYS  61   3.110  -8.120   3.488
  457   1HB   LYS  61          1HB       LYS  61   5.257  -9.586   1.944
  458   2HB   LYS  61          2HB       LYS  61   4.650 -10.101   3.510
  459   1HG   LYS  61          1HG       LYS  61   2.676  -9.659   1.341
  460   2HG   LYS  61          2HG       LYS  61   3.711 -11.084   1.248
  461   1HD   LYS  61          1HD       LYS  61   2.663 -10.741   3.914
  462   2HD   LYS  61          2HD       LYS  61   1.358 -10.796   2.726
  463   1HE   LYS  61          1HE       LYS  61   3.362 -12.798   2.169
  464   2HE   LYS  61          2HE       LYS  61   2.747 -12.959   3.814
  465   1HZ   LYS  61          1HZ       LYS  61   0.833 -12.591   1.620
  466   2HZ   LYS  61          2HZ       LYS  61   1.546 -14.112   1.826
  467   3HZ   LYS  61          3HZ       LYS  61   0.647 -13.422   3.082
  468    H    VAL  62           H        VAL  62   5.040  -9.041   5.081
  469    HA   VAL  62           HA       VAL  62   6.624  -6.641   5.635
  470    HB   VAL  62           HB       VAL  62   6.082  -9.027   7.409
  471   1HG1  VAL  62          1HG1      VAL  62   8.181  -7.883   7.937
  472   2HG1  VAL  62          2HG1      VAL  62   7.314  -6.351   8.055
  473   3HG1  VAL  62          3HG1      VAL  62   6.978  -7.646   9.205
  474   1HG2  VAL  62          1HG2      VAL  62   4.791  -6.313   7.246
  475   2HG2  VAL  62          2HG2      VAL  62   4.024  -7.893   7.084
  476   3HG2  VAL  62          3HG2      VAL  62   4.644  -7.371   8.650
  477    H    GLY  63           H        GLY  63   8.381  -6.883   4.258
  478   1HA   GLY  63          1HA       GLY  63  10.146  -9.164   4.900
  479   2HA   GLY  63          2HA       GLY  63  10.729  -7.547   4.534
  480    H    ASP  64           H        ASP  64   8.937  -7.093   2.322
  481    HA   ASP  64           HA       ASP  64  10.066  -8.995   0.374
  482   1HB   ASP  64          1HB       ASP  64   8.071  -8.392  -1.059
  483   2HB   ASP  64          2HB       ASP  64   7.703  -9.323   0.390
  484    H    LYS  65           H        LYS  65  10.059  -7.976  -1.913
  485    HA   LYS  65           HA       LYS  65  11.454  -5.418  -1.687
  486   1HB   LYS  65          1HB       LYS  65  11.678  -7.759  -3.407
  487   2HB   LYS  65          2HB       LYS  65  11.674  -6.255  -4.320
  488   1HG   LYS  65          1HG       LYS  65  13.863  -6.216  -3.906
  489   2HG   LYS  65          2HG       LYS  65  13.402  -5.678  -2.289
  490   1HD   LYS  65          1HD       LYS  65  13.168  -8.462  -2.235
  491   2HD   LYS  65          2HD       LYS  65  14.664  -8.137  -3.115
  492   1HE   LYS  65          1HE       LYS  65  15.287  -6.575  -1.233
  493   2HE   LYS  65          2HE       LYS  65  13.909  -7.225  -0.347
  494   1HZ   LYS  65          1HZ       LYS  65  14.988  -9.481  -0.818
  495   2HZ   LYS  65          2HZ       LYS  65  16.388  -8.598  -1.165
  496   3HZ   LYS  65          3HZ       LYS  65  15.687  -8.501   0.371
  497    H    ILE  66           H        ILE  66  10.501  -3.580  -2.246
  498    HA   ILE  66           HA       ILE  66   8.325  -3.671  -4.213
  499    HB   ILE  66           HB       ILE  66   7.967  -3.173  -1.503
  500   1HG1  ILE  66          1HG1      ILE  66   5.659  -2.604  -2.192
  501   2HG1  ILE  66          2HG1      ILE  66   6.218  -2.475  -3.859
  502   1HG2  ILE  66          1HG2      ILE  66   7.927  -0.549  -2.972
  503   2HG2  ILE  66          2HG2      ILE  66   7.031  -0.839  -1.484
  504   3HG2  ILE  66          3HG2      ILE  66   8.788  -0.958  -1.492
  505   1HD1  ILE  66          1HD1      ILE  66   7.122  -4.953  -3.002
  506   2HD1  ILE  66          2HD1      ILE  66   5.492  -4.807  -2.341
  507   3HD1  ILE  66          3HD1      ILE  66   5.760  -4.627  -4.075
  508    H    SER  67           H        SER  67   7.888  -1.568  -5.263
  509    HA   SER  67           HA       SER  67  10.212   0.225  -5.274
  510   1HB   SER  67          1HB       SER  67  10.382   0.217  -7.650
  511   2HB   SER  67          2HB       SER  67  10.312  -1.475  -7.160
  512    HG   SER  67           HG       SER  67   8.827  -1.404  -8.711
  513    H    GLU  68           H        GLU  68   9.674   2.296  -5.157
  514    HA   GLU  68           HA       GLU  68   7.242   3.354  -4.654
  515   1HB   GLU  68          1HB       GLU  68   9.371   4.741  -6.292
  516   2HB   GLU  68          2HB       GLU  68   8.101   5.523  -5.363
  517   1HG   GLU  68          1HG       GLU  68   9.062   4.666  -3.300
  518   2HG   GLU  68          2HG       GLU  68  10.318   3.839  -4.218
  519    H    GLY  69           H        GLY  69   5.372   3.251  -5.729
  520   1HA   GLY  69          1HA       GLY  69   5.296   4.048  -8.522
  521   2HA   GLY  69          2HA       GLY  69   3.913   3.809  -7.469
  522    H    GLY  70           H        GLY  70   3.698   1.365  -6.748
  523   1HA   GLY  70          1HA       GLY  70   4.376  -0.903  -7.702
  524   2HA   GLY  70          2HA       GLY  70   3.901  -0.198  -9.242
  525    H    LEU  71           H        LEU  71   2.710  -2.517  -8.373
  526    HA   LEU  71           HA       LEU  71  -0.013  -1.565  -7.823
  527   1HB   LEU  71          1HB       LEU  71   0.517  -2.853  -9.957
  528   2HB   LEU  71          2HB       LEU  71   0.735  -4.261  -8.934
  529    HG   LEU  71           HG       LEU  71  -1.544  -4.308  -8.316
  530   1HD1  LEU  71          1HD1      LEU  71  -1.477  -1.467  -9.097
  531   2HD1  LEU  71          2HD1      LEU  71  -2.968  -2.333  -9.469
  532   3HD1  LEU  71          3HD1      LEU  71  -2.374  -2.274  -7.808
  533   1HD2  LEU  71          1HD2      LEU  71  -0.758  -4.384 -11.010
  534   2HD2  LEU  71          2HD2      LEU  71  -2.161  -5.156 -10.271
  535   3HD2  LEU  71          3HD2      LEU  71  -2.307  -3.543 -10.969
  536    H    ILE  72           H        ILE  72   0.104  -1.488  -5.596
  537    HA   ILE  72           HA       ILE  72   0.890  -3.858  -4.131
  538    HB   ILE  72           HB       ILE  72   0.341  -1.021  -3.441
  539   1HG1  ILE  72          1HG1      ILE  72   2.309  -2.691  -1.998
  540   2HG1  ILE  72          2HG1      ILE  72   2.569  -2.506  -3.730
  541   1HG2  ILE  72          1HG2      ILE  72  -0.407  -3.276  -1.658
  542   2HG2  ILE  72          2HG2      ILE  72   0.514  -1.957  -0.932
  543   3HG2  ILE  72          3HG2      ILE  72  -1.028  -1.626  -1.720
  544   1HD1  ILE  72          1HD1      ILE  72   1.951   0.009  -2.439
  545   2HD1  ILE  72          2HD1      ILE  72   3.378  -0.773  -1.757
  546   3HD1  ILE  72          3HD1      ILE  72   3.301  -0.432  -3.484
  547    H    VAL  73           H        VAL  73  -1.929  -1.788  -3.456
  548    HA   VAL  73           HA       VAL  73  -3.579  -4.230  -3.470
  549    HB   VAL  73           HB       VAL  73  -4.866  -3.385  -1.613
  550   1HG1  VAL  73          1HG1      VAL  73  -2.193  -4.197  -1.469
  551   2HG1  VAL  73          2HG1      VAL  73  -2.355  -2.879  -0.307
  552   3HG1  VAL  73          3HG1      VAL  73  -3.412  -4.286  -0.198
  553   1HG2  VAL  73          1HG2      VAL  73  -4.719  -0.999  -2.131
  554   2HG2  VAL  73          2HG2      VAL  73  -4.282  -1.320  -0.452
  555   3HG2  VAL  73          3HG2      VAL  73  -3.023  -0.996  -1.643
  556    H    VAL  74           H        VAL  74  -5.478  -4.178  -4.495
  557    HA   VAL  74           HA       VAL  74  -6.230  -1.681  -5.861
  558    HB   VAL  74           HB       VAL  74  -7.117  -4.505  -6.463
  559   1HG1  VAL  74          1HG1      VAL  74  -8.528  -2.456  -7.163
  560   2HG1  VAL  74          2HG1      VAL  74  -7.250  -2.184  -8.347
  561   3HG1  VAL  74          3HG1      VAL  74  -8.164  -3.692  -8.368
  562   1HG2  VAL  74          1HG2      VAL  74  -4.639  -4.009  -6.760
  563   2HG2  VAL  74          2HG2      VAL  74  -5.500  -4.637  -8.164
  564   3HG2  VAL  74          3HG2      VAL  74  -5.128  -2.917  -8.056
  565    H    VAL  75           H        VAL  75  -8.333  -0.885  -5.724
  566    HA   VAL  75           HA       VAL  75 -10.095  -2.236  -3.806
  567    HB   VAL  75           HB       VAL  75 -10.810   0.063  -3.070
  568   1HG1  VAL  75          1HG1      VAL  75  -8.422  -1.427  -2.388
  569   2HG1  VAL  75          2HG1      VAL  75  -8.274   0.282  -1.986
  570   3HG1  VAL  75          3HG1      VAL  75  -9.612  -0.663  -1.334
  571   1HG2  VAL  75          1HG2      VAL  75  -8.992   0.821  -5.116
  572   2HG2  VAL  75          2HG2      VAL  75 -10.004   1.852  -4.104
  573   3HG2  VAL  75          3HG2      VAL  75  -8.378   1.417  -3.575
  574    H    GLU  76           H        GLU  76 -12.358  -1.448  -3.897
  575    HA   GLU  76           HA       GLU  76 -13.254  -1.414  -6.647
  576   1HB   GLU  76          1HB       GLU  76 -14.447  -2.872  -5.185
  577   2HB   GLU  76          2HB       GLU  76 -14.683  -1.602  -3.992
  578   1HG   GLU  76          1HG       GLU  76 -16.470  -0.745  -5.059
  579   2HG   GLU  76          2HG       GLU  76 -15.811  -1.076  -6.661
  580    H    ALA  77           H        ALA  77 -12.895   0.796  -4.011
  581    HA   ALA  77           HA       ALA  77 -13.221   3.019  -3.803
  582   1HB   ALA  77          1HB       ALA  77 -13.375   4.297  -6.035
  583   2HB   ALA  77          2HB       ALA  77 -13.022   2.724  -6.754
  584   3HB   ALA  77          3HB       ALA  77 -11.885   3.447  -5.613
  585    H    GLU  78           H        GLU  78 -14.950   3.784  -2.894
  586    HA   GLU  78           HA       GLU  78 -17.142   4.170  -2.412
  587   1HB   GLU  78          1HB       GLU  78 -16.343   5.641  -4.595
  588   2HB   GLU  78          2HB       GLU  78 -17.855   4.927  -5.145
  589   1HG   GLU  78          1HG       GLU  78 -18.866   5.776  -2.981
  590   2HG   GLU  78          2HG       GLU  78 -17.389   6.717  -2.786
  591    H    GLY  79           H        GLY  79 -17.038   1.607  -2.521
  592   1HA   GLY  79          1HA       GLY  79 -18.062  -0.372  -3.115
  593   2HA   GLY  79          2HA       GLY  79 -18.631   0.407  -4.584
  594    H    THR  80           H        THR  80 -20.757   0.609  -4.742
  595    HA   THR  80           HA       THR  80 -22.325   1.073  -2.305
  596    HB   THR  80           HB       THR  80 -22.867   2.765  -3.801
  597    HG1  THR  80           HG1      THR  80 -24.874   2.245  -3.523
  598   1HG2  THR  80          1HG2      THR  80 -22.804   0.732  -6.013
  599   2HG2  THR  80          2HG2      THR  80 -23.379   2.389  -6.197
  600   3HG2  THR  80          3HG2      THR  80 -21.698   2.082  -5.762
  601    H    ALA  81           H        ALA  81 -23.773  -0.370  -1.577
  602    HA   ALA  81           HA       ALA  81 -24.937  -2.311  -1.342
  603   1HB   ALA  81          1HB       ALA  81 -25.169  -2.896  -4.207
  604   2HB   ALA  81          2HB       ALA  81 -25.714  -1.285  -3.737
  605   3HB   ALA  81          3HB       ALA  81 -26.421  -2.710  -2.978

  No H/Q in entry =         605
  Start of MODEL    7
    1    H1   ALA   1           H1       ALA   1 -13.263   6.708  -9.112
    2    H2   ALA   1           H2       ALA   1 -12.170   6.828 -10.430
    3    H3   ALA   1           H3       ALA   1 -13.857   6.967 -10.701
    4    HA   ALA   1           HA       ALA   1 -14.236   4.754 -10.212
    5   1HB   ALA   1          1HB       ALA   1 -13.313   3.820 -12.075
    6   2HB   ALA   1          2HB       ALA   1 -11.710   4.480 -11.751
    7   3HB   ALA   1          3HB       ALA   1 -12.977   5.519 -12.406
    8    H    LEU   2           H        LEU   2 -12.379   2.663 -10.450
    9    HA   LEU   2           HA       LEU   2 -11.718   2.221  -7.748
   10   1HB   LEU   2          1HB       LEU   2 -11.001   0.815 -10.303
   11   2HB   LEU   2          2HB       LEU   2 -10.354   0.284  -8.762
   12    HG   LEU   2           HG       LEU   2 -13.043   0.436  -8.233
   13   1HD1  LEU   2          1HD1      LEU   2 -12.914   0.575 -10.984
   14   2HD1  LEU   2          2HD1      LEU   2 -13.205  -1.137 -10.668
   15   3HD1  LEU   2          3HD1      LEU   2 -14.311   0.079 -10.027
   16   1HD2  LEU   2          1HD2      LEU   2 -11.255  -1.824  -9.071
   17   2HD2  LEU   2          2HD2      LEU   2 -11.791  -1.379  -7.450
   18   3HD2  LEU   2          3HD2      LEU   2 -12.931  -2.092  -8.592
   19    H    VAL   3           H        VAL   3  -9.415   1.457  -7.147
   20    HA   VAL   3           HA       VAL   3  -7.370   3.203  -8.309
   21    HB   VAL   3           HB       VAL   3  -8.222   3.168  -5.423
   22   1HG1  VAL   3          1HG1      VAL   3  -5.810   2.757  -5.412
   23   2HG1  VAL   3          2HG1      VAL   3  -5.565   4.162  -6.455
   24   3HG1  VAL   3          3HG1      VAL   3  -6.186   4.378  -4.819
   25   1HG2  VAL   3          1HG2      VAL   3  -7.991   5.178  -7.596
   26   2HG2  VAL   3          2HG2      VAL   3  -9.261   4.950  -6.395
   27   3HG2  VAL   3          3HG2      VAL   3  -7.738   5.711  -5.934
   28    H    GLU   4           H        GLU   4  -5.264   2.464  -8.102
   29    HA   GLU   4           HA       GLU   4  -4.948  -0.238  -6.972
   30   1HB   GLU   4          1HB       GLU   4  -3.291   0.631  -9.302
   31   2HB   GLU   4          2HB       GLU   4  -3.782  -0.987  -8.823
   32   1HG   GLU   4          1HG       GLU   4  -5.082  -0.726 -10.662
   33   2HG   GLU   4          2HG       GLU   4  -6.174  -0.074  -9.441
   34    H    LEU   5           H        LEU   5  -3.887   0.229  -5.109
   35    HA   LEU   5           HA       LEU   5  -1.997   2.301  -4.802
   36   1HB   LEU   5          1HB       LEU   5  -2.489  -0.200  -3.192
   37   2HB   LEU   5          2HB       LEU   5  -1.345   1.039  -2.714
   38    HG   LEU   5           HG       LEU   5  -4.336   1.336  -2.973
   39   1HD1  LEU   5          1HD1      LEU   5  -2.444   0.945  -0.745
   40   2HD1  LEU   5          2HD1      LEU   5  -3.713   2.145  -0.494
   41   3HD1  LEU   5          3HD1      LEU   5  -4.139   0.482  -0.897
   42   1HD2  LEU   5          1HD2      LEU   5  -2.245   3.421  -2.360
   43   2HD2  LEU   5          2HD2      LEU   5  -3.283   3.359  -3.785
   44   3HD2  LEU   5          3HD2      LEU   5  -3.986   3.646  -2.193
   45    H    LYS   6           H        LYS   6   0.126   2.418  -5.207
   46    HA   LYS   6           HA       LYS   6   1.544  -0.070  -5.870
   47   1HB   LYS   6          1HB       LYS   6   2.168   2.462  -7.339
   48   2HB   LYS   6          2HB       LYS   6   2.455   0.797  -7.822
   49   1HG   LYS   6          1HG       LYS   6  -0.320   1.038  -7.591
   50   2HG   LYS   6          2HG       LYS   6   0.225   2.506  -8.404
   51   1HD   LYS   6          1HD       LYS   6   1.252  -0.165  -9.277
   52   2HD   LYS   6          2HD       LYS   6  -0.338   0.387  -9.806
   53   1HE   LYS   6          1HE       LYS   6   1.111   2.589 -10.329
   54   2HE   LYS   6          2HE       LYS   6   2.354   1.357 -10.538
   55   1HZ   LYS   6          1HZ       LYS   6   0.247   0.323 -11.880
   56   2HZ   LYS   6          2HZ       LYS   6   0.091   1.976 -12.201
   57   3HZ   LYS   6          3HZ       LYS   6   1.528   1.173 -12.588
   58    H    VAL   7           H        VAL   7   1.855   0.707  -3.401
   59    HA   VAL   7           HA       VAL   7   3.364   1.309  -1.802
   60    HB   VAL   7           HB       VAL   7   5.329   1.355  -4.090
   61   1HG1  VAL   7          1HG1      VAL   7   6.194   2.343  -2.034
   62   2HG1  VAL   7          2HG1      VAL   7   5.748   0.886  -1.146
   63   3HG1  VAL   7          3HG1      VAL   7   6.992   0.812  -2.393
   64   1HG2  VAL   7          1HG2      VAL   7   3.872  -0.736  -3.787
   65   2HG2  VAL   7          2HG2      VAL   7   5.620  -0.944  -3.881
   66   3HG2  VAL   7          3HG2      VAL   7   4.808  -0.998  -2.316
   67    HA   PRO   8           HA       PRO   8   3.731   5.731  -2.163
   68   1HB   PRO   8          1HB       PRO   8   4.451   6.280   0.355
   69   2HB   PRO   8          2HB       PRO   8   2.851   5.629  -0.025
   70   1HG   PRO   8          1HG       PRO   8   5.166   4.299   1.248
   71   2HG   PRO   8          2HG       PRO   8   3.443   3.921   1.377
   72   1HD   PRO   8          1HD       PRO   8   5.414   2.673  -0.283
   73   2HD   PRO   8          2HD       PRO   8   3.687   2.284  -0.164
   74    H    ASP   9           H        ASP   9   5.321   7.500  -1.309
   75    HA   ASP   9           HA       ASP   9   7.802   7.121  -2.599
   76   1HB   ASP   9          1HB       ASP   9   6.410   9.260  -1.186
   77   2HB   ASP   9          2HB       ASP   9   8.148   9.289  -0.898
   78    H    ILE  10           H        ILE  10   9.914   7.717  -1.335
   79    HA   ILE  10           HA       ILE  10  10.101   6.931   1.386
   80    HB   ILE  10           HB       ILE  10  11.709   4.919   0.636
   81   1HG1  ILE  10          1HG1      ILE  10  10.537   3.544  -1.056
   82   2HG1  ILE  10          2HG1      ILE  10   9.428   4.878  -1.353
   83   1HG2  ILE  10          1HG2      ILE  10   9.568   5.141   2.180
   84   2HG2  ILE  10          2HG2      ILE  10   8.843   4.194   0.877
   85   3HG2  ILE  10          3HG2      ILE  10  10.251   3.576   1.746
   86   1HD1  ILE  10          1HD1      ILE  10  11.426   6.251  -2.002
   87   2HD1  ILE  10          2HD1      ILE  10  12.371   4.763  -1.936
   88   3HD1  ILE  10          3HD1      ILE  10  11.037   4.911  -3.080
   89    H    GLY  11           H        GLY  11  11.056   8.994  -0.493
   90   1HA   GLY  11          1HA       GLY  11  13.396   9.782   0.558
   91   2HA   GLY  11          2HA       GLY  11  13.001  10.088  -1.124
   92    H    GLY  12           H        GLY  12  14.003   8.906  -2.741
   93   1HA   GLY  12          1HA       GLY  12  15.823   6.758  -1.962
   94   2HA   GLY  12          2HA       GLY  12  16.552   8.196  -2.663
   95    H    HIS  13           H        HIS  13  15.098   5.212  -3.289
   96    HA   HIS  13           HA       HIS  13  14.338   5.835  -6.016
   97   1HB   HIS  13          1HB       HIS  13  15.929   3.940  -6.806
   98   2HB   HIS  13          2HB       HIS  13  16.592   5.548  -6.534
   99    HD1  HIS  13           HD1      HIS  13  15.874   3.323  -3.620
  100    HD2  HIS  13           HD2      HIS  13  19.121   4.502  -5.929
  101    HE1  HIS  13           HE1      HIS  13  17.910   2.538  -2.369
  102    HE2  HIS  13           HE2      HIS  13  19.864   3.331  -3.746
  103    H    GLU  14           H        GLU  14  14.077   3.476  -7.155
  104    HA   GLU  14           HA       GLU  14  11.884   2.286  -5.819
  105   1HB   GLU  14          1HB       GLU  14  13.434   1.060  -8.093
  106   2HB   GLU  14          2HB       GLU  14  11.743   0.812  -7.683
  107   1HG   GLU  14          1HG       GLU  14  11.323   2.315  -9.267
  108   2HG   GLU  14          2HG       GLU  14  11.843   3.510  -8.080
  109    H    ASN  15           H        ASN  15  12.094  -0.376  -6.179
  110    HA   ASN  15           HA       ASN  15  12.567  -2.210  -4.900
  111   1HB   ASN  15          1HB       ASN  15  15.029  -2.810  -4.956
  112   2HB   ASN  15          2HB       ASN  15  14.276  -2.506  -6.518
  113   1HD2  ASN  15          2HD2      ASN  15  14.774  -0.606  -7.634
  114   2HD2  ASN  15          1HD2      ASN  15  16.186   0.317  -7.266
  115    H    VAL  16           H        VAL  16  11.873  -1.769  -2.846
  116    HA   VAL  16           HA       VAL  16  13.991  -1.206  -0.912
  117    HB   VAL  16           HB       VAL  16  12.118   0.158   0.373
  118   1HG1  VAL  16          1HG1      VAL  16  14.302   0.890  -1.408
  119   2HG1  VAL  16          2HG1      VAL  16  13.108   2.172  -1.204
  120   3HG1  VAL  16          3HG1      VAL  16  13.906   1.478   0.208
  121   1HG2  VAL  16          1HG2      VAL  16  11.338   0.382  -2.509
  122   2HG2  VAL  16          2HG2      VAL  16  10.316   0.140  -1.093
  123   3HG2  VAL  16          3HG2      VAL  16  11.056   1.711  -1.389
  124    H    ASP  17           H        ASP  17  12.724  -1.336   1.425
  125    HA   ASP  17           HA       ASP  17  11.326  -3.924   1.295
  126   1HB   ASP  17          1HB       ASP  17  13.212  -2.764   3.332
  127   2HB   ASP  17          2HB       ASP  17  12.136  -4.097   3.737
  128    H    ILE  18           H        ILE  18   9.414  -4.218   2.333
  129    HA   ILE  18           HA       ILE  18   7.918  -1.901   3.057
  130    HB   ILE  18           HB       ILE  18   7.279  -4.849   3.194
  131   1HG1  ILE  18          1HG1      ILE  18   5.905  -2.835   1.470
  132   2HG1  ILE  18          2HG1      ILE  18   7.497  -3.420   0.998
  133   1HG2  ILE  18          1HG2      ILE  18   5.504  -2.501   3.846
  134   2HG2  ILE  18          2HG2      ILE  18   4.928  -4.148   3.584
  135   3HG2  ILE  18          3HG2      ILE  18   6.003  -3.793   4.936
  136   1HD1  ILE  18          1HD1      ILE  18   5.769  -5.609   1.711
  137   2HD1  ILE  18          2HD1      ILE  18   5.042  -4.601   0.459
  138   3HD1  ILE  18          3HD1      ILE  18   6.641  -5.302   0.210
  139    H    ILE  19           H        ILE  19   6.759  -1.712   5.142
  140    HA   ILE  19           HA       ILE  19   8.282  -2.892   7.355
  141    HB   ILE  19           HB       ILE  19   9.350  -0.922   7.589
  142   1HG1  ILE  19          1HG1      ILE  19   6.679  -0.183   8.786
  143   2HG1  ILE  19          2HG1      ILE  19   8.034  -0.947   9.607
  144   1HG2  ILE  19          1HG2      ILE  19   7.900  -0.072   5.471
  145   2HG2  ILE  19          2HG2      ILE  19   7.328   1.022   6.722
  146   3HG2  ILE  19          3HG2      ILE  19   9.044   0.924   6.356
  147   1HD1  ILE  19          1HD1      ILE  19   8.799   1.568   8.420
  148   2HD1  ILE  19          2HD1      ILE  19   7.430   1.747   9.517
  149   3HD1  ILE  19          3HD1      ILE  19   8.930   1.019  10.091
  150    H    ALA  20           H        ALA  20   5.258  -2.331   6.030
  151    HA   ALA  20           HA       ALA  20   4.005  -3.197   8.492
  152   1HB   ALA  20          1HB       ALA  20   4.117  -0.594   8.321
  153   2HB   ALA  20          2HB       ALA  20   2.767  -0.812   7.203
  154   3HB   ALA  20          3HB       ALA  20   2.638  -1.389   8.866
  155    H    VAL  21           H        VAL  21   1.849  -3.979   8.214
  156    HA   VAL  21           HA       VAL  21   0.850  -4.224   5.489
  157    HB   VAL  21           HB       VAL  21   1.423  -6.659   7.182
  158   1HG1  VAL  21          1HG1      VAL  21   0.244  -6.409   4.417
  159   2HG1  VAL  21          2HG1      VAL  21   0.663  -7.921   5.220
  160   3HG1  VAL  21          3HG1      VAL  21  -0.614  -6.898   5.877
  161   1HG2  VAL  21          1HG2      VAL  21   3.458  -5.719   6.209
  162   2HG2  VAL  21          2HG2      VAL  21   3.037  -7.252   5.445
  163   3HG2  VAL  21          3HG2      VAL  21   2.707  -5.733   4.613
  164    H    GLU  22           H        GLU  22  -1.288  -3.981   5.469
  165    HA   GLU  22           HA       GLU  22  -2.933  -5.045   7.599
  166   1HB   GLU  22          1HB       GLU  22  -2.724  -2.081   7.072
  167   2HB   GLU  22          2HB       GLU  22  -4.081  -2.811   7.918
  168   1HG   GLU  22          1HG       GLU  22  -1.207  -2.996   8.791
  169   2HG   GLU  22          2HG       GLU  22  -2.391  -1.856   9.430
  170    H    VAL  23           H        VAL  23  -2.612  -5.534   4.773
  171    HA   VAL  23           HA       VAL  23  -5.309  -4.788   3.844
  172    HB   VAL  23           HB       VAL  23  -4.289  -5.147   1.499
  173   1HG1  VAL  23          1HG1      VAL  23  -4.507  -2.878   3.201
  174   2HG1  VAL  23          2HG1      VAL  23  -3.067  -2.690   2.199
  175   3HG1  VAL  23          3HG1      VAL  23  -4.638  -2.956   1.443
  176   1HG2  VAL  23          1HG2      VAL  23  -1.797  -4.682   3.132
  177   2HG2  VAL  23          2HG2      VAL  23  -2.173  -6.089   2.138
  178   3HG2  VAL  23          3HG2      VAL  23  -1.885  -4.524   1.378
  179    H    ASN  24           H        ASN  24  -6.629  -6.453   3.564
  180    HA   ASN  24           HA       ASN  24  -5.503  -9.059   2.815
  181   1HB   ASN  24          1HB       ASN  24  -6.084  -8.769   5.330
  182   2HB   ASN  24          2HB       ASN  24  -7.755  -8.884   4.789
  183   1HD2  ASN  24          2HD2      ASN  24  -6.964 -10.734   6.500
  184   2HD2  ASN  24          1HD2      ASN  24  -6.719 -12.259   5.724
  185    H    VAL  25           H        VAL  25  -7.346  -6.704   1.741
  186    HA   VAL  25           HA       VAL  25  -8.994  -6.523   0.188
  187    HB   VAL  25           HB       VAL  25  -8.619  -9.509  -0.049
  188   1HG1  VAL  25          1HG1      VAL  25 -10.803  -8.755  -0.908
  189   2HG1  VAL  25          2HG1      VAL  25  -9.974  -7.609  -1.961
  190   3HG1  VAL  25          3HG1      VAL  25  -9.745  -9.343  -2.191
  191   1HG2  VAL  25          1HG2      VAL  25  -7.144  -7.196  -1.061
  192   2HG2  VAL  25          2HG2      VAL  25  -6.640  -8.876  -0.886
  193   3HG2  VAL  25          3HG2      VAL  25  -7.570  -8.378  -2.299
  194    H    GLY  26           H        GLY  26 -11.130  -6.237   0.423
  195   1HA   GLY  26          1HA       GLY  26 -12.592  -8.116   2.170
  196   2HA   GLY  26          2HA       GLY  26 -13.330  -7.195   0.868
  197    H    ASP  27           H        ASP  27 -10.992  -5.632   2.869
  198    HA   ASP  27           HA       ASP  27 -13.034  -4.479   4.605
  199   1HB   ASP  27          1HB       ASP  27 -10.357  -5.159   4.989
  200   2HB   ASP  27          2HB       ASP  27 -10.353  -3.398   4.927
  201    H    THR  28           H        THR  28 -13.675  -2.368   4.558
  202    HA   THR  28           HA       THR  28 -13.350  -0.947   2.125
  203    HB   THR  28           HB       THR  28 -15.338  -0.876   3.748
  204    HG1  THR  28           HG1      THR  28 -15.861   1.167   3.035
  205   1HG2  THR  28          1HG2      THR  28 -13.808  -0.148   5.698
  206   2HG2  THR  28          2HG2      THR  28 -13.958   1.459   4.987
  207   3HG2  THR  28          3HG2      THR  28 -15.399   0.592   5.520
  208    H    ILE  29           H        ILE  29 -12.575   1.310   1.984
  209    HA   ILE  29           HA       ILE  29 -10.448   1.995   3.871
  210    HB   ILE  29           HB       ILE  29  -8.872   2.464   2.012
  211   1HG1  ILE  29          1HG1      ILE  29  -9.918   0.729   0.025
  212   2HG1  ILE  29          2HG1      ILE  29 -11.195   1.864   0.444
  213   1HG2  ILE  29          1HG2      ILE  29  -9.814  -0.295   2.638
  214   2HG2  ILE  29          2HG2      ILE  29  -8.557  -0.071   1.422
  215   3HG2  ILE  29          3HG2      ILE  29  -8.303   0.507   3.069
  216   1HD1  ILE  29          1HD1      ILE  29  -9.619   3.720   0.031
  217   2HD1  ILE  29          2HD1      ILE  29  -8.421   2.542  -0.500
  218   3HD1  ILE  29          3HD1      ILE  29  -9.929   2.732  -1.396
  219    H    ALA  30           H        ALA  30 -10.410   4.124   4.285
  220    HA   ALA  30           HA       ALA  30 -12.199   5.858   2.788
  221   1HB   ALA  30          1HB       ALA  30 -10.529   6.640   5.163
  222   2HB   ALA  30          2HB       ALA  30 -12.015   7.385   4.574
  223   3HB   ALA  30          3HB       ALA  30 -12.065   5.788   5.320
  224    H    VAL  31           H        VAL  31 -11.150   8.298   2.870
  225    HA   VAL  31           HA       VAL  31  -8.964   8.120   0.957
  226    HB   VAL  31           HB       VAL  31 -10.372  10.632   1.847
  227   1HG1  VAL  31          1HG1      VAL  31  -8.323   9.980  -0.094
  228   2HG1  VAL  31          2HG1      VAL  31  -9.701  10.792  -0.837
  229   3HG1  VAL  31          3HG1      VAL  31  -8.848  11.552   0.507
  230   1HG2  VAL  31          1HG2      VAL  31 -11.303   8.450   0.079
  231   2HG2  VAL  31          2HG2      VAL  31 -12.225   9.584   1.066
  232   3HG2  VAL  31          3HG2      VAL  31 -11.566  10.100  -0.486
  233    H    ASP  32           H        ASP  32  -8.187   7.451   3.562
  234    HA   ASP  32           HA       ASP  32  -5.850   8.809   3.936
  235   1HB   ASP  32          1HB       ASP  32  -6.524  10.156   6.066
  236   2HB   ASP  32          2HB       ASP  32  -6.782  10.871   4.477
  237    H    ASP  33           H        ASP  33  -5.922   6.342   4.217
  238    HA   ASP  33           HA       ASP  33  -5.841   5.806   7.092
  239   1HB   ASP  33          1HB       ASP  33  -6.871   3.495   6.528
  240   2HB   ASP  33          2HB       ASP  33  -7.947   4.882   6.677
  241    H    THR  34           H        THR  34  -3.862   5.122   7.523
  242    HA   THR  34           HA       THR  34  -1.992   4.304   5.611
  243    HB   THR  34           HB       THR  34  -0.936   3.253   7.809
  244    HG1  THR  34           HG1      THR  34  -2.235   3.619   9.416
  245   1HG2  THR  34          1HG2      THR  34  -0.098   5.187   6.479
  246   2HG2  THR  34          2HG2      THR  34  -1.110   6.226   7.484
  247   3HG2  THR  34          3HG2      THR  34   0.191   5.287   8.217
  248    H    LEU  35           H        LEU  35  -1.974   2.561   4.445
  249    HA   LEU  35           HA       LEU  35  -3.290   0.134   5.381
  250   1HB   LEU  35          1HB       LEU  35  -2.105   0.948   2.731
  251   2HB   LEU  35          2HB       LEU  35  -2.664  -0.683   3.051
  252    HG   LEU  35           HG       LEU  35  -4.298   1.838   2.893
  253   1HD1  LEU  35          1HD1      LEU  35  -3.627  -0.094   1.027
  254   2HD1  LEU  35          2HD1      LEU  35  -5.256  -0.535   1.542
  255   3HD1  LEU  35          3HD1      LEU  35  -4.938   1.080   0.906
  256   1HD2  LEU  35          1HD2      LEU  35  -4.970  -0.790   4.166
  257   2HD2  LEU  35          2HD2      LEU  35  -5.252   0.842   4.769
  258   3HD2  LEU  35          3HD2      LEU  35  -6.221   0.215   3.435
  259    H    ILE  36           H        ILE  36  -0.130   1.330   4.388
  260    HA   ILE  36           HA       ILE  36   1.144  -0.691   6.038
  261    HB   ILE  36           HB       ILE  36   2.770  -1.346   4.259
  262   1HG1  ILE  36          1HG1      ILE  36   2.208  -1.082   1.925
  263   2HG1  ILE  36          2HG1      ILE  36   0.734  -0.213   2.330
  264   1HG2  ILE  36          1HG2      ILE  36   0.416  -2.447   4.921
  265   2HG2  ILE  36          2HG2      ILE  36   0.204  -2.264   3.181
  266   3HG2  ILE  36          3HG2      ILE  36   1.574  -3.179   3.811
  267   1HD1  ILE  36          1HD1      ILE  36   3.368   0.874   3.201
  268   2HD1  ILE  36          2HD1      ILE  36   2.861   1.050   1.524
  269   3HD1  ILE  36          3HD1      ILE  36   1.868   1.721   2.818
  270    H    THR  37           H        THR  37   3.706  -0.369   5.553
  271    HA   THR  37           HA       THR  37   4.245   2.506   5.452
  272    HB   THR  37           HB       THR  37   5.587   0.708   7.462
  273    HG1  THR  37           HG1      THR  37   3.271   2.296   7.841
  274   1HG2  THR  37          1HG2      THR  37   6.694   2.836   7.010
  275   2HG2  THR  37          2HG2      THR  37   5.201   3.691   7.396
  276   3HG2  THR  37          3HG2      THR  37   6.041   2.775   8.647
  277    H    LEU  38           H        LEU  38   6.412   3.018   4.788
  278    HA   LEU  38           HA       LEU  38   7.927   0.760   3.679
  279   1HB   LEU  38          1HB       LEU  38   6.867   3.156   2.256
  280   2HB   LEU  38          2HB       LEU  38   8.417   2.508   1.759
  281    HG   LEU  38           HG       LEU  38   6.845   1.544   0.312
  282   1HD1  LEU  38          1HD1      LEU  38   8.352  -0.039   1.984
  283   2HD1  LEU  38          2HD1      LEU  38   6.751  -0.777   2.043
  284   3HD1  LEU  38          3HD1      LEU  38   7.561  -0.549   0.495
  285   1HD2  LEU  38          1HD2      LEU  38   4.957   2.159   2.015
  286   2HD2  LEU  38          2HD2      LEU  38   4.722   0.863   0.840
  287   3HD2  LEU  38          3HD2      LEU  38   5.143   0.476   2.509
  288    H    GLU  39           H        GLU  39  10.173   1.443   2.995
  289    HA   GLU  39           HA       GLU  39  11.315   3.832   3.957
  290   1HB   GLU  39          1HB       GLU  39  10.908   3.037   6.160
  291   2HB   GLU  39          2HB       GLU  39  11.509   1.433   5.768
  292   1HG   GLU  39          1HG       GLU  39  13.765   2.318   5.537
  293   2HG   GLU  39          2HG       GLU  39  13.172   3.942   5.886
  294    H    THR  40           H        THR  40  13.713   3.776   3.917
  295    HA   THR  40           HA       THR  40  14.685   1.696   2.076
  296    HB   THR  40           HB       THR  40  15.940   3.315   0.879
  297    HG1  THR  40           HG1      THR  40  16.580   5.125   1.720
  298   1HG2  THR  40          1HG2      THR  40  13.455   3.359   0.476
  299   2HG2  THR  40          2HG2      THR  40  13.412   4.800   1.492
  300   3HG2  THR  40          3HG2      THR  40  14.349   4.802  -0.003
  301    H    ASP  41           H        ASP  41  16.214   4.320   3.919
  302    HA   ASP  41           HA       ASP  41  17.552   2.493   5.688
  303   1HB   ASP  41          1HB       ASP  41  18.900   3.525   3.277
  304   2HB   ASP  41          2HB       ASP  41  19.805   3.731   4.774
  305    H    LYS  42           H        LYS  42  15.836   4.927   5.695
  306    HA   LYS  42           HA       LYS  42  16.843   6.199   7.943
  307   1HB   LYS  42          1HB       LYS  42  18.059   7.132   5.511
  308   2HB   LYS  42          2HB       LYS  42  17.106   8.426   6.223
  309   1HG   LYS  42          1HG       LYS  42  19.216   6.845   7.677
  310   2HG   LYS  42          2HG       LYS  42  19.457   8.437   6.953
  311   1HD   LYS  42          1HD       LYS  42  17.439   9.138   8.419
  312   2HD   LYS  42          2HD       LYS  42  17.799   7.669   9.327
  313   1HE   LYS  42          1HE       LYS  42  19.729   9.922   8.782
  314   2HE   LYS  42          2HE       LYS  42  18.888   9.635  10.305
  315   1HZ   LYS  42          1HZ       LYS  42  20.788   7.739   9.033
  316   2HZ   LYS  42          2HZ       LYS  42  21.170   8.783  10.309
  317   3HZ   LYS  42          3HZ       LYS  42  20.036   7.547  10.536
  318    H    ALA  43           H        ALA  43  15.065   6.774   4.932
  319    HA   ALA  43           HA       ALA  43  13.063   8.320   6.409
  320   1HB   ALA  43          1HB       ALA  43  13.785   8.069   3.527
  321   2HB   ALA  43          2HB       ALA  43  12.154   8.578   3.966
  322   3HB   ALA  43          3HB       ALA  43  13.547   9.515   4.508
  323    H    THR  44           H        THR  44  11.143   7.500   6.943
  324    HA   THR  44           HA       THR  44  10.354   4.932   5.734
  325    HB   THR  44           HB       THR  44   9.459   4.216   7.779
  326    HG1  THR  44           HG1      THR  44   8.345   6.021   8.431
  327   1HG2  THR  44          1HG2      THR  44  12.101   4.842   7.719
  328   2HG2  THR  44          2HG2      THR  44  11.563   5.682   9.173
  329   3HG2  THR  44          3HG2      THR  44  11.299   3.946   9.008
  330    H    MET  45           H        MET  45   8.692   5.129   4.415
  331    HA   MET  45           HA       MET  45   6.749   7.287   4.871
  332   1HB   MET  45          1HB       MET  45   8.019   6.243   2.535
  333   2HB   MET  45          2HB       MET  45   6.285   5.998   2.384
  334   1HG   MET  45          1HG       MET  45   6.909   8.100   1.396
  335   2HG   MET  45          2HG       MET  45   5.928   8.385   2.832
  336   1HE   MET  45          1HE       MET  45   7.186  10.465   1.471
  337   2HE   MET  45          2HE       MET  45   8.262  11.390   2.519
  338   3HE   MET  45          3HE       MET  45   8.933  10.345   1.266
  339    H    ASP  46           H        ASP  46   4.639   6.307   3.372
  340    HA   ASP  46           HA       ASP  46   3.834   3.692   4.000
  341   1HB   ASP  46          1HB       ASP  46   2.029   4.401   5.699
  342   2HB   ASP  46          2HB       ASP  46   3.680   4.221   6.283
  343    H    VAL  47           H        VAL  47   1.427   3.396   3.662
  344    HA   VAL  47           HA       VAL  47   0.509   5.343   1.652
  345    HB   VAL  47           HB       VAL  47  -0.029   2.376   1.851
  346   1HG1  VAL  47          1HG1      VAL  47  -1.704   4.395   0.740
  347   2HG1  VAL  47          2HG1      VAL  47  -1.014   3.455  -0.584
  348   3HG1  VAL  47          3HG1      VAL  47  -1.911   2.644   0.698
  349   1HG2  VAL  47          1HG2      VAL  47   1.543   4.105  -0.028
  350   2HG2  VAL  47          2HG2      VAL  47   2.061   2.671   0.856
  351   3HG2  VAL  47          3HG2      VAL  47   0.960   2.513  -0.510
  352    HA   PRO  48           HA       PRO  48  -2.810   5.749   4.709
  353   1HB   PRO  48          1HB       PRO  48  -3.259   8.345   4.372
  354   2HB   PRO  48          2HB       PRO  48  -1.797   7.789   5.196
  355   1HG   PRO  48          1HG       PRO  48  -2.133   8.813   2.418
  356   2HG   PRO  48          2HG       PRO  48  -0.789   9.050   3.547
  357   1HD   PRO  48          1HD       PRO  48  -0.894   7.172   1.459
  358   2HD   PRO  48          2HD       PRO  48   0.275   7.192   2.793
  359    H    ALA  49           H        ALA  49  -3.250   4.611   2.110
  360    HA   ALA  49           HA       ALA  49  -4.886   4.284   0.560
  361   1HB   ALA  49          1HB       ALA  49  -6.737   5.828   2.351
  362   2HB   ALA  49          2HB       ALA  49  -6.174   4.210   2.770
  363   3HB   ALA  49          3HB       ALA  49  -7.104   4.466   1.294
  364    H    GLU  50           H        GLU  50  -6.727   5.549  -0.703
  365    HA   GLU  50           HA       GLU  50  -6.351   8.372  -0.934
  366   1HB   GLU  50          1HB       GLU  50  -5.437   8.402  -3.198
  367   2HB   GLU  50          2HB       GLU  50  -4.324   7.623  -2.081
  368   1HG   GLU  50          1HG       GLU  50  -5.222   5.422  -2.861
  369   2HG   GLU  50          2HG       GLU  50  -6.114   6.301  -4.102
  370    H    VAL  51           H        VAL  51  -8.571   6.687  -0.507
  371    HA   VAL  51           HA       VAL  51 -10.453   7.801  -2.206
  372    HB   VAL  51           HB       VAL  51 -11.037   5.390  -3.277
  373   1HG1  VAL  51          1HG1      VAL  51  -9.890   7.897  -4.182
  374   2HG1  VAL  51          2HG1      VAL  51  -9.451   6.543  -5.222
  375   3HG1  VAL  51          3HG1      VAL  51 -11.148   6.901  -4.911
  376   1HG2  VAL  51          1HG2      VAL  51  -8.719   4.648  -2.357
  377   2HG2  VAL  51          2HG2      VAL  51  -9.186   4.190  -3.995
  378   3HG2  VAL  51          3HG2      VAL  51  -8.082   5.542  -3.736
  379    H    ALA  52           H        ALA  52 -12.618   6.651  -2.089
  380    HA   ALA  52           HA       ALA  52 -12.868   5.402   0.567
  381   1HB   ALA  52          1HB       ALA  52 -14.748   7.153  -0.981
  382   2HB   ALA  52          2HB       ALA  52 -15.207   6.280   0.482
  383   3HB   ALA  52          3HB       ALA  52 -13.943   7.510   0.550
  384    H    GLY  53           H        GLY  53 -12.742   3.218  -0.045
  385   1HA   GLY  53          1HA       GLY  53 -13.879   1.980  -2.207
  386   2HA   GLY  53          2HA       GLY  53 -15.198   2.143  -1.066
  387    H    VAL  54           H        VAL  54 -13.589  -0.180  -2.184
  388    HA   VAL  54           HA       VAL  54 -12.676  -1.377   0.344
  389    HB   VAL  54           HB       VAL  54 -14.541  -2.680  -1.646
  390   1HG1  VAL  54          1HG1      VAL  54 -12.860  -4.210  -0.612
  391   2HG1  VAL  54          2HG1      VAL  54 -13.519  -3.790   0.968
  392   3HG1  VAL  54          3HG1      VAL  54 -14.532  -4.609  -0.220
  393   1HG2  VAL  54          1HG2      VAL  54 -15.492  -0.937  -0.060
  394   2HG2  VAL  54          2HG2      VAL  54 -16.244  -2.532  -0.026
  395   3HG2  VAL  54          3HG2      VAL  54 -15.112  -2.064   1.242
  396    H    VAL  55           H        VAL  55 -11.036  -2.922   0.144
  397    HA   VAL  55           HA       VAL  55  -9.469  -2.734  -2.243
  398    HB   VAL  55           HB       VAL  55  -9.052  -4.533   0.144
  399   1HG1  VAL  55          1HG1      VAL  55  -7.919  -5.284  -1.949
  400   2HG1  VAL  55          2HG1      VAL  55  -7.089  -3.727  -2.007
  401   3HG1  VAL  55          3HG1      VAL  55  -6.797  -4.831  -0.663
  402   1HG2  VAL  55          1HG2      VAL  55  -9.052  -2.011   0.510
  403   2HG2  VAL  55          2HG2      VAL  55  -7.616  -2.893   1.029
  404   3HG2  VAL  55          3HG2      VAL  55  -7.592  -1.980  -0.479
  405    H    LYS  56           H        LYS  56  -8.962  -4.300  -3.713
  406    HA   LYS  56           HA       LYS  56 -10.749  -6.644  -3.767
  407   1HB   LYS  56          1HB       LYS  56  -9.573  -6.091  -6.336
  408   2HB   LYS  56          2HB       LYS  56 -11.274  -6.182  -5.899
  409   1HG   LYS  56          1HG       LYS  56  -9.627  -3.714  -5.440
  410   2HG   LYS  56          2HG       LYS  56 -10.470  -4.027  -6.959
  411   1HD   LYS  56          1HD       LYS  56 -11.991  -4.238  -4.404
  412   2HD   LYS  56          2HD       LYS  56 -11.605  -2.634  -5.031
  413   1HE   LYS  56          1HE       LYS  56 -13.459  -2.843  -6.259
  414   2HE   LYS  56          2HE       LYS  56 -12.520  -3.952  -7.258
  415   1HZ   LYS  56          1HZ       LYS  56 -13.784  -5.084  -4.892
  416   2HZ   LYS  56          2HZ       LYS  56 -14.821  -4.618  -6.143
  417   3HZ   LYS  56          3HZ       LYS  56 -13.592  -5.744  -6.436
  418    H    GLU  57           H        GLU  57  -7.579  -5.395  -4.701
  419    HA   GLU  57           HA       GLU  57  -6.581  -8.131  -4.654
  420   1HB   GLU  57          1HB       GLU  57  -5.932  -5.770  -6.292
  421   2HB   GLU  57          2HB       GLU  57  -4.556  -6.748  -5.802
  422   1HG   GLU  57          1HG       GLU  57  -6.075  -8.715  -6.664
  423   2HG   GLU  57          2HG       GLU  57  -6.820  -7.419  -7.599
  424    H    VAL  58           H        VAL  58  -4.241  -8.333  -3.992
  425    HA   VAL  58           HA       VAL  58  -3.169  -6.404  -2.155
  426    HB   VAL  58           HB       VAL  58  -4.890  -7.448  -0.726
  427   1HG1  VAL  58          1HG1      VAL  58  -4.889  -9.645  -1.883
  428   2HG1  VAL  58          2HG1      VAL  58  -3.342 -10.007  -1.117
  429   3HG1  VAL  58          3HG1      VAL  58  -4.783  -9.776  -0.127
  430   1HG2  VAL  58          1HG2      VAL  58  -2.252  -6.973  -0.126
  431   2HG2  VAL  58          2HG2      VAL  58  -3.537  -7.271   1.047
  432   3HG2  VAL  58          3HG2      VAL  58  -2.510  -8.600   0.505
  433    H    LYS  59           H        LYS  59  -1.042  -6.550  -2.324
  434    HA   LYS  59           HA       LYS  59   0.254  -9.145  -2.527
  435   1HB   LYS  59          1HB       LYS  59   0.661  -6.989  -4.603
  436   2HB   LYS  59          2HB       LYS  59   1.536  -8.513  -4.516
  437   1HG   LYS  59          1HG       LYS  59  -0.018  -9.059  -6.083
  438   2HG   LYS  59          2HG       LYS  59  -0.905  -9.516  -4.627
  439   1HD   LYS  59          1HD       LYS  59  -2.493  -8.267  -5.720
  440   2HD   LYS  59          2HD       LYS  59  -1.728  -7.027  -4.726
  441   1HE   LYS  59          1HE       LYS  59  -1.941  -6.109  -6.898
  442   2HE   LYS  59          2HE       LYS  59  -0.240  -6.527  -6.695
  443   1HZ   LYS  59          1HZ       LYS  59  -1.857  -8.628  -7.837
  444   2HZ   LYS  59          2HZ       LYS  59  -1.753  -7.241  -8.797
  445   3HZ   LYS  59          3HZ       LYS  59  -0.344  -8.045  -8.317
  446    H    VAL  60           H        VAL  60   0.936  -8.473  -0.407
  447    HA   VAL  60           HA       VAL  60   3.498  -7.299  -0.392
  448    HB   VAL  60           HB       VAL  60   2.734  -5.146  -0.541
  449   1HG1  VAL  60          1HG1      VAL  60   0.267  -5.950   0.988
  450   2HG1  VAL  60          2HG1      VAL  60   0.612  -4.315   0.426
  451   3HG1  VAL  60          3HG1      VAL  60   0.389  -5.621  -0.741
  452   1HG2  VAL  60          1HG2      VAL  60   3.817  -5.627   1.772
  453   2HG2  VAL  60          2HG2      VAL  60   3.063  -4.062   1.473
  454   3HG2  VAL  60          3HG2      VAL  60   2.204  -5.293   2.398
  455    H    LYS  61           H        LYS  61   4.521  -7.430   1.637
  456    HA   LYS  61           HA       LYS  61   3.029  -8.506   3.888
  457   1HB   LYS  61          1HB       LYS  61   4.126 -10.297   2.144
  458   2HB   LYS  61          2HB       LYS  61   5.438 -10.088   3.295
  459   1HG   LYS  61          1HG       LYS  61   4.362 -11.770   4.343
  460   2HG   LYS  61          2HG       LYS  61   3.432 -10.429   5.018
  461   1HD   LYS  61          1HD       LYS  61   1.567 -10.980   3.873
  462   2HD   LYS  61          2HD       LYS  61   2.470 -11.453   2.432
  463   1HE   LYS  61          1HE       LYS  61   2.142 -13.581   2.971
  464   2HE   LYS  61          2HE       LYS  61   3.111 -13.331   4.422
  465   1HZ   LYS  61          1HZ       LYS  61   0.198 -12.787   4.271
  466   2HZ   LYS  61          2HZ       LYS  61   0.855 -14.238   4.839
  467   3HZ   LYS  61          3HZ       LYS  61   1.167 -12.792   5.658
  468    H    VAL  62           H        VAL  62   4.959  -9.237   5.575
  469    HA   VAL  62           HA       VAL  62   6.500  -6.764   5.919
  470    HB   VAL  62           HB       VAL  62   5.909  -8.915   7.957
  471   1HG1  VAL  62          1HG1      VAL  62   7.946  -7.205   8.081
  472   2HG1  VAL  62          2HG1      VAL  62   6.679  -6.157   8.718
  473   3HG1  VAL  62          3HG1      VAL  62   7.033  -7.693   9.508
  474   1HG2  VAL  62          1HG2      VAL  62   3.893  -7.699   7.136
  475   2HG2  VAL  62          2HG2      VAL  62   4.225  -7.466   8.852
  476   3HG2  VAL  62          3HG2      VAL  62   4.631  -6.198   7.696
  477    H    GLY  63           H        GLY  63   8.077  -7.530   4.319
  478   1HA   GLY  63          1HA       GLY  63   9.811  -9.696   5.292
  479   2HA   GLY  63          2HA       GLY  63  10.505  -8.107   5.016
  480    H    ASP  64           H        ASP  64   9.111  -7.413   2.676
  481    HA   ASP  64           HA       ASP  64  10.357  -9.283   0.782
  482   1HB   ASP  64          1HB       ASP  64   8.371  -8.644  -0.766
  483   2HB   ASP  64          2HB       ASP  64   8.117  -9.861   0.481
  484    H    LYS  65           H        LYS  65  10.702  -8.291  -1.385
  485    HA   LYS  65           HA       LYS  65  11.739  -5.597  -1.038
  486   1HB   LYS  65          1HB       LYS  65  12.145  -7.788  -3.028
  487   2HB   LYS  65          2HB       LYS  65  12.494  -6.137  -3.517
  488   1HG   LYS  65          1HG       LYS  65  13.677  -6.635  -0.964
  489   2HG   LYS  65          2HG       LYS  65  14.143  -7.909  -2.093
  490   1HD   LYS  65          1HD       LYS  65  14.245  -5.128  -3.102
  491   2HD   LYS  65          2HD       LYS  65  15.451  -5.580  -1.895
  492   1HE   LYS  65          1HE       LYS  65  16.622  -6.697  -3.417
  493   2HE   LYS  65          2HE       LYS  65  15.211  -7.659  -3.853
  494   1HZ   LYS  65          1HZ       LYS  65  14.646  -5.371  -5.082
  495   2HZ   LYS  65          2HZ       LYS  65  16.336  -5.321  -5.156
  496   3HZ   LYS  65          3HZ       LYS  65  15.497  -6.633  -5.818
  497    H    ILE  66           H        ILE  66  10.278  -4.064  -1.247
  498    HA   ILE  66           HA       ILE  66   8.690  -4.006  -3.712
  499    HB   ILE  66           HB       ILE  66   7.707  -4.207  -0.999
  500   1HG1  ILE  66          1HG1      ILE  66   5.672  -4.829  -2.094
  501   2HG1  ILE  66          2HG1      ILE  66   6.174  -4.045  -3.590
  502   1HG2  ILE  66          1HG2      ILE  66   6.713  -1.819  -2.533
  503   2HG2  ILE  66          2HG2      ILE  66   5.927  -2.513  -1.116
  504   3HG2  ILE  66          3HG2      ILE  66   7.538  -1.808  -0.978
  505   1HD1  ILE  66          1HD1      ILE  66   7.801  -6.265  -2.439
  506   2HD1  ILE  66          2HD1      ILE  66   6.348  -6.611  -3.378
  507   3HD1  ILE  66          3HD1      ILE  66   7.679  -5.712  -4.109
  508    H    SER  67           H        SER  67   7.868  -1.766  -4.191
  509    HA   SER  67           HA       SER  67   9.091   0.477  -2.933
  510   1HB   SER  67          1HB       SER  67  10.656   1.144  -4.602
  511   2HB   SER  67          2HB       SER  67  11.011  -0.544  -4.235
  512    HG   SER  67           HG       SER  67  10.104   0.600  -6.562
  513    H    GLU  68           H        GLU  68   8.735   2.511  -4.239
  514    HA   GLU  68           HA       GLU  68   6.104   2.936  -4.792
  515   1HB   GLU  68          1HB       GLU  68   8.563   4.378  -5.170
  516   2HB   GLU  68          2HB       GLU  68   7.497   4.656  -6.541
  517   1HG   GLU  68          1HG       GLU  68   5.866   4.882  -4.294
  518   2HG   GLU  68          2HG       GLU  68   7.365   5.705  -3.866
  519    H    GLY  69           H        GLY  69   5.146   1.331  -6.016
  520   1HA   GLY  69          1HA       GLY  69   5.937   1.242  -8.859
  521   2HA   GLY  69          2HA       GLY  69   4.256   1.316  -8.352
  522    H    GLY  70           H        GLY  70   3.880  -0.514  -6.501
  523   1HA   GLY  70          1HA       GLY  70   4.748  -2.831  -6.023
  524   2HA   GLY  70          2HA       GLY  70   4.837  -3.006  -7.767
  525    H    LEU  71           H        LEU  71   2.183  -1.228  -7.511
  526    HA   LEU  71           HA       LEU  71  -0.066  -1.600  -7.389
  527   1HB   LEU  71          1HB       LEU  71   0.463  -2.740  -9.473
  528   2HB   LEU  71          2HB       LEU  71   0.851  -4.209  -8.600
  529    HG   LEU  71           HG       LEU  71  -1.384  -4.696  -8.156
  530   1HD1  LEU  71          1HD1      LEU  71  -1.992  -1.809  -8.759
  531   2HD1  LEU  71          2HD1      LEU  71  -3.223  -3.047  -8.518
  532   3HD1  LEU  71          3HD1      LEU  71  -2.122  -2.632  -7.205
  533   1HD2  LEU  71          1HD2      LEU  71  -0.661  -3.964 -10.814
  534   2HD2  LEU  71          2HD2      LEU  71  -1.759  -5.233 -10.272
  535   3HD2  LEU  71          3HD2      LEU  71  -2.370  -3.604 -10.563
  536    H    ILE  72           H        ILE  72   1.044  -1.950  -4.958
  537    HA   ILE  72           HA       ILE  72   0.879  -4.268  -3.571
  538    HB   ILE  72           HB       ILE  72   0.311  -1.439  -2.833
  539   1HG1  ILE  72          1HG1      ILE  72   2.195  -3.363  -1.510
  540   2HG1  ILE  72          2HG1      ILE  72   2.590  -2.644  -3.068
  541   1HG2  ILE  72          1HG2      ILE  72  -0.614  -3.774  -1.269
  542   2HG2  ILE  72          2HG2      ILE  72   0.286  -2.549  -0.372
  543   3HG2  ILE  72          3HG2      ILE  72  -1.175  -2.101  -1.251
  544   1HD1  ILE  72          1HD1      ILE  72   1.821  -0.973  -0.712
  545   2HD1  ILE  72          2HD1      ILE  72   3.480  -1.508  -0.984
  546   3HD1  ILE  72          3HD1      ILE  72   2.673  -0.495  -2.177
  547    H    VAL  73           H        VAL  73  -1.883  -2.033  -3.303
  548    HA   VAL  73           HA       VAL  73  -3.687  -4.313  -3.721
  549    HB   VAL  73           HB       VAL  73  -5.069  -3.691  -1.838
  550   1HG1  VAL  73          1HG1      VAL  73  -2.409  -4.675  -1.627
  551   2HG1  VAL  73          2HG1      VAL  73  -2.766  -3.712  -0.193
  552   3HG1  VAL  73          3HG1      VAL  73  -3.812  -5.062  -0.633
  553   1HG2  VAL  73          1HG2      VAL  73  -3.058  -1.488  -1.401
  554   2HG2  VAL  73          2HG2      VAL  73  -4.768  -1.312  -1.794
  555   3HG2  VAL  73          3HG2      VAL  73  -4.285  -1.961  -0.227
  556    H    VAL  74           H        VAL  74  -5.709  -3.846  -4.531
  557    HA   VAL  74           HA       VAL  74  -6.046  -1.125  -5.628
  558    HB   VAL  74           HB       VAL  74  -7.184  -3.753  -6.617
  559   1HG1  VAL  74          1HG1      VAL  74  -8.373  -1.368  -6.948
  560   2HG1  VAL  74          2HG1      VAL  74  -7.261  -1.342  -8.316
  561   3HG1  VAL  74          3HG1      VAL  74  -8.426  -2.655  -8.152
  562   1HG2  VAL  74          1HG2      VAL  74  -4.752  -2.224  -7.278
  563   2HG2  VAL  74          2HG2      VAL  74  -5.084  -3.951  -7.417
  564   3HG2  VAL  74          3HG2      VAL  74  -5.677  -2.837  -8.650
  565    H    VAL  75           H        VAL  75  -7.988  -0.047  -5.269
  566    HA   VAL  75           HA       VAL  75  -9.913  -1.437  -3.542
  567    HB   VAL  75           HB       VAL  75 -10.365   0.793  -2.511
  568   1HG1  VAL  75          1HG1      VAL  75  -7.756  -0.637  -2.240
  569   2HG1  VAL  75          2HG1      VAL  75  -8.088   0.789  -1.259
  570   3HG1  VAL  75          3HG1      VAL  75  -9.139  -0.622  -1.148
  571   1HG2  VAL  75          1HG2      VAL  75  -7.908   1.537  -4.076
  572   2HG2  VAL  75          2HG2      VAL  75  -9.504   2.280  -4.160
  573   3HG2  VAL  75          3HG2      VAL  75  -8.517   2.471  -2.711
  574    H    GLU  76           H        GLU  76 -12.090  -0.535  -3.534
  575    HA   GLU  76           HA       GLU  76 -13.101  -0.270  -6.167
  576   1HB   GLU  76          1HB       GLU  76 -14.160  -1.082  -3.804
  577   2HB   GLU  76          2HB       GLU  76 -14.842   0.537  -3.918
  578   1HG   GLU  76          1HG       GLU  76 -16.136   0.021  -5.714
  579   2HG   GLU  76          2HG       GLU  76 -15.018  -1.203  -6.310
  580    H    ALA  77           H        ALA  77 -12.644   2.017  -3.508
  581    HA   ALA  77           HA       ALA  77 -12.626   4.278  -3.416
  582   1HB   ALA  77          1HB       ALA  77 -10.885   4.347  -4.909
  583   2HB   ALA  77          2HB       ALA  77 -11.862   3.736  -6.242
  584   3HB   ALA  77          3HB       ALA  77 -12.075   5.393  -5.681
  585    H    GLU  78           H        GLU  78 -14.175   5.743  -3.226
  586    HA   GLU  78           HA       GLU  78 -16.341   6.508  -3.248
  587   1HB   GLU  78          1HB       GLU  78 -16.861   7.685  -5.335
  588   2HB   GLU  78          2HB       GLU  78 -15.195   7.942  -4.832
  589   1HG   GLU  78          1HG       GLU  78 -14.335   6.742  -6.579
  590   2HG   GLU  78          2HG       GLU  78 -15.782   5.750  -6.754
  591    H    GLY  79           H        GLY  79 -16.850   4.025  -2.963
  592   1HA   GLY  79          1HA       GLY  79 -18.026   2.130  -3.696
  593   2HA   GLY  79          2HA       GLY  79 -18.361   2.951  -5.213
  594    H    THR  80           H        THR  80 -19.974   1.573  -2.936
  595    HA   THR  80           HA       THR  80 -21.659   3.374  -1.690
  596    HB   THR  80           HB       THR  80 -22.363   4.300  -3.746
  597    HG1  THR  80           HG1      THR  80 -24.162   3.907  -2.545
  598   1HG2  THR  80          1HG2      THR  80 -21.522   2.162  -5.036
  599   2HG2  THR  80          2HG2      THR  80 -23.233   1.739  -4.956
  600   3HG2  THR  80          3HG2      THR  80 -22.731   3.247  -5.721
  601    H    ALA  81           H        ALA  81 -22.323   2.079  -0.119
  602    HA   ALA  81           HA       ALA  81 -23.977  -0.183  -0.636
  603   1HB   ALA  81          1HB       ALA  81 -21.780  -1.193  -1.089
  604   2HB   ALA  81          2HB       ALA  81 -21.260  -0.761   0.540
  605   3HB   ALA  81          3HB       ALA  81 -22.573  -1.917   0.310

  No H/Q in entry =         605
  Start of MODEL    8
    1    H1   ALA   1           H1       ALA   1 -15.674   3.582  -9.603
    2    H2   ALA   1           H2       ALA   1 -14.670   4.607 -10.544
    3    H3   ALA   1           H3       ALA   1 -15.976   3.772 -11.278
    4    HA   ALA   1           HA       ALA   1 -14.964   1.730 -11.032
    5   1HB   ALA   1          1HB       ALA   1 -13.639   3.916 -12.353
    6   2HB   ALA   1          2HB       ALA   1 -12.474   2.692 -11.848
    7   3HB   ALA   1          3HB       ALA   1 -13.836   2.242 -12.873
    8    H    LEU   2           H        LEU   2 -12.533   0.844 -10.668
    9    HA   LEU   2           HA       LEU   2 -12.115   1.130  -7.798
   10   1HB   LEU   2          1HB       LEU   2 -10.374  -0.701  -9.312
   11   2HB   LEU   2          2HB       LEU   2 -11.262  -0.968  -7.826
   12    HG   LEU   2           HG       LEU   2 -12.285  -1.205 -10.648
   13   1HD1  LEU   2          1HD1      LEU   2 -11.589  -3.063  -8.447
   14   2HD1  LEU   2          2HD1      LEU   2 -12.996  -3.463  -9.432
   15   3HD1  LEU   2          3HD1      LEU   2 -11.419  -3.253 -10.193
   16   1HD2  LEU   2          1HD2      LEU   2 -13.727  -0.445  -8.274
   17   2HD2  LEU   2          2HD2      LEU   2 -14.300  -0.597  -9.936
   18   3HD2  LEU   2          3HD2      LEU   2 -14.288  -2.006  -8.874
   19    H    VAL   3           H        VAL   3  -9.693   0.872  -7.145
   20    HA   VAL   3           HA       VAL   3  -8.077   2.756  -8.732
   21    HB   VAL   3           HB       VAL   3  -8.613   2.736  -5.776
   22   1HG1  VAL   3          1HG1      VAL   3  -6.179   2.647  -5.953
   23   2HG1  VAL   3          2HG1      VAL   3  -6.207   4.025  -7.056
   24   3HG1  VAL   3          3HG1      VAL   3  -6.723   4.226  -5.381
   25   1HG2  VAL   3          1HG2      VAL   3  -8.878   4.630  -8.033
   26   2HG2  VAL   3          2HG2      VAL   3  -9.949   4.337  -6.663
   27   3HG2  VAL   3          3HG2      VAL   3  -8.489   5.303  -6.449
   28    H    GLU   4           H        GLU   4  -5.727   2.584  -8.284
   29    HA   GLU   4           HA       GLU   4  -4.947  -0.151  -7.522
   30   1HB   GLU   4          1HB       GLU   4  -3.934   1.511  -9.832
   31   2HB   GLU   4          2HB       GLU   4  -3.147   0.043  -9.269
   32   1HG   GLU   4          1HG       GLU   4  -4.762  -1.317 -10.113
   33   2HG   GLU   4          2HG       GLU   4  -6.032  -0.108  -9.932
   34    H    LEU   5           H        LEU   5  -4.312   0.487  -5.450
   35    HA   LEU   5           HA       LEU   5  -2.810   2.694  -4.736
   36   1HB   LEU   5          1HB       LEU   5  -3.640   0.281  -3.509
   37   2HB   LEU   5          2HB       LEU   5  -1.921   0.437  -3.207
   38    HG   LEU   5           HG       LEU   5  -3.244   1.397  -1.388
   39   1HD1  LEU   5          1HD1      LEU   5  -1.012   2.377  -2.285
   40   2HD1  LEU   5          2HD1      LEU   5  -2.021   3.731  -2.791
   41   3HD1  LEU   5          3HD1      LEU   5  -1.944   3.277  -1.088
   42   1HD2  LEU   5          1HD2      LEU   5  -5.005   2.185  -3.267
   43   2HD2  LEU   5          2HD2      LEU   5  -4.925   2.879  -1.647
   44   3HD2  LEU   5          3HD2      LEU   5  -4.140   3.698  -2.998
   45    H    LYS   6           H        LYS   6  -0.563   3.005  -4.333
   46    HA   LYS   6           HA       LYS   6   1.249   1.128  -5.660
   47   1HB   LYS   6          1HB       LYS   6   0.988   4.061  -6.296
   48   2HB   LYS   6          2HB       LYS   6   2.425   3.131  -6.693
   49   1HG   LYS   6          1HG       LYS   6   0.170   1.696  -7.639
   50   2HG   LYS   6          2HG       LYS   6   0.012   3.376  -8.156
   51   1HD   LYS   6          1HD       LYS   6   2.582   3.022  -8.748
   52   2HD   LYS   6          2HD       LYS   6   2.054   1.344  -8.875
   53   1HE   LYS   6          1HE       LYS   6   0.094   2.799 -10.205
   54   2HE   LYS   6          2HE       LYS   6   1.611   3.566 -10.676
   55   1HZ   LYS   6          1HZ       LYS   6   1.896   0.760 -10.757
   56   2HZ   LYS   6          2HZ       LYS   6   0.534   1.205 -11.655
   57   3HZ   LYS   6          3HZ       LYS   6   2.042   1.878 -12.020
   58    H    VAL   7           H        VAL   7   3.404   1.251  -5.023
   59    HA   VAL   7           HA       VAL   7   3.971   1.545  -2.364
   60    HB   VAL   7           HB       VAL   7   5.833   1.882  -4.717
   61   1HG1  VAL   7          1HG1      VAL   7   6.682   2.752  -2.468
   62   2HG1  VAL   7          2HG1      VAL   7   6.675   1.066  -1.955
   63   3HG1  VAL   7          3HG1      VAL   7   7.681   1.572  -3.311
   64   1HG2  VAL   7          1HG2      VAL   7   4.546  -0.246  -4.564
   65   2HG2  VAL   7          2HG2      VAL   7   6.295  -0.449  -4.489
   66   3HG2  VAL   7          3HG2      VAL   7   5.333  -0.548  -3.015
   67    HA   PRO   8           HA       PRO   8   4.111   5.914  -1.644
   68   1HB   PRO   8          1HB       PRO   8   5.669   5.982   0.579
   69   2HB   PRO   8          2HB       PRO   8   3.976   5.474   0.597
   70   1HG   PRO   8          1HG       PRO   8   6.456   3.802   0.607
   71   2HG   PRO   8          2HG       PRO   8   4.941   3.566   1.498
   72   1HD   PRO   8          1HD       PRO   8   5.571   2.193  -0.763
   73   2HD   PRO   8          2HD       PRO   8   3.903   2.560  -0.289
   74    H    ASP   9           H        ASP   9   6.025   7.450  -0.638
   75    HA   ASP   9           HA       ASP   9   8.109   7.354  -2.689
   76   1HB   ASP   9          1HB       ASP   9   6.622   9.435  -1.318
   77   2HB   ASP   9          2HB       ASP   9   8.357   9.735  -1.257
   78    H    ILE  10           H        ILE  10   9.209   5.609  -1.509
   79    HA   ILE  10           HA       ILE  10  10.441   6.336   1.019
   80    HB   ILE  10           HB       ILE  10  11.590   4.033   0.661
   81   1HG1  ILE  10          1HG1      ILE  10  10.443   2.484  -0.780
   82   2HG1  ILE  10          2HG1      ILE  10   9.232   3.691  -1.197
   83   1HG2  ILE  10          1HG2      ILE  10   9.724   4.655   2.249
   84   2HG2  ILE  10          2HG2      ILE  10   8.613   3.998   1.045
   85   3HG2  ILE  10          3HG2      ILE  10   9.827   2.956   1.792
   86   1HD1  ILE  10          1HD1      ILE  10  10.972   5.005  -2.331
   87   2HD1  ILE  10          2HD1      ILE  10  12.142   3.739  -1.960
   88   3HD1  ILE  10          3HD1      ILE  10  10.776   3.393  -3.018
   89    H    GLY  11           H        GLY  11  11.351   8.176  -0.437
   90   1HA   GLY  11          1HA       GLY  11  13.479   9.132  -0.738
   91   2HA   GLY  11          2HA       GLY  11  13.187   8.335  -2.270
   92    H    GLY  12           H        GLY  12  14.145   6.281  -2.665
   93   1HA   GLY  12          1HA       GLY  12  15.756   4.760  -1.098
   94   2HA   GLY  12          2HA       GLY  12  16.797   6.104  -1.545
   95    H    HIS  13           H        HIS  13  14.480   3.904  -3.130
   96    HA   HIS  13           HA       HIS  13  15.400   4.036  -5.704
   97   1HB   HIS  13          1HB       HIS  13  16.810   1.820  -5.658
   98   2HB   HIS  13          2HB       HIS  13  17.576   3.367  -5.316
   99    HD1  HIS  13           HD1      HIS  13  19.382   1.878  -4.025
  100    HD2  HIS  13           HD2      HIS  13  15.585   1.993  -2.341
  101    HE1  HIS  13           HE1      HIS  13  19.666   1.042  -1.671
  102    HE2  HIS  13           HE2      HIS  13  17.343   1.047  -0.695
  103    H    GLU  14           H        GLU  14  14.678   2.251  -7.062
  104    HA   GLU  14           HA       GLU  14  12.244   1.125  -6.085
  105   1HB   GLU  14          1HB       GLU  14  12.267  -0.039  -8.364
  106   2HB   GLU  14          2HB       GLU  14  12.220   1.719  -8.365
  107   1HG   GLU  14          1HG       GLU  14  14.938   0.800  -8.384
  108   2HG   GLU  14          2HG       GLU  14  14.027   0.053  -9.695
  109    H    ASN  15           H        ASN  15  13.606   0.093  -4.290
  110    HA   ASN  15           HA       ASN  15  13.473  -2.683  -4.538
  111   1HB   ASN  15          1HB       ASN  15  16.016  -3.078  -4.222
  112   2HB   ASN  15          2HB       ASN  15  15.411  -2.790  -5.851
  113   1HD2  ASN  15          2HD2      ASN  15  16.264  -1.185  -6.993
  114   2HD2  ASN  15          1HD2      ASN  15  17.339   0.019  -6.378
  115    H    VAL  16           H        VAL  16  12.381  -1.250  -2.696
  116    HA   VAL  16           HA       VAL  16  14.166  -1.227  -0.363
  117    HB   VAL  16           HB       VAL  16  12.597   0.257   0.713
  118   1HG1  VAL  16          1HG1      VAL  16  13.317   1.037  -2.104
  119   2HG1  VAL  16          2HG1      VAL  16  12.635   2.169  -0.935
  120   3HG1  VAL  16          3HG1      VAL  16  14.190   1.400  -0.614
  121   1HG2  VAL  16          1HG2      VAL  16  10.688  -0.884  -0.917
  122   2HG2  VAL  16          2HG2      VAL  16  10.450   0.511   0.137
  123   3HG2  VAL  16          3HG2      VAL  16  10.850   0.747  -1.566
  124    H    ASP  17           H        ASP  17  12.566  -1.461   1.719
  125    HA   ASP  17           HA       ASP  17  11.101  -3.983   1.319
  126   1HB   ASP  17          1HB       ASP  17  12.848  -3.259   3.682
  127   2HB   ASP  17          2HB       ASP  17  11.918  -4.744   3.507
  128    H    ILE  18           H        ILE  18   9.086  -4.039   2.119
  129    HA   ILE  18           HA       ILE  18   7.903  -1.700   3.173
  130    HB   ILE  18           HB       ILE  18   6.893  -4.542   3.006
  131   1HG1  ILE  18          1HG1      ILE  18   5.599  -2.404   1.477
  132   2HG1  ILE  18          2HG1      ILE  18   7.286  -2.659   1.048
  133   1HG2  ILE  18          1HG2      ILE  18   5.450  -2.050   3.900
  134   2HG2  ILE  18          2HG2      ILE  18   4.642  -3.545   3.432
  135   3HG2  ILE  18          3HG2      ILE  18   5.719  -3.525   4.828
  136   1HD1  ILE  18          1HD1      ILE  18   5.663  -5.092   1.271
  137   2HD1  ILE  18          2HD1      ILE  18   5.231  -4.001  -0.044
  138   3HD1  ILE  18          3HD1      ILE  18   6.874  -4.634   0.074
  139    H    ILE  19           H        ILE  19   6.772  -1.580   5.255
  140    HA   ILE  19           HA       ILE  19   8.180  -3.099   7.345
  141    HB   ILE  19           HB       ILE  19   9.013  -1.292   8.350
  142   1HG1  ILE  19          1HG1      ILE  19   6.472   0.298   7.952
  143   2HG1  ILE  19          2HG1      ILE  19   6.733  -0.803   9.301
  144   1HG2  ILE  19          1HG2      ILE  19   8.024   0.092   5.868
  145   2HG2  ILE  19          2HG2      ILE  19   9.082   0.860   7.053
  146   3HG2  ILE  19          3HG2      ILE  19   9.626  -0.575   6.184
  147   1HD1  ILE  19          1HD1      ILE  19   8.675   0.543   9.981
  148   2HD1  ILE  19          2HD1      ILE  19   8.318   1.674   8.676
  149   3HD1  ILE  19          3HD1      ILE  19   7.165   1.454   9.993
  150    H    ALA  20           H        ALA  20   5.262  -1.378   6.409
  151    HA   ALA  20           HA       ALA  20   3.822  -2.796   8.552
  152   1HB   ALA  20          1HB       ALA  20   3.924  -0.259   8.661
  153   2HB   ALA  20          2HB       ALA  20   2.876  -0.267   7.243
  154   3HB   ALA  20          3HB       ALA  20   2.324  -0.995   8.751
  155    H    VAL  21           H        VAL  21   1.493  -3.200   8.015
  156    HA   VAL  21           HA       VAL  21   0.769  -3.363   5.238
  157    HB   VAL  21           HB       VAL  21   2.203  -5.365   5.465
  158   1HG1  VAL  21          1HG1      VAL  21   1.569  -5.653   7.935
  159   2HG1  VAL  21          2HG1      VAL  21   0.151  -6.510   7.331
  160   3HG1  VAL  21          3HG1      VAL  21   1.768  -7.109   6.959
  161   1HG2  VAL  21          1HG2      VAL  21  -0.047  -5.186   4.114
  162   2HG2  VAL  21          2HG2      VAL  21   0.828  -6.713   4.219
  163   3HG2  VAL  21          3HG2      VAL  21  -0.572  -6.427   5.252
  164    H    GLU  22           H        GLU  22  -1.292  -2.768   5.264
  165    HA   GLU  22           HA       GLU  22  -3.079  -3.949   7.270
  166   1HB   GLU  22          1HB       GLU  22  -2.900  -1.022   6.549
  167   2HB   GLU  22          2HB       GLU  22  -4.242  -1.727   7.440
  168   1HG   GLU  22          1HG       GLU  22  -1.984  -2.574   8.809
  169   2HG   GLU  22          2HG       GLU  22  -1.635  -0.903   8.365
  170    H    VAL  23           H        VAL  23  -3.178  -5.190   5.064
  171    HA   VAL  23           HA       VAL  23  -5.604  -4.249   3.740
  172    HB   VAL  23           HB       VAL  23  -4.608  -4.941   1.504
  173   1HG1  VAL  23          1HG1      VAL  23  -3.919  -2.479   3.034
  174   2HG1  VAL  23          2HG1      VAL  23  -3.216  -2.710   1.434
  175   3HG1  VAL  23          3HG1      VAL  23  -4.968  -2.680   1.631
  176   1HG2  VAL  23          1HG2      VAL  23  -2.066  -4.689   3.106
  177   2HG2  VAL  23          2HG2      VAL  23  -2.656  -6.119   2.259
  178   3HG2  VAL  23          3HG2      VAL  23  -2.135  -4.704   1.344
  179    H    ASN  24           H        ASN  24  -7.014  -5.853   3.828
  180    HA   ASN  24           HA       ASN  24  -6.030  -8.630   3.670
  181   1HB   ASN  24          1HB       ASN  24  -7.407  -7.424   5.757
  182   2HB   ASN  24          2HB       ASN  24  -8.646  -8.325   4.893
  183   1HD2  ASN  24          2HD2      ASN  24  -8.954 -10.272   5.673
  184   2HD2  ASN  24          1HD2      ASN  24  -7.753 -11.298   6.373
  185    H    VAL  25           H        VAL  25  -7.022  -6.713   1.587
  186    HA   VAL  25           HA       VAL  25  -8.196  -6.825  -0.352
  187    HB   VAL  25           HB       VAL  25  -8.728  -9.653   0.557
  188   1HG1  VAL  25          1HG1      VAL  25  -9.387  -8.291  -2.046
  189   2HG1  VAL  25          2HG1      VAL  25  -9.303 -10.043  -1.861
  190   3HG1  VAL  25          3HG1      VAL  25 -10.491  -9.116  -0.946
  191   1HG2  VAL  25          1HG2      VAL  25  -6.656  -8.349  -1.150
  192   2HG2  VAL  25          2HG2      VAL  25  -6.464  -9.546   0.131
  193   3HG2  VAL  25          3HG2      VAL  25  -7.107 -10.029  -1.438
  194    H    GLY  26           H        GLY  26 -10.392  -9.041   1.294
  195   1HA   GLY  26          1HA       GLY  26 -12.642  -8.859   1.712
  196   2HA   GLY  26          2HA       GLY  26 -12.644  -7.413   0.711
  197    H    ASP  27           H        ASP  27 -11.353  -5.540   1.862
  198    HA   ASP  27           HA       ASP  27 -12.482  -5.355   4.553
  199   1HB   ASP  27          1HB       ASP  27  -9.794  -5.538   4.079
  200   2HB   ASP  27          2HB       ASP  27 -10.031  -3.793   4.120
  201    H    THR  28           H        THR  28 -12.490  -2.964   5.293
  202    HA   THR  28           HA       THR  28 -13.592  -1.386   3.080
  203    HB   THR  28           HB       THR  28 -13.868  -0.858   6.040
  204    HG1  THR  28           HG1      THR  28 -15.295  -2.372   6.084
  205   1HG2  THR  28          1HG2      THR  28 -14.387   0.973   4.327
  206   2HG2  THR  28          2HG2      THR  28 -15.776  -0.024   3.896
  207   3HG2  THR  28          3HG2      THR  28 -15.608   0.591   5.541
  208    H    ILE  29           H        ILE  29 -12.767   0.551   2.482
  209    HA   ILE  29           HA       ILE  29 -10.568   1.667   4.083
  210    HB   ILE  29           HB       ILE  29  -9.380   2.249   1.979
  211   1HG1  ILE  29          1HG1      ILE  29 -10.508   0.236   0.289
  212   2HG1  ILE  29          2HG1      ILE  29 -11.798   1.313   0.814
  213   1HG2  ILE  29          1HG2      ILE  29  -9.471  -0.196   3.344
  214   2HG2  ILE  29          2HG2      ILE  29  -9.369  -0.601   1.629
  215   3HG2  ILE  29          3HG2      ILE  29  -8.150   0.443   2.364
  216   1HD1  ILE  29          1HD1      ILE  29  -9.232   2.370  -0.307
  217   2HD1  ILE  29          2HD1      ILE  29 -10.575   1.883  -1.341
  218   3HD1  ILE  29          3HD1      ILE  29 -10.794   3.177  -0.162
  219    H    ALA  30           H        ALA  30 -10.204   3.918   3.833
  220    HA   ALA  30           HA       ALA  30 -12.304   5.415   2.434
  221   1HB   ALA  30          1HB       ALA  30 -11.467   5.985   5.274
  222   2HB   ALA  30          2HB       ALA  30 -12.677   6.858   4.333
  223   3HB   ALA  30          3HB       ALA  30 -12.965   5.183   4.802
  224    H    VAL  31           H        VAL  31 -11.741   7.869   2.569
  225    HA   VAL  31           HA       VAL  31  -9.111   8.145   1.441
  226    HB   VAL  31           HB       VAL  31 -10.922  10.451   2.094
  227   1HG1  VAL  31          1HG1      VAL  31  -8.927   9.918  -0.103
  228   2HG1  VAL  31          2HG1      VAL  31  -9.938  11.358   0.014
  229   3HG1  VAL  31          3HG1      VAL  31  -8.734  11.023   1.259
  230   1HG2  VAL  31          1HG2      VAL  31 -11.575   8.201   0.441
  231   2HG2  VAL  31          2HG2      VAL  31 -12.539   9.631   0.810
  232   3HG2  VAL  31          3HG2      VAL  31 -11.419   9.649  -0.553
  233    H    ASP  32           H        ASP  32  -8.510   7.328   3.874
  234    HA   ASP  32           HA       ASP  32  -6.707   9.014   4.949
  235   1HB   ASP  32          1HB       ASP  32  -7.992   9.837   7.053
  236   2HB   ASP  32          2HB       ASP  32  -8.166  10.739   5.550
  237    H    ASP  33           H        ASP  33  -6.201   6.625   4.923
  238    HA   ASP  33           HA       ASP  33  -6.385   5.638   7.640
  239   1HB   ASP  33          1HB       ASP  33  -7.323   3.486   7.090
  240   2HB   ASP  33          2HB       ASP  33  -8.423   4.733   6.511
  241    H    THR  34           H        THR  34  -4.451   4.882   8.195
  242    HA   THR  34           HA       THR  34  -2.305   4.720   6.416
  243    HB   THR  34           HB       THR  34  -1.432   3.189   8.428
  244    HG1  THR  34           HG1      THR  34  -2.443   3.736  10.304
  245   1HG2  THR  34          1HG2      THR  34  -0.485   5.344   7.727
  246   2HG2  THR  34          2HG2      THR  34  -1.742   6.164   8.657
  247   3HG2  THR  34          3HG2      THR  34  -0.553   5.153   9.480
  248    H    LEU  35           H        LEU  35  -1.907   3.318   4.894
  249    HA   LEU  35           HA       LEU  35  -3.117   0.669   4.984
  250   1HB   LEU  35          1HB       LEU  35  -1.786   2.321   2.872
  251   2HB   LEU  35          2HB       LEU  35  -1.889   0.582   2.662
  252    HG   LEU  35           HG       LEU  35  -4.299   2.323   3.160
  253   1HD1  LEU  35          1HD1      LEU  35  -2.750   2.471   0.917
  254   2HD1  LEU  35          2HD1      LEU  35  -3.927   1.234   0.474
  255   3HD1  LEU  35          3HD1      LEU  35  -4.475   2.830   0.989
  256   1HD2  LEU  35          1HD2      LEU  35  -3.878  -0.479   3.129
  257   2HD2  LEU  35          2HD2      LEU  35  -5.396   0.402   3.300
  258   3HD2  LEU  35          3HD2      LEU  35  -4.819  -0.056   1.698
  259    H    ILE  36           H        ILE  36   0.042   2.222   4.895
  260    HA   ILE  36           HA       ILE  36   1.234  -0.029   6.231
  261    HB   ILE  36           HB       ILE  36   2.865  -0.662   4.647
  262   1HG1  ILE  36          1HG1      ILE  36   3.280   1.662   3.753
  263   2HG1  ILE  36          2HG1      ILE  36   3.287   0.393   2.537
  264   1HG2  ILE  36          1HG2      ILE  36   0.681  -1.665   4.286
  265   2HG2  ILE  36          2HG2      ILE  36   0.272  -0.378   3.150
  266   3HG2  ILE  36          3HG2      ILE  36   1.577  -1.504   2.776
  267   1HD1  ILE  36          1HD1      ILE  36   0.857   2.031   3.106
  268   2HD1  ILE  36          2HD1      ILE  36   2.104   2.553   1.976
  269   3HD1  ILE  36          3HD1      ILE  36   1.221   1.055   1.686
  270    H    THR  37           H        THR  37   3.915   0.592   5.650
  271    HA   THR  37           HA       THR  37   4.371   3.387   6.094
  272    HB   THR  37           HB       THR  37   4.956   1.419   8.316
  273    HG1  THR  37           HG1      THR  37   3.363   3.743   8.451
  274   1HG2  THR  37          1HG2      THR  37   5.775   4.265   7.927
  275   2HG2  THR  37          2HG2      THR  37   5.536   3.599   9.543
  276   3HG2  THR  37          3HG2      THR  37   6.737   2.889   8.465
  277    H    LEU  38           H        LEU  38   5.178   2.029   4.029
  278    HA   LEU  38           HA       LEU  38   7.382   0.476   3.910
  279   1HB   LEU  38          1HB       LEU  38   5.979   2.050   2.129
  280   2HB   LEU  38          2HB       LEU  38   7.606   2.702   2.045
  281    HG   LEU  38           HG       LEU  38   8.120   0.042   1.865
  282   1HD1  LEU  38          1HD1      LEU  38   5.720  -0.489   1.827
  283   2HD1  LEU  38          2HD1      LEU  38   5.536   0.509   0.385
  284   3HD1  LEU  38          3HD1      LEU  38   6.532  -0.946   0.328
  285   1HD2  LEU  38          1HD2      LEU  38   9.009   1.820   0.443
  286   2HD2  LEU  38          2HD2      LEU  38   8.438   0.455  -0.515
  287   3HD2  LEU  38          3HD2      LEU  38   7.465   1.922  -0.400
  288    H    GLU  39           H        GLU  39   9.658   0.989   3.362
  289    HA   GLU  39           HA       GLU  39  10.842   3.451   4.088
  290   1HB   GLU  39          1HB       GLU  39  10.215   2.809   6.342
  291   2HB   GLU  39          2HB       GLU  39  10.985   1.242   6.141
  292   1HG   GLU  39          1HG       GLU  39  13.152   2.482   5.807
  293   2HG   GLU  39          2HG       GLU  39  12.302   3.935   6.325
  294    H    THR  40           H        THR  40  13.144   3.436   3.884
  295    HA   THR  40           HA       THR  40  14.108   1.148   2.321
  296    HB   THR  40           HB       THR  40  15.774   2.670   1.406
  297    HG1  THR  40           HG1      THR  40  16.199   4.544   2.273
  298   1HG2  THR  40          1HG2      THR  40  13.143   2.825   0.816
  299   2HG2  THR  40          2HG2      THR  40  13.495   4.498   1.246
  300   3HG2  THR  40          3HG2      THR  40  14.416   3.703  -0.034
  301    H    ASP  41           H        ASP  41  16.000   3.545   4.079
  302    HA   ASP  41           HA       ASP  41  16.866   1.596   6.042
  303   1HB   ASP  41          1HB       ASP  41  18.316   1.339   3.946
  304   2HB   ASP  41          2HB       ASP  41  18.960   2.932   4.332
  305    H    LYS  42           H        LYS  42  15.543   4.316   5.793
  306    HA   LYS  42           HA       LYS  42  16.529   5.459   8.138
  307   1HB   LYS  42          1HB       LYS  42  18.396   5.950   6.355
  308   2HB   LYS  42          2HB       LYS  42  17.291   7.218   5.839
  309   1HG   LYS  42          1HG       LYS  42  17.857   8.527   7.539
  310   2HG   LYS  42          2HG       LYS  42  17.662   7.220   8.709
  311   1HD   LYS  42          1HD       LYS  42  19.863   6.752   8.734
  312   2HD   LYS  42          2HD       LYS  42  20.034   6.988   6.994
  313   1HE   LYS  42          1HE       LYS  42  21.328   8.680   8.020
  314   2HE   LYS  42          2HE       LYS  42  19.861   9.466   7.436
  315   1HZ   LYS  42          1HZ       LYS  42  19.007   9.020   9.806
  316   2HZ   LYS  42          2HZ       LYS  42  20.639   8.830  10.206
  317   3HZ   LYS  42          3HZ       LYS  42  20.093  10.296   9.562
  318    H    ALA  43           H        ALA  43  15.047   6.148   5.000
  319    HA   ALA  43           HA       ALA  43  13.215   8.050   6.268
  320   1HB   ALA  43          1HB       ALA  43  14.198   7.624   3.525
  321   2HB   ALA  43          2HB       ALA  43  12.504   8.100   3.662
  322   3HB   ALA  43          3HB       ALA  43  13.768   9.116   4.361
  323    H    THR  44           H        THR  44  11.548   7.048   7.223
  324    HA   THR  44           HA       THR  44  10.339   4.712   5.967
  325    HB   THR  44           HB       THR  44   9.270   4.288   7.999
  326    HG1  THR  44           HG1      THR  44   9.584   7.047   8.493
  327   1HG2  THR  44          1HG2      THR  44  12.003   4.925   8.131
  328   2HG2  THR  44          2HG2      THR  44  11.255   5.561   9.596
  329   3HG2  THR  44          3HG2      THR  44  11.079   3.855   9.185
  330    H    MET  45           H        MET  45   8.799   5.003   4.510
  331    HA   MET  45           HA       MET  45   7.226   7.464   4.562
  332   1HB   MET  45          1HB       MET  45   8.357   6.010   2.493
  333   2HB   MET  45          2HB       MET  45   6.645   5.626   2.380
  334   1HG   MET  45          1HG       MET  45   7.267   7.547   1.001
  335   2HG   MET  45          2HG       MET  45   6.086   7.966   2.236
  336   1HE   MET  45          1HE       MET  45   6.936  10.040   0.931
  337   2HE   MET  45          2HE       MET  45   6.971  11.009   2.404
  338   3HE   MET  45          3HE       MET  45   8.381  10.963   1.345
  339    H    ASP  46           H        ASP  46   5.060   7.558   4.843
  340    HA   ASP  46           HA       ASP  46   3.680   5.033   5.467
  341   1HB   ASP  46          1HB       ASP  46   3.370   7.743   6.768
  342   2HB   ASP  46          2HB       ASP  46   2.279   6.389   7.049
  343    H    VAL  47           H        VAL  47   1.585   4.764   4.749
  344    HA   VAL  47           HA       VAL  47   0.598   6.836   2.902
  345    HB   VAL  47           HB       VAL  47   0.468   3.836   2.590
  346   1HG1  VAL  47          1HG1      VAL  47  -1.411   5.774   1.690
  347   2HG1  VAL  47          2HG1      VAL  47  -0.519   5.182   0.288
  348   3HG1  VAL  47          3HG1      VAL  47  -1.362   4.046   1.342
  349   1HG2  VAL  47          1HG2      VAL  47   1.820   6.026   1.034
  350   2HG2  VAL  47          2HG2      VAL  47   2.570   4.671   1.876
  351   3HG2  VAL  47          3HG2      VAL  47   1.614   4.386   0.423
  352    HA   PRO  48           HA       PRO  48  -2.937   6.353   5.667
  353   1HB   PRO  48          1HB       PRO  48  -3.941   8.796   5.358
  354   2HB   PRO  48          2HB       PRO  48  -2.440   8.544   6.257
  355   1HG   PRO  48          1HG       PRO  48  -2.843   9.572   3.488
  356   2HG   PRO  48          2HG       PRO  48  -1.646  10.054   4.702
  357   1HD   PRO  48          1HD       PRO  48  -1.219   8.282   2.566
  358   2HD   PRO  48          2HD       PRO  48  -0.161   8.499   3.974
  359    H    ALA  49           H        ALA  49  -2.937   5.383   2.874
  360    HA   ALA  49           HA       ALA  49  -4.381   4.804   1.215
  361   1HB   ALA  49          1HB       ALA  49  -6.649   4.347   1.861
  362   2HB   ALA  49          2HB       ALA  49  -5.577   3.902   3.189
  363   3HB   ALA  49          3HB       ALA  49  -6.503   5.400   3.270
  364    H    GLU  50           H        GLU  50  -6.282   5.547  -0.123
  365    HA   GLU  50           HA       GLU  50  -7.107   8.265   0.041
  366   1HB   GLU  50          1HB       GLU  50  -4.657   8.261  -0.870
  367   2HB   GLU  50          2HB       GLU  50  -5.405   7.708  -2.362
  368   1HG   GLU  50          1HG       GLU  50  -5.635   9.865  -2.844
  369   2HG   GLU  50          2HG       GLU  50  -6.967   9.847  -1.691
  370    H    VAL  51           H        VAL  51  -8.924   6.626  -0.006
  371    HA   VAL  51           HA       VAL  51 -10.240   6.803  -2.504
  372    HB   VAL  51           HB       VAL  51 -10.379   4.081  -2.471
  373   1HG1  VAL  51          1HG1      VAL  51  -9.885   5.905  -4.301
  374   2HG1  VAL  51          2HG1      VAL  51  -8.229   5.331  -4.103
  375   3HG1  VAL  51          3HG1      VAL  51  -9.502   4.206  -4.580
  376   1HG2  VAL  51          1HG2      VAL  51  -8.288   4.407  -0.824
  377   2HG2  VAL  51          2HG2      VAL  51  -8.427   3.043  -1.933
  378   3HG2  VAL  51          3HG2      VAL  51  -7.440   4.436  -2.370
  379    H    ALA  52           H        ALA  52 -12.246   5.241  -2.482
  380    HA   ALA  52           HA       ALA  52 -13.214   4.875   0.265
  381   1HB   ALA  52          1HB       ALA  52 -14.742   6.344  -1.876
  382   2HB   ALA  52          2HB       ALA  52 -15.303   5.985  -0.240
  383   3HB   ALA  52          3HB       ALA  52 -13.949   7.091  -0.479
  384    H    GLY  53           H        GLY  53 -12.880   2.591  -0.344
  385   1HA   GLY  53          1HA       GLY  53 -14.051   1.306  -2.479
  386   2HA   GLY  53          2HA       GLY  53 -15.336   1.479  -1.299
  387    H    VAL  54           H        VAL  54 -13.787  -0.839  -2.444
  388    HA   VAL  54           HA       VAL  54 -12.849  -2.042   0.075
  389    HB   VAL  54           HB       VAL  54 -14.648  -3.337  -1.983
  390   1HG1  VAL  54          1HG1      VAL  54 -13.228  -4.421   0.429
  391   2HG1  VAL  54          2HG1      VAL  54 -14.715  -5.160  -0.164
  392   3HG1  VAL  54          3HG1      VAL  54 -13.295  -5.074  -1.207
  393   1HG2  VAL  54          1HG2      VAL  54 -15.130  -2.184   0.733
  394   2HG2  VAL  54          2HG2      VAL  54 -16.075  -2.008  -0.745
  395   3HG2  VAL  54          3HG2      VAL  54 -16.120  -3.524   0.156
  396    H    VAL  55           H        VAL  55 -11.063  -3.360  -0.099
  397    HA   VAL  55           HA       VAL  55  -9.611  -3.228  -2.579
  398    HB   VAL  55           HB       VAL  55  -8.853  -4.693  -0.055
  399   1HG1  VAL  55          1HG1      VAL  55  -7.715  -5.490  -2.111
  400   2HG1  VAL  55          2HG1      VAL  55  -7.139  -3.845  -2.390
  401   3HG1  VAL  55          3HG1      VAL  55  -6.611  -4.732  -0.961
  402   1HG2  VAL  55          1HG2      VAL  55  -9.144  -2.004  -0.302
  403   2HG2  VAL  55          2HG2      VAL  55  -8.016  -2.792   0.801
  404   3HG2  VAL  55          3HG2      VAL  55  -7.455  -2.214  -0.769
  405    H    LYS  56           H        LYS  56  -8.960  -4.891  -3.869
  406    HA   LYS  56           HA       LYS  56 -10.416  -7.435  -3.540
  407   1HB   LYS  56          1HB       LYS  56  -9.524  -7.008  -6.250
  408   2HB   LYS  56          2HB       LYS  56 -11.155  -7.304  -5.660
  409   1HG   LYS  56          1HG       LYS  56  -9.920  -4.577  -5.536
  410   2HG   LYS  56          2HG       LYS  56 -10.718  -5.168  -6.995
  411   1HD   LYS  56          1HD       LYS  56 -11.989  -5.010  -4.263
  412   2HD   LYS  56          2HD       LYS  56 -12.219  -3.832  -5.557
  413   1HE   LYS  56          1HE       LYS  56 -13.816  -5.085  -6.456
  414   2HE   LYS  56          2HE       LYS  56 -12.709  -6.452  -6.582
  415   1HZ   LYS  56          1HZ       LYS  56 -13.860  -5.897  -3.956
  416   2HZ   LYS  56          2HZ       LYS  56 -14.894  -6.543  -5.127
  417   3HZ   LYS  56          3HZ       LYS  56 -13.490  -7.378  -4.683
  418    H    GLU  57           H        GLU  57  -7.545  -5.823  -4.783
  419    HA   GLU  57           HA       GLU  57  -6.132  -8.364  -4.620
  420   1HB   GLU  57          1HB       GLU  57  -5.969  -6.074  -6.463
  421   2HB   GLU  57          2HB       GLU  57  -4.423  -6.776  -6.001
  422   1HG   GLU  57          1HG       GLU  57  -5.324  -9.000  -6.701
  423   2HG   GLU  57          2HG       GLU  57  -6.734  -8.156  -7.339
  424    H    VAL  58           H        VAL  58  -3.909  -8.328  -3.882
  425    HA   VAL  58           HA       VAL  58  -3.034  -6.048  -2.306
  426    HB   VAL  58           HB       VAL  58  -4.426  -7.226  -0.693
  427   1HG1  VAL  58          1HG1      VAL  58  -3.471  -9.523  -2.024
  428   2HG1  VAL  58          2HG1      VAL  58  -2.942  -9.637  -0.344
  429   3HG1  VAL  58          3HG1      VAL  58  -4.653  -9.431  -0.716
  430   1HG2  VAL  58          1HG2      VAL  58  -2.360  -6.193   0.105
  431   2HG2  VAL  58          2HG2      VAL  58  -2.757  -7.633   1.044
  432   3HG2  VAL  58          3HG2      VAL  58  -1.490  -7.700  -0.183
  433    H    LYS  59           H        LYS  59  -0.972  -5.810  -2.786
  434    HA   LYS  59           HA       LYS  59   0.694  -8.206  -3.152
  435   1HB   LYS  59          1HB       LYS  59   1.135  -5.727  -4.777
  436   2HB   LYS  59          2HB       LYS  59   1.665  -7.374  -5.103
  437   1HG   LYS  59          1HG       LYS  59  -1.014  -7.707  -5.141
  438   2HG   LYS  59          2HG       LYS  59  -0.883  -6.048  -5.724
  439   1HD   LYS  59          1HD       LYS  59   1.038  -7.181  -7.205
  440   2HD   LYS  59          2HD       LYS  59  -0.015  -8.579  -6.978
  441   1HE   LYS  59          1HE       LYS  59  -1.730  -6.459  -7.589
  442   2HE   LYS  59          2HE       LYS  59  -0.359  -6.273  -8.683
  443   1HZ   LYS  59          1HZ       LYS  59  -0.667  -8.688  -9.229
  444   2HZ   LYS  59          2HZ       LYS  59  -2.133  -8.627  -8.388
  445   3HZ   LYS  59          3HZ       LYS  59  -1.906  -7.664  -9.759
  446    H    VAL  60           H        VAL  60   1.017  -7.556  -0.813
  447    HA   VAL  60           HA       VAL  60   3.551  -6.347  -0.531
  448    HB   VAL  60           HB       VAL  60   2.702  -4.208  -0.691
  449   1HG1  VAL  60          1HG1      VAL  60   0.222  -5.163   0.725
  450   2HG1  VAL  60          2HG1      VAL  60   0.521  -3.491   0.255
  451   3HG1  VAL  60          3HG1      VAL  60   0.384  -4.743  -0.980
  452   1HG2  VAL  60          1HG2      VAL  60   3.795  -4.616   1.562
  453   2HG2  VAL  60          2HG2      VAL  60   2.787  -3.177   1.428
  454   3HG2  VAL  60          3HG2      VAL  60   2.170  -4.614   2.242
  455    H    LYS  61           H        LYS  61   4.358  -6.469   1.608
  456    HA   LYS  61           HA       LYS  61   2.821  -7.405   3.800
  457   1HB   LYS  61          1HB       LYS  61   3.532  -9.668   3.961
  458   2HB   LYS  61          2HB       LYS  61   2.922  -9.454   2.326
  459   1HG   LYS  61          1HG       LYS  61   4.837 -10.620   1.908
  460   2HG   LYS  61          2HG       LYS  61   5.443  -8.967   1.788
  461   1HD   LYS  61          1HD       LYS  61   6.910  -9.399   3.400
  462   2HD   LYS  61          2HD       LYS  61   5.579  -9.730   4.511
  463   1HE   LYS  61          1HE       LYS  61   5.539 -12.061   3.399
  464   2HE   LYS  61          2HE       LYS  61   7.152 -11.642   2.823
  465   1HZ   LYS  61          1HZ       LYS  61   7.302 -11.012   5.431
  466   2HZ   LYS  61          2HZ       LYS  61   6.275 -12.356   5.476
  467   3HZ   LYS  61          3HZ       LYS  61   7.807 -12.486   4.771
  468    H    VAL  62           H        VAL  62   4.335  -8.177   5.616
  469    HA   VAL  62           HA       VAL  62   6.470  -6.244   5.802
  470    HB   VAL  62           HB       VAL  62   5.603  -8.326   7.812
  471   1HG1  VAL  62          1HG1      VAL  62   7.439  -5.950   7.994
  472   2HG1  VAL  62          2HG1      VAL  62   6.723  -6.717   9.411
  473   3HG1  VAL  62          3HG1      VAL  62   7.798  -7.638   8.359
  474   1HG2  VAL  62          1HG2      VAL  62   4.178  -6.123   6.918
  475   2HG2  VAL  62          2HG2      VAL  62   3.914  -7.006   8.422
  476   3HG2  VAL  62          3HG2      VAL  62   4.937  -5.569   8.411
  477    H    GLY  63           H        GLY  63   8.014  -6.986   4.306
  478   1HA   GLY  63          1HA       GLY  63   9.315  -9.538   5.028
  479   2HA   GLY  63          2HA       GLY  63  10.251  -8.074   4.771
  480    H    ASP  64           H        ASP  64   9.077  -7.022   2.519
  481    HA   ASP  64           HA       ASP  64   9.880  -9.003   0.514
  482   1HB   ASP  64          1HB       ASP  64   7.976  -8.208  -0.949
  483   2HB   ASP  64          2HB       ASP  64   7.502  -9.184   0.440
  484    H    LYS  65           H        LYS  65   9.893  -7.816  -1.739
  485    HA   LYS  65           HA       LYS  65  11.412  -5.334  -1.337
  486   1HB   LYS  65          1HB       LYS  65  12.274  -7.525  -2.575
  487   2HB   LYS  65          2HB       LYS  65  11.442  -6.789  -3.939
  488   1HG   LYS  65          1HG       LYS  65  13.027  -5.246  -4.218
  489   2HG   LYS  65          2HG       LYS  65  13.165  -4.937  -2.486
  490   1HD   LYS  65          1HD       LYS  65  14.411  -7.148  -2.346
  491   2HD   LYS  65          2HD       LYS  65  14.494  -7.094  -4.108
  492   1HE   LYS  65          1HE       LYS  65  15.757  -5.081  -4.068
  493   2HE   LYS  65          2HE       LYS  65  15.462  -4.856  -2.345
  494   1HZ   LYS  65          1HZ       LYS  65  16.683  -7.084  -2.111
  495   2HZ   LYS  65          2HZ       LYS  65  17.252  -6.785  -3.675
  496   3HZ   LYS  65          3HZ       LYS  65  17.601  -5.699  -2.427
  497    H    ILE  66           H        ILE  66  11.149  -3.597  -2.877
  498    HA   ILE  66           HA       ILE  66   8.658  -3.641  -4.404
  499    HB   ILE  66           HB       ILE  66   8.989  -2.272  -1.902
  500   1HG1  ILE  66          1HG1      ILE  66   6.570  -1.824  -2.240
  501   2HG1  ILE  66          2HG1      ILE  66   6.721  -2.436  -3.886
  502   1HG2  ILE  66          1HG2      ILE  66   9.775  -0.381  -3.355
  503   2HG2  ILE  66          2HG2      ILE  66   8.175  -0.383  -4.093
  504   3HG2  ILE  66          3HG2      ILE  66   8.351  -0.040  -2.375
  505   1HD1  ILE  66          1HD1      ILE  66   7.683  -4.189  -1.716
  506   2HD1  ILE  66          2HD1      ILE  66   5.940  -3.946  -1.847
  507   3HD1  ILE  66          3HD1      ILE  66   6.845  -4.587  -3.217
  508    H    SER  67           H        SER  67   8.444  -1.486  -5.669
  509    HA   SER  67           HA       SER  67  11.011  -0.346  -6.442
  510   1HB   SER  67          1HB       SER  67  10.370  -0.747  -8.901
  511   2HB   SER  67          2HB       SER  67  10.994  -2.124  -7.995
  512    HG   SER  67           HG       SER  67   9.172  -2.801  -9.063
  513    H    GLU  68           H        GLU  68   9.106   0.971  -5.067
  514    HA   GLU  68           HA       GLU  68   7.563   2.671  -5.063
  515   1HB   GLU  68          1HB       GLU  68   9.506   3.525  -7.212
  516   2HB   GLU  68          2HB       GLU  68   8.313   4.595  -6.489
  517   1HG   GLU  68          1HG       GLU  68   9.345   4.433  -4.352
  518   2HG   GLU  68          2HG       GLU  68  10.414   3.144  -4.906
  519    H    GLY  69           H        GLY  69   6.222   0.761  -6.246
  520   1HA   GLY  69          1HA       GLY  69   5.247   1.804  -8.819
  521   2HA   GLY  69          2HA       GLY  69   4.111   1.556  -7.500
  522    H    GLY  70           H        GLY  70   4.168  -0.709  -6.538
  523   1HA   GLY  70          1HA       GLY  70   4.791  -3.052  -7.031
  524   2HA   GLY  70          2HA       GLY  70   4.554  -2.662  -8.728
  525    H    LEU  71           H        LEU  71   2.139  -1.053  -8.119
  526    HA   LEU  71           HA       LEU  71  -0.115  -1.299  -7.825
  527   1HB   LEU  71          1HB       LEU  71   0.223  -2.543  -9.908
  528   2HB   LEU  71          2HB       LEU  71   0.534  -4.007  -8.995
  529    HG   LEU  71           HG       LEU  71  -1.719  -4.209  -8.326
  530   1HD1  LEU  71          1HD1      LEU  71  -1.809  -1.317  -8.900
  531   2HD1  LEU  71          2HD1      LEU  71  -3.276  -2.231  -9.254
  532   3HD1  LEU  71          3HD1      LEU  71  -2.597  -2.250  -7.627
  533   1HD2  LEU  71          1HD2      LEU  71  -1.275  -3.487 -11.172
  534   2HD2  LEU  71          2HD2      LEU  71  -1.761  -5.023 -10.456
  535   3HD2  LEU  71          3HD2      LEU  71  -2.935  -3.716 -10.624
  536    H    ILE  72           H        ILE  72   0.876  -1.476  -5.449
  537    HA   ILE  72           HA       ILE  72   0.877  -3.744  -3.948
  538    HB   ILE  72           HB       ILE  72   0.193  -0.910  -3.328
  539   1HG1  ILE  72          1HG1      ILE  72   2.147  -2.469  -1.759
  540   2HG1  ILE  72          2HG1      ILE  72   2.506  -2.309  -3.475
  541   1HG2  ILE  72          1HG2      ILE  72  -0.594  -3.204  -1.640
  542   2HG2  ILE  72          2HG2      ILE  72   0.274  -1.903  -0.823
  543   3HG2  ILE  72          3HG2      ILE  72  -1.223  -1.556  -1.686
  544   1HD1  ILE  72          1HD1      ILE  72   1.710   0.198  -2.253
  545   2HD1  ILE  72          2HD1      ILE  72   3.148  -0.512  -1.516
  546   3HD1  ILE  72          3HD1      ILE  72   3.113  -0.187  -3.248
  547    H    VAL  73           H        VAL  73  -1.969  -1.663  -3.534
  548    HA   VAL  73           HA       VAL  73  -3.633  -4.088  -3.744
  549    HB   VAL  73           HB       VAL  73  -5.103  -3.198  -2.023
  550   1HG1  VAL  73          1HG1      VAL  73  -2.492  -4.158  -1.634
  551   2HG1  VAL  73          2HG1      VAL  73  -2.734  -2.885  -0.439
  552   3HG1  VAL  73          3HG1      VAL  73  -3.853  -4.247  -0.516
  553   1HG2  VAL  73          1HG2      VAL  73  -3.152  -0.902  -1.934
  554   2HG2  VAL  73          2HG2      VAL  73  -4.863  -0.838  -2.359
  555   3HG2  VAL  73          3HG2      VAL  73  -4.379  -1.210  -0.705
  556    H    VAL  74           H        VAL  74  -5.882  -3.729  -4.284
  557    HA   VAL  74           HA       VAL  74  -6.362  -1.288  -5.869
  558    HB   VAL  74           HB       VAL  74  -7.122  -4.115  -6.654
  559   1HG1  VAL  74          1HG1      VAL  74  -8.459  -1.803  -7.275
  560   2HG1  VAL  74          2HG1      VAL  74  -7.380  -2.011  -8.655
  561   3HG1  VAL  74          3HG1      VAL  74  -8.500  -3.298  -8.210
  562   1HG2  VAL  74          1HG2      VAL  74  -4.848  -2.369  -7.343
  563   2HG2  VAL  74          2HG2      VAL  74  -4.971  -4.129  -7.341
  564   3HG2  VAL  74          3HG2      VAL  74  -5.620  -3.201  -8.693
  565    H    VAL  75           H        VAL  75  -8.106  -0.250  -5.120
  566    HA   VAL  75           HA       VAL  75 -10.125  -1.783  -3.640
  567    HB   VAL  75           HB       VAL  75 -10.655   0.280  -2.475
  568   1HG1  VAL  75          1HG1      VAL  75  -8.328  -1.224  -2.197
  569   2HG1  VAL  75          2HG1      VAL  75  -7.815   0.454  -2.033
  570   3HG1  VAL  75          3HG1      VAL  75  -9.076  -0.188  -0.981
  571   1HG2  VAL  75          1HG2      VAL  75  -9.566   1.533  -4.647
  572   2HG2  VAL  75          2HG2      VAL  75  -9.992   2.315  -3.128
  573   3HG2  VAL  75          3HG2      VAL  75  -8.335   1.781  -3.411
  574    H    GLU  76           H        GLU  76 -12.331  -1.146  -3.777
  575    HA   GLU  76           HA       GLU  76 -13.243  -0.697  -6.415
  576   1HB   GLU  76          1HB       GLU  76 -14.365  -1.674  -4.102
  577   2HB   GLU  76          2HB       GLU  76 -15.154  -0.108  -4.256
  578   1HG   GLU  76          1HG       GLU  76 -15.214  -1.284  -6.807
  579   2HG   GLU  76          2HG       GLU  76 -15.673  -2.540  -5.657
  580    H    ALA  77           H        ALA  77 -12.618   1.347  -3.684
  581    HA   ALA  77           HA       ALA  77 -12.664   3.571  -3.332
  582   1HB   ALA  77          1HB       ALA  77 -11.071   3.275  -5.267
  583   2HB   ALA  77          2HB       ALA  77 -11.710   4.895  -4.994
  584   3HB   ALA  77          3HB       ALA  77 -12.368   3.894  -6.288
  585    H    GLU  78           H        GLU  78 -13.758   5.609  -3.637
  586    HA   GLU  78           HA       GLU  78 -15.562   6.950  -3.975
  587   1HB   GLU  78          1HB       GLU  78 -16.650   4.922  -5.901
  588   2HB   GLU  78          2HB       GLU  78 -16.980   6.646  -5.836
  589   1HG   GLU  78          1HG       GLU  78 -15.117   7.189  -6.976
  590   2HG   GLU  78          2HG       GLU  78 -14.165   5.894  -6.250
  591    H    GLY  79           H        GLY  79 -16.857   3.657  -4.357
  592   1HA   GLY  79          1HA       GLY  79 -18.276   3.943  -1.818
  593   2HA   GLY  79          2HA       GLY  79 -18.097   2.461  -2.745
  594    H    THR  80           H        THR  80 -20.510   2.731  -1.869
  595    HA   THR  80           HA       THR  80 -22.298   4.381  -3.260
  596    HB   THR  80           HB       THR  80 -21.755   3.268  -5.279
  597    HG1  THR  80           HG1      THR  80 -23.933   3.397  -5.186
  598   1HG2  THR  80          1HG2      THR  80 -20.763   1.232  -3.965
  599   2HG2  THR  80          2HG2      THR  80 -22.365   0.550  -4.249
  600   3HG2  THR  80          3HG2      THR  80 -21.363   1.048  -5.614
  601    H    ALA  81           H        ALA  81 -21.945   1.039  -2.091
  602    HA   ALA  81           HA       ALA  81 -24.105   1.517  -0.189
  603   1HB   ALA  81          1HB       ALA  81 -25.228   0.587  -2.148
  604   2HB   ALA  81          2HB       ALA  81 -25.274  -0.540  -0.793
  605   3HB   ALA  81          3HB       ALA  81 -24.141  -0.801  -2.119

  No H/Q in entry =         605
  Start of MODEL    9
    1    H1   ALA   1           H1       ALA   1 -13.239   5.299 -10.585
    2    H2   ALA   1           H2       ALA   1 -14.769   5.240 -11.354
    3    H3   ALA   1           H3       ALA   1 -14.658   5.065  -9.650
    4    HA   ALA   1           HA       ALA   1 -15.023   2.965 -10.552
    5   1HB   ALA   1          1HB       ALA   1 -14.084   2.152 -12.448
    6   2HB   ALA   1          2HB       ALA   1 -12.548   2.974 -12.174
    7   3HB   ALA   1          3HB       ALA   1 -13.927   3.871 -12.809
    8    H    LEU   2           H        LEU   2 -13.105   1.071 -10.634
    9    HA   LEU   2           HA       LEU   2 -12.226   0.849  -8.019
   10   1HB   LEU   2          1HB       LEU   2 -11.234  -0.445 -10.551
   11   2HB   LEU   2          2HB       LEU   2 -10.602  -0.870  -8.972
   12    HG   LEU   2           HG       LEU   2 -13.345  -1.092  -8.645
   13   1HD1  LEU   2          1HD1      LEU   2 -12.806  -1.227 -11.423
   14   2HD1  LEU   2          2HD1      LEU   2 -13.199  -2.854 -10.867
   15   3HD1  LEU   2          3HD1      LEU   2 -14.326  -1.528 -10.581
   16   1HD2  LEU   2          1HD2      LEU   2 -11.526  -2.559  -7.791
   17   2HD2  LEU   2          2HD2      LEU   2 -12.908  -3.440  -8.440
   18   3HD2  LEU   2          3HD2      LEU   2 -11.430  -3.296  -9.390
   19    H    VAL   3           H        VAL   3  -9.791   0.451  -7.497
   20    HA   VAL   3           HA       VAL   3  -8.094   2.509  -8.693
   21    HB   VAL   3           HB       VAL   3  -8.954   2.423  -5.817
   22   1HG1  VAL   3          1HG1      VAL   3  -6.509   2.324  -5.739
   23   2HG1  VAL   3          2HG1      VAL   3  -6.418   3.728  -6.805
   24   3HG1  VAL   3          3HG1      VAL   3  -7.107   3.892  -5.191
   25   1HG2  VAL   3          1HG2      VAL   3 -10.100   3.921  -7.378
   26   2HG2  VAL   3          2HG2      VAL   3  -9.230   4.812  -6.130
   27   3HG2  VAL   3          3HG2      VAL   3  -8.559   4.693  -7.756
   28    H    GLU   4           H        GLU   4  -5.856   2.217  -8.312
   29    HA   GLU   4           HA       GLU   4  -5.098  -0.410  -7.224
   30   1HB   GLU   4          1HB       GLU   4  -4.080   0.885  -9.760
   31   2HB   GLU   4          2HB       GLU   4  -3.388  -0.557  -9.033
   32   1HG   GLU   4          1HG       GLU   4  -5.074  -1.890  -9.729
   33   2HG   GLU   4          2HG       GLU   4  -6.286  -0.618  -9.588
   34    H    LEU   5           H        LEU   5  -4.166   0.239  -5.345
   35    HA   LEU   5           HA       LEU   5  -2.724   2.613  -4.970
   36   1HB   LEU   5          1HB       LEU   5  -3.340   0.241  -3.434
   37   2HB   LEU   5          2HB       LEU   5  -1.701   0.782  -3.124
   38    HG   LEU   5           HG       LEU   5  -3.994   2.714  -2.995
   39   1HD1  LEU   5          1HD1      LEU   5  -4.357   0.635  -1.541
   40   2HD1  LEU   5          2HD1      LEU   5  -2.996   1.231  -0.590
   41   3HD1  LEU   5          3HD1      LEU   5  -4.449   2.216  -0.766
   42   1HD2  LEU   5          1HD2      LEU   5  -1.245   2.968  -2.771
   43   2HD2  LEU   5          2HD2      LEU   5  -2.456   4.146  -2.261
   44   3HD2  LEU   5          3HD2      LEU   5  -1.818   2.978  -1.104
   45    H    LYS   6           H        LYS   6  -0.442   2.890  -4.530
   46    HA   LYS   6           HA       LYS   6   1.329   0.926  -5.776
   47   1HB   LYS   6          1HB       LYS   6   1.076   3.815  -6.604
   48   2HB   LYS   6          2HB       LYS   6   2.491   2.841  -6.974
   49   1HG   LYS   6          1HG       LYS   6   0.527   1.227  -7.888
   50   2HG   LYS   6          2HG       LYS   6  -0.187   2.816  -8.172
   51   1HD   LYS   6          1HD       LYS   6   2.230   3.316  -9.138
   52   2HD   LYS   6          2HD       LYS   6   2.229   1.568  -9.374
   53   1HE   LYS   6          1HE       LYS   6   1.216   2.048 -11.318
   54   2HE   LYS   6          2HE       LYS   6  -0.228   2.237 -10.324
   55   1HZ   LYS   6          1HZ       LYS   6   1.075   4.656 -10.196
   56   2HZ   LYS   6          2HZ       LYS   6   1.188   4.193 -11.820
   57   3HZ   LYS   6          3HZ       LYS   6  -0.326   4.306 -11.075
   58    H    VAL   7           H        VAL   7   3.414   0.934  -5.028
   59    HA   VAL   7           HA       VAL   7   3.951   1.589  -2.421
   60    HB   VAL   7           HB       VAL   7   5.924   1.398  -4.703
   61   1HG1  VAL   7          1HG1      VAL   7   6.722   2.488  -2.515
   62   2HG1  VAL   7          2HG1      VAL   7   6.569   0.874  -1.829
   63   3HG1  VAL   7          3HG1      VAL   7   7.667   1.156  -3.177
   64   1HG2  VAL   7          1HG2      VAL   7   4.422  -0.564  -4.331
   65   2HG2  VAL   7          2HG2      VAL   7   6.142  -0.908  -4.148
   66   3HG2  VAL   7          3HG2      VAL   7   5.124  -0.718  -2.721
   67    HA   PRO   8           HA       PRO   8   4.482   5.987  -2.372
   68   1HB   PRO   8          1HB       PRO   8   6.003   6.225  -0.125
   69   2HB   PRO   8          2HB       PRO   8   4.261   5.929  -0.095
   70   1HG   PRO   8          1HG       PRO   8   6.518   4.003   0.265
   71   2HG   PRO   8          2HG       PRO   8   4.966   4.083   1.119
   72   1HD   PRO   8          1HD       PRO   8   5.469   2.308  -0.873
   73   2HD   PRO   8          2HD       PRO   8   3.851   2.953  -0.543
   74    H    ASP   9           H        ASP   9   6.579   7.435  -1.519
   75    HA   ASP   9           HA       ASP   9   8.594   6.859  -3.541
   76   1HB   ASP   9          1HB       ASP   9   7.481   9.229  -2.296
   77   2HB   ASP   9          2HB       ASP   9   9.242   9.267  -2.298
   78    H    ILE  10           H        ILE  10   8.175   6.460  -0.210
   79    HA   ILE  10           HA       ILE  10   9.602   6.279   1.583
   80    HB   ILE  10           HB       ILE  10  11.443   4.469   0.883
   81   1HG1  ILE  10          1HG1      ILE  10  10.273   2.991  -0.856
   82   2HG1  ILE  10          2HG1      ILE  10   9.364   4.429  -1.305
   83   1HG2  ILE  10          1HG2      ILE  10   9.501   4.295   2.456
   84   2HG2  ILE  10          2HG2      ILE  10   8.521   3.782   1.081
   85   3HG2  ILE  10          3HG2      ILE  10   9.899   2.809   1.595
   86   1HD1  ILE  10          1HD1      ILE  10  11.928   5.340  -1.351
   87   2HD1  ILE  10          2HD1      ILE  10  12.110   3.676  -1.910
   88   3HD1  ILE  10          3HD1      ILE  10  11.016   4.774  -2.751
   89    H    GLY  11           H        GLY  11  10.371   8.543  -0.015
   90   1HA   GLY  11          1HA       GLY  11  12.588   9.494   1.140
   91   2HA   GLY  11          2HA       GLY  11  12.189   9.896  -0.520
   92    H    GLY  12           H        GLY  12  12.629   7.151  -1.477
   93   1HA   GLY  12          1HA       GLY  12  14.819   5.783  -1.107
   94   2HA   GLY  12          2HA       GLY  12  15.559   7.305  -1.578
   95    H    HIS  13           H        HIS  13  15.122   4.430  -2.749
   96    HA   HIS  13           HA       HIS  13  14.226   5.297  -5.413
   97   1HB   HIS  13          1HB       HIS  13  16.052   4.160  -6.472
   98   2HB   HIS  13          2HB       HIS  13  16.731   5.208  -5.231
   99    HD1  HIS  13           HD1      HIS  13  18.524   3.023  -6.088
  100    HD2  HIS  13           HD2      HIS  13  15.677   2.469  -3.112
  101    HE1  HIS  13           HE1      HIS  13  19.331   1.058  -4.744
  102    HE2  HIS  13           HE2      HIS  13  17.553   0.692  -2.996
  103    H    GLU  14           H        GLU  14  14.666   2.829  -6.690
  104    HA   GLU  14           HA       GLU  14  12.312   1.439  -5.944
  105   1HB   GLU  14          1HB       GLU  14  14.542   0.577  -7.792
  106   2HB   GLU  14          2HB       GLU  14  12.954  -0.170  -7.689
  107   1HG   GLU  14          1HG       GLU  14  12.287   2.418  -8.145
  108   2HG   GLU  14          2HG       GLU  14  13.803   2.287  -9.037
  109    H    ASN  15           H        ASN  15  12.574  -1.125  -5.917
  110    HA   ASN  15           HA       ASN  15  12.877  -2.835  -4.427
  111   1HB   ASN  15          1HB       ASN  15  15.288  -3.488  -4.176
  112   2HB   ASN  15          2HB       ASN  15  14.771  -3.232  -5.838
  113   1HD2  ASN  15          2HD2      ASN  15  16.903  -2.293  -3.359
  114   2HD2  ASN  15          1HD2      ASN  15  17.733  -1.049  -4.224
  115    H    VAL  16           H        VAL  16  11.966  -2.209  -2.519
  116    HA   VAL  16           HA       VAL  16  13.837  -1.483  -0.403
  117    HB   VAL  16           HB       VAL  16  12.305   0.231   0.519
  118   1HG1  VAL  16          1HG1      VAL  16  13.493   0.681  -2.205
  119   2HG1  VAL  16          2HG1      VAL  16  12.811   1.987  -1.235
  120   3HG1  VAL  16          3HG1      VAL  16  14.187   1.065  -0.630
  121   1HG2  VAL  16          1HG2      VAL  16  10.381  -0.743  -1.019
  122   2HG2  VAL  16          2HG2      VAL  16  10.387   0.939  -0.496
  123   3HG2  VAL  16          3HG2      VAL  16  10.953   0.516  -2.111
  124    H    ASP  17           H        ASP  17  13.359  -2.430   1.515
  125    HA   ASP  17           HA       ASP  17  11.393  -4.488   1.530
  126   1HB   ASP  17          1HB       ASP  17  13.631  -4.506   2.737
  127   2HB   ASP  17          2HB       ASP  17  12.888  -3.452   3.936
  128    H    ILE  18           H        ILE  18   9.335  -4.421   2.139
  129    HA   ILE  18           HA       ILE  18   7.987  -2.084   2.812
  130    HB   ILE  18           HB       ILE  18   7.308  -5.002   3.038
  131   1HG1  ILE  18          1HG1      ILE  18   5.567  -3.181   1.547
  132   2HG1  ILE  18          2HG1      ILE  18   7.232  -3.194   0.976
  133   1HG2  ILE  18          1HG2      ILE  18   5.507  -2.744   3.902
  134   2HG2  ILE  18          2HG2      ILE  18   5.006  -4.417   3.666
  135   3HG2  ILE  18          3HG2      ILE  18   6.169  -4.017   4.927
  136   1HD1  ILE  18          1HD1      ILE  18   6.230  -5.867   1.440
  137   2HD1  ILE  18          2HD1      ILE  18   5.240  -4.971   0.287
  138   3HD1  ILE  18          3HD1      ILE  18   6.970  -5.167   0.000
  139    H    ILE  19           H        ILE  19   6.758  -1.729   4.946
  140    HA   ILE  19           HA       ILE  19   8.274  -2.774   7.218
  141    HB   ILE  19           HB       ILE  19   9.358  -0.928   7.778
  142   1HG1  ILE  19          1HG1      ILE  19   8.024   1.420   7.596
  143   2HG1  ILE  19          2HG1      ILE  19   6.672   0.318   7.784
  144   1HG2  ILE  19          1HG2      ILE  19   8.453  -0.208   5.061
  145   2HG2  ILE  19          2HG2      ILE  19   9.167   1.068   6.032
  146   3HG2  ILE  19          3HG2      ILE  19  10.074  -0.407   5.713
  147   1HD1  ILE  19          1HD1      ILE  19   7.941  -0.615   9.787
  148   2HD1  ILE  19          2HD1      ILE  19   8.952   0.824   9.650
  149   3HD1  ILE  19          3HD1      ILE  19   7.220   0.986   9.948
  150    H    ALA  20           H        ALA  20   5.390  -2.642   5.996
  151    HA   ALA  20           HA       ALA  20   4.036  -3.145   8.387
  152   1HB   ALA  20          1HB       ALA  20   4.388  -0.603   8.481
  153   2HB   ALA  20          2HB       ALA  20   3.140  -0.532   7.238
  154   3HB   ALA  20          3HB       ALA  20   2.776  -1.237   8.812
  155    H    VAL  21           H        VAL  21   1.962  -3.933   8.045
  156    HA   VAL  21           HA       VAL  21   0.907  -3.811   5.311
  157    HB   VAL  21           HB       VAL  21   2.201  -5.915   5.531
  158   1HG1  VAL  21          1HG1      VAL  21   1.520  -6.068   8.047
  159   2HG1  VAL  21          2HG1      VAL  21   0.135  -6.959   7.415
  160   3HG1  VAL  21          3HG1      VAL  21   1.772  -7.538   7.107
  161   1HG2  VAL  21          1HG2      VAL  21  -0.213  -5.541   4.370
  162   2HG2  VAL  21          2HG2      VAL  21   0.733  -7.022   4.229
  163   3HG2  VAL  21          3HG2      VAL  21  -0.564  -6.915   5.419
  164    H    GLU  22           H        GLU  22  -1.176  -3.279   5.317
  165    HA   GLU  22           HA       GLU  22  -2.936  -4.251   7.421
  166   1HB   GLU  22          1HB       GLU  22  -3.041  -1.318   6.822
  167   2HB   GLU  22          2HB       GLU  22  -3.636  -2.186   8.229
  168   1HG   GLU  22          1HG       GLU  22  -0.708  -1.923   7.633
  169   2HG   GLU  22          2HG       GLU  22  -1.602  -0.711   8.549
  170    H    VAL  23           H        VAL  23  -2.782  -4.917   4.692
  171    HA   VAL  23           HA       VAL  23  -5.283  -3.733   3.672
  172    HB   VAL  23           HB       VAL  23  -4.402  -4.491   1.391
  173   1HG1  VAL  23          1HG1      VAL  23  -3.326  -2.169   2.957
  174   2HG1  VAL  23          2HG1      VAL  23  -2.918  -2.400   1.257
  175   3HG1  VAL  23          3HG1      VAL  23  -4.602  -2.191   1.739
  176   1HG2  VAL  23          1HG2      VAL  23  -2.500  -5.786   2.546
  177   2HG2  VAL  23          2HG2      VAL  23  -2.121  -4.871   1.087
  178   3HG2  VAL  23          3HG2      VAL  23  -1.704  -4.217   2.671
  179    H    ASN  24           H        ASN  24  -6.882  -5.093   3.894
  180    HA   ASN  24           HA       ASN  24  -6.402  -7.935   3.303
  181   1HB   ASN  24          1HB       ASN  24  -8.547  -7.009   5.190
  182   2HB   ASN  24          2HB       ASN  24  -7.845  -8.614   5.017
  183   1HD2  ASN  24          2HD2      ASN  24  -5.444  -8.692   5.483
  184   2HD2  ASN  24          1HD2      ASN  24  -4.902  -7.814   6.868
  185    H    VAL  25           H        VAL  25  -7.096  -7.970   1.258
  186    HA   VAL  25           HA       VAL  25  -8.974  -6.623  -0.099
  187    HB   VAL  25           HB       VAL  25  -9.294  -8.546  -1.535
  188   1HG1  VAL  25          1HG1      VAL  25  -7.165  -7.302  -1.629
  189   2HG1  VAL  25          2HG1      VAL  25  -6.462  -8.476  -0.515
  190   3HG1  VAL  25          3HG1      VAL  25  -6.995  -8.988  -2.116
  191   1HG2  VAL  25          1HG2      VAL  25  -8.475 -10.021   0.888
  192   2HG2  VAL  25          2HG2      VAL  25  -9.626 -10.461  -0.374
  193   3HG2  VAL  25          3HG2      VAL  25  -7.895 -10.650  -0.654
  194    H    GLY  26           H        GLY  26 -10.973  -6.060   0.457
  195   1HA   GLY  26          1HA       GLY  26 -12.742  -8.151   1.566
  196   2HA   GLY  26          2HA       GLY  26 -13.291  -6.897   0.466
  197    H    ASP  27           H        ASP  27 -11.464  -4.979   1.994
  198    HA   ASP  27           HA       ASP  27 -13.305  -4.538   4.251
  199   1HB   ASP  27          1HB       ASP  27 -10.414  -4.776   4.231
  200   2HB   ASP  27          2HB       ASP  27 -10.923  -3.224   4.890
  201    H    THR  28           H        THR  28 -13.998  -2.457   4.622
  202    HA   THR  28           HA       THR  28 -14.024  -0.697   2.399
  203    HB   THR  28           HB       THR  28 -14.815   0.112   5.182
  204    HG1  THR  28           HG1      THR  28 -15.803  -1.825   5.030
  205   1HG2  THR  28          1HG2      THR  28 -15.529   0.935   2.442
  206   2HG2  THR  28          2HG2      THR  28 -16.834   0.884   3.627
  207   3HG2  THR  28          3HG2      THR  28 -15.412   1.883   3.924
  208    H    ILE  29           H        ILE  29 -12.675   0.887   1.875
  209    HA   ILE  29           HA       ILE  29 -10.657   1.693   3.848
  210    HB   ILE  29           HB       ILE  29  -9.205   2.290   2.024
  211   1HG1  ILE  29          1HG1      ILE  29 -11.678   1.823   0.392
  212   2HG1  ILE  29          2HG1      ILE  29 -10.596   3.205   0.391
  213   1HG2  ILE  29          1HG2      ILE  29  -9.990  -0.285   2.629
  214   2HG2  ILE  29          2HG2      ILE  29 -10.027  -0.247   0.865
  215   3HG2  ILE  29          3HG2      ILE  29  -8.547   0.177   1.726
  216   1HD1  ILE  29          1HD1      ILE  29  -8.885   1.482  -0.577
  217   2HD1  ILE  29          2HD1      ILE  29 -10.350   0.605  -1.014
  218   3HD1  ILE  29          3HD1      ILE  29 -10.094   2.242  -1.620
  219    H    ALA  30           H        ALA  30  -9.810   3.980   3.480
  220    HA   ALA  30           HA       ALA  30 -11.983   5.806   2.718
  221   1HB   ALA  30          1HB       ALA  30 -10.313   6.297   5.163
  222   2HB   ALA  30          2HB       ALA  30 -11.824   7.070   4.684
  223   3HB   ALA  30          3HB       ALA  30 -11.826   5.393   5.232
  224    H    VAL  31           H        VAL  31 -10.980   8.190   2.991
  225    HA   VAL  31           HA       VAL  31  -8.666   8.193   1.209
  226    HB   VAL  31           HB       VAL  31 -10.235  10.618   2.053
  227   1HG1  VAL  31          1HG1      VAL  31  -8.050  10.098   0.269
  228   2HG1  VAL  31          2HG1      VAL  31  -9.426  10.736  -0.630
  229   3HG1  VAL  31          3HG1      VAL  31  -8.770  11.639   0.734
  230   1HG2  VAL  31          1HG2      VAL  31 -11.252   8.376   0.641
  231   2HG2  VAL  31          2HG2      VAL  31 -12.038   9.922   0.960
  232   3HG2  VAL  31          3HG2      VAL  31 -11.077   9.707  -0.503
  233    H    ASP  32           H        ASP  32  -8.298   7.553   4.010
  234    HA   ASP  32           HA       ASP  32  -6.005   9.002   4.581
  235   1HB   ASP  32          1HB       ASP  32  -6.843  10.323   6.580
  236   2HB   ASP  32          2HB       ASP  32  -7.283  10.962   4.999
  237    H    ASP  33           H        ASP  33  -6.118   6.472   4.730
  238    HA   ASP  33           HA       ASP  33  -6.129   5.853   7.591
  239   1HB   ASP  33          1HB       ASP  33  -7.103   3.545   6.889
  240   2HB   ASP  33          2HB       ASP  33  -8.199   4.910   7.087
  241    H    THR  34           H        THR  34  -4.046   5.408   7.941
  242    HA   THR  34           HA       THR  34  -2.133   4.644   6.133
  243    HB   THR  34           HB       THR  34  -1.214   3.401   8.326
  244    HG1  THR  34           HG1      THR  34  -2.915   3.744   9.656
  245   1HG2  THR  34          1HG2      THR  34  -0.131   5.269   7.181
  246   2HG2  THR  34          2HG2      THR  34  -1.244   6.381   7.980
  247   3HG2  THR  34          3HG2      THR  34  -0.100   5.442   8.938
  248    H    LEU  35           H        LEU  35  -1.993   2.997   4.842
  249    HA   LEU  35           HA       LEU  35  -3.280   0.470   5.538
  250   1HB   LEU  35          1HB       LEU  35  -2.091   1.502   2.962
  251   2HB   LEU  35          2HB       LEU  35  -2.713  -0.127   3.157
  252    HG   LEU  35           HG       LEU  35  -4.312   2.424   3.389
  253   1HD1  LEU  35          1HD1      LEU  35  -3.645   0.681   1.178
  254   2HD1  LEU  35          2HD1      LEU  35  -5.388   0.785   1.431
  255   3HD1  LEU  35          3HD1      LEU  35  -4.445   2.252   1.177
  256   1HD2  LEU  35          1HD2      LEU  35  -5.011  -0.453   3.876
  257   2HD2  LEU  35          2HD2      LEU  35  -5.320   0.952   4.896
  258   3HD2  LEU  35          3HD2      LEU  35  -6.231   0.729   3.403
  259    H    ILE  36           H        ILE  36  -0.141   1.796   4.574
  260    HA   ILE  36           HA       ILE  36   1.174  -0.322   6.060
  261    HB   ILE  36           HB       ILE  36   2.743  -0.875   4.208
  262   1HG1  ILE  36          1HG1      ILE  36   2.290  -0.375   1.945
  263   2HG1  ILE  36          2HG1      ILE  36   0.693   0.265   2.311
  264   1HG2  ILE  36          1HG2      ILE  36   0.438  -2.012   4.861
  265   2HG2  ILE  36          2HG2      ILE  36   0.093  -1.636   3.175
  266   3HG2  ILE  36          3HG2      ILE  36   1.487  -2.633   3.588
  267   1HD1  ILE  36          1HD1      ILE  36   3.219   1.591   3.244
  268   2HD1  ILE  36          2HD1      ILE  36   2.493   1.919   1.671
  269   3HD1  ILE  36          3HD1      ILE  36   1.593   2.269   3.149
  270    H    THR  37           H        THR  37   3.732   0.032   5.481
  271    HA   THR  37           HA       THR  37   4.387   2.846   5.384
  272    HB   THR  37           HB       THR  37   4.940   1.122   7.805
  273    HG1  THR  37           HG1      THR  37   3.876   2.849   8.860
  274   1HG2  THR  37          1HG2      THR  37   6.783   2.848   6.856
  275   2HG2  THR  37          2HG2      THR  37   5.808   3.921   7.859
  276   3HG2  THR  37          3HG2      THR  37   6.546   2.484   8.564
  277    H    LEU  38           H        LEU  38   5.805   2.768   3.767
  278    HA   LEU  38           HA       LEU  38   7.616   0.504   3.505
  279   1HB   LEU  38          1HB       LEU  38   6.926   2.834   1.742
  280   2HB   LEU  38          2HB       LEU  38   8.259   1.757   1.373
  281    HG   LEU  38           HG       LEU  38   6.496   0.950   0.082
  282   1HD1  LEU  38          1HD1      LEU  38   7.625  -0.805   1.396
  283   2HD1  LEU  38          2HD1      LEU  38   6.353  -0.677   2.610
  284   3HD1  LEU  38          3HD1      LEU  38   5.963  -1.218   0.978
  285   1HD2  LEU  38          1HD2      LEU  38   4.875   2.280   1.832
  286   2HD2  LEU  38          2HD2      LEU  38   4.326   1.240   0.516
  287   3HD2  LEU  38          3HD2      LEU  38   4.473   0.591   2.150
  288    H    GLU  39           H        GLU  39   9.904   0.737   3.327
  289    HA   GLU  39           HA       GLU  39  11.112   3.289   3.939
  290   1HB   GLU  39          1HB       GLU  39  10.492   2.479   6.179
  291   2HB   GLU  39          2HB       GLU  39  11.391   0.996   5.890
  292   1HG   GLU  39          1HG       GLU  39  13.451   2.350   5.643
  293   2HG   GLU  39          2HG       GLU  39  12.516   3.779   6.085
  294    H    THR  40           H        THR  40  13.353   3.341   3.577
  295    HA   THR  40           HA       THR  40  14.371   0.996   2.118
  296    HB   THR  40           HB       THR  40  15.513   2.411   0.650
  297    HG1  THR  40           HG1      THR  40  16.262   4.327   1.175
  298   1HG2  THR  40          1HG2      THR  40  12.824   2.828   0.915
  299   2HG2  THR  40          2HG2      THR  40  13.478   4.464   0.970
  300   3HG2  THR  40          3HG2      THR  40  13.835   3.419  -0.405
  301    H    ASP  41           H        ASP  41  15.655   3.820   3.870
  302    HA   ASP  41           HA       ASP  41  17.123   2.239   5.716
  303   1HB   ASP  41          1HB       ASP  41  18.444   2.017   3.526
  304   2HB   ASP  41          2HB       ASP  41  18.864   3.712   3.748
  305    H    LYS  42           H        LYS  42  16.867   5.351   4.057
  306    HA   LYS  42           HA       LYS  42  17.114   6.668   6.676
  307   1HB   LYS  42          1HB       LYS  42  19.100   6.849   4.915
  308   2HB   LYS  42          2HB       LYS  42  18.069   8.107   4.249
  309   1HG   LYS  42          1HG       LYS  42  19.504   9.233   5.696
  310   2HG   LYS  42          2HG       LYS  42  18.006   9.065   6.613
  311   1HD   LYS  42          1HD       LYS  42  19.019   6.968   7.616
  312   2HD   LYS  42          2HD       LYS  42  20.548   7.480   6.897
  313   1HE   LYS  42          1HE       LYS  42  20.911   8.902   8.564
  314   2HE   LYS  42          2HE       LYS  42  19.350   9.676   8.295
  315   1HZ   LYS  42          1HZ       LYS  42  19.616   7.149   9.813
  316   2HZ   LYS  42          2HZ       LYS  42  19.733   8.663  10.557
  317   3HZ   LYS  42          3HZ       LYS  42  18.302   8.213   9.775
  318    H    ALA  43           H        ALA  43  14.714   5.895   5.396
  319    HA   ALA  43           HA       ALA  43  13.220   8.255   5.580
  320   1HB   ALA  43          1HB       ALA  43  13.553   7.334   2.730
  321   2HB   ALA  43          2HB       ALA  43  14.344   8.751   3.420
  322   3HB   ALA  43          3HB       ALA  43  12.586   8.690   3.306
  323    H    THR  44           H        THR  44  11.364   7.511   6.355
  324    HA   THR  44           HA       THR  44  10.344   4.942   5.334
  325    HB   THR  44           HB       THR  44   9.488   4.432   7.439
  326    HG1  THR  44           HG1      THR  44   9.051   5.942   9.001
  327   1HG2  THR  44          1HG2      THR  44  12.159   5.201   7.365
  328   2HG2  THR  44          2HG2      THR  44  11.512   5.910   8.845
  329   3HG2  THR  44          3HG2      THR  44  11.372   4.174   8.565
  330    H    MET  45           H        MET  45   8.596   5.074   4.106
  331    HA   MET  45           HA       MET  45   6.873   7.444   4.352
  332   1HB   MET  45          1HB       MET  45   7.780   5.800   2.087
  333   2HB   MET  45          2HB       MET  45   6.072   6.218   2.044
  334   1HG   MET  45          1HG       MET  45   7.609   8.531   2.729
  335   2HG   MET  45          2HG       MET  45   8.261   7.793   1.267
  336   1HE   MET  45          1HE       MET  45   5.262   9.251   3.087
  337   2HE   MET  45          2HE       MET  45   4.044   9.515   1.840
  338   3HE   MET  45          3HE       MET  45   4.355   7.885   2.437
  339    H    ASP  46           H        ASP  46   4.589   7.199   4.246
  340    HA   ASP  46           HA       ASP  46   3.581   4.507   4.848
  341   1HB   ASP  46          1HB       ASP  46   2.026   5.605   6.526
  342   2HB   ASP  46          2HB       ASP  46   3.718   5.510   7.001
  343    H    VAL  47           H        VAL  47   1.518   4.049   4.090
  344    HA   VAL  47           HA       VAL  47   0.442   6.063   2.238
  345    HB   VAL  47           HB       VAL  47   0.048   3.068   2.273
  346   1HG1  VAL  47          1HG1      VAL  47  -1.666   5.040   1.229
  347   2HG1  VAL  47          2HG1      VAL  47  -0.810   4.347  -0.150
  348   3HG1  VAL  47          3HG1      VAL  47  -1.718   3.301   0.942
  349   1HG2  VAL  47          1HG2      VAL  47   2.271   3.960   1.500
  350   2HG2  VAL  47          2HG2      VAL  47   1.384   3.014   0.304
  351   3HG2  VAL  47          3HG2      VAL  47   1.407   4.774   0.194
  352    HA   PRO  48           HA       PRO  48  -2.949   6.103   5.227
  353   1HB   PRO  48          1HB       PRO  48  -3.715   8.616   4.837
  354   2HB   PRO  48          2HB       PRO  48  -2.197   8.258   5.671
  355   1HG   PRO  48          1HG       PRO  48  -2.649   9.159   2.862
  356   2HG   PRO  48          2HG       PRO  48  -1.361   9.610   3.993
  357   1HD   PRO  48          1HD       PRO  48  -1.167   7.691   1.965
  358   2HD   PRO  48          2HD       PRO  48  -0.054   7.872   3.334
  359    H    ALA  49           H        ALA  49  -3.219   4.948   2.546
  360    HA   ALA  49           HA       ALA  49  -4.756   4.557   0.895
  361   1HB   ALA  49          1HB       ALA  49  -7.003   5.156   2.709
  362   2HB   ALA  49          2HB       ALA  49  -5.821   3.982   3.290
  363   3HB   ALA  49          3HB       ALA  49  -6.658   3.708   1.762
  364    H    GLU  50           H        GLU  50  -4.540   6.202  -0.573
  365    HA   GLU  50           HA       GLU  50  -5.902   8.716  -0.138
  366   1HB   GLU  50          1HB       GLU  50  -3.856   7.705  -1.998
  367   2HB   GLU  50          2HB       GLU  50  -4.966   8.886  -2.681
  368   1HG   GLU  50          1HG       GLU  50  -4.272  10.564  -1.249
  369   2HG   GLU  50          2HG       GLU  50  -3.611   9.427  -0.075
  370    H    VAL  51           H        VAL  51  -7.822   6.964  -0.080
  371    HA   VAL  51           HA       VAL  51  -9.744   7.717  -1.825
  372    HB   VAL  51           HB       VAL  51  -8.664   7.010  -3.781
  373   1HG1  VAL  51          1HG1      VAL  51  -7.209   5.349  -2.110
  374   2HG1  VAL  51          2HG1      VAL  51  -8.050   4.240  -3.196
  375   3HG1  VAL  51          3HG1      VAL  51  -7.025   5.513  -3.856
  376   1HG2  VAL  51          1HG2      VAL  51 -11.013   5.793  -3.101
  377   2HG2  VAL  51          2HG2      VAL  51 -10.272   5.747  -4.700
  378   3HG2  VAL  51          3HG2      VAL  51 -10.011   4.419  -3.569
  379    H    ALA  52           H        ALA  52 -11.683   6.742  -1.347
  380    HA   ALA  52           HA       ALA  52 -11.676   4.826   0.829
  381   1HB   ALA  52          1HB       ALA  52 -13.435   6.845  -0.082
  382   2HB   ALA  52          2HB       ALA  52 -13.598   5.825   1.349
  383   3HB   ALA  52          3HB       ALA  52 -14.304   5.310  -0.188
  384    H    GLY  53           H        GLY  53 -14.059   3.455   0.255
  385   1HA   GLY  53          1HA       GLY  53 -13.412   1.980  -2.209
  386   2HA   GLY  53          2HA       GLY  53 -14.992   2.028  -1.441
  387    H    VAL  54           H        VAL  54 -13.198  -0.231  -2.240
  388    HA   VAL  54           HA       VAL  54 -12.574  -1.472   0.330
  389    HB   VAL  54           HB       VAL  54 -14.426  -2.782  -1.666
  390   1HG1  VAL  54          1HG1      VAL  54 -13.078  -3.695   0.826
  391   2HG1  VAL  54          2HG1      VAL  54 -14.695  -4.301   0.468
  392   3HG1  VAL  54          3HG1      VAL  54 -13.381  -4.564  -0.679
  393   1HG2  VAL  54          1HG2      VAL  54 -14.936  -1.150   0.745
  394   2HG2  VAL  54          2HG2      VAL  54 -15.921  -1.384  -0.697
  395   3HG2  VAL  54          3HG2      VAL  54 -15.900  -2.615   0.565
  396    H    VAL  55           H        VAL  55 -10.902  -2.939   0.207
  397    HA   VAL  55           HA       VAL  55  -9.405  -2.982  -2.238
  398    HB   VAL  55           HB       VAL  55  -8.882  -4.540   0.293
  399   1HG1  VAL  55          1HG1      VAL  55  -7.774  -5.450  -1.730
  400   2HG1  VAL  55          2HG1      VAL  55  -7.029  -3.872  -1.999
  401   3HG1  VAL  55          3HG1      VAL  55  -6.624  -4.802  -0.556
  402   1HG2  VAL  55          1HG2      VAL  55  -8.948  -1.961   0.380
  403   2HG2  VAL  55          2HG2      VAL  55  -7.543  -2.792   1.048
  404   3HG2  VAL  55          3HG2      VAL  55  -7.450  -2.045  -0.547
  405    H    LYS  56           H        LYS  56  -8.879  -4.695  -3.521
  406    HA   LYS  56           HA       LYS  56 -10.577  -7.090  -3.266
  407   1HB   LYS  56          1HB       LYS  56  -9.570  -6.666  -5.952
  408   2HB   LYS  56          2HB       LYS  56 -11.218  -6.947  -5.414
  409   1HG   LYS  56          1HG       LYS  56 -10.293  -4.229  -4.885
  410   2HG   LYS  56          2HG       LYS  56 -10.271  -4.667  -6.590
  411   1HD   LYS  56          1HD       LYS  56 -12.435  -4.050  -6.524
  412   2HD   LYS  56          2HD       LYS  56 -12.673  -5.665  -5.853
  413   1HE   LYS  56          1HE       LYS  56 -12.108  -4.371  -3.596
  414   2HE   LYS  56          2HE       LYS  56 -12.754  -3.016  -4.522
  415   1HZ   LYS  56          1HZ       LYS  56 -14.589  -4.897  -4.999
  416   2HZ   LYS  56          2HZ       LYS  56 -14.118  -5.326  -3.433
  417   3HZ   LYS  56          3HZ       LYS  56 -14.702  -3.769  -3.745
  418    H    GLU  57           H        GLU  57  -7.567  -5.763  -4.548
  419    HA   GLU  57           HA       GLU  57  -6.393  -8.415  -4.303
  420   1HB   GLU  57          1HB       GLU  57  -5.964  -6.181  -6.197
  421   2HB   GLU  57          2HB       GLU  57  -4.549  -7.130  -5.761
  422   1HG   GLU  57          1HG       GLU  57  -5.546  -9.132  -6.579
  423   2HG   GLU  57          2HG       GLU  57  -7.100  -8.330  -6.803
  424    H    VAL  58           H        VAL  58  -3.922  -8.301  -3.936
  425    HA   VAL  58           HA       VAL  58  -2.920  -6.150  -2.325
  426    HB   VAL  58           HB       VAL  58  -4.343  -7.223  -0.645
  427   1HG1  VAL  58          1HG1      VAL  58  -2.799  -9.689  -1.413
  428   2HG1  VAL  58          2HG1      VAL  58  -3.686  -9.551   0.106
  429   3HG1  VAL  58          3HG1      VAL  58  -4.546  -9.443  -1.430
  430   1HG2  VAL  58          1HG2      VAL  58  -1.720  -6.525  -0.364
  431   2HG2  VAL  58          2HG2      VAL  58  -2.811  -6.915   0.966
  432   3HG2  VAL  58          3HG2      VAL  58  -1.737  -8.153   0.315
  433    H    LYS  59           H        LYS  59  -0.741  -6.186  -2.255
  434    HA   LYS  59           HA       LYS  59   0.729  -8.641  -2.700
  435   1HB   LYS  59          1HB       LYS  59   0.751  -6.357  -4.668
  436   2HB   LYS  59          2HB       LYS  59   2.016  -7.577  -4.602
  437   1HG   LYS  59          1HG       LYS  59   0.760  -8.634  -6.124
  438   2HG   LYS  59          2HG       LYS  59  -0.194  -9.138  -4.727
  439   1HD   LYS  59          1HD       LYS  59  -1.907  -8.241  -5.884
  440   2HD   LYS  59          2HD       LYS  59  -1.291  -6.717  -5.244
  441   1HE   LYS  59          1HE       LYS  59  -1.509  -6.282  -7.513
  442   2HE   LYS  59          2HE       LYS  59   0.197  -6.694  -7.349
  443   1HZ   LYS  59          1HZ       LYS  59  -0.965  -9.090  -7.819
  444   2HZ   LYS  59          2HZ       LYS  59  -1.886  -8.054  -8.789
  445   3HZ   LYS  59          3HZ       LYS  59  -0.208  -8.131  -8.988
  446    H    VAL  60           H        VAL  60   1.067  -7.764  -0.441
  447    HA   VAL  60           HA       VAL  60   3.664  -6.641  -0.282
  448    HB   VAL  60           HB       VAL  60   2.883  -4.496  -0.591
  449   1HG1  VAL  60          1HG1      VAL  60   0.371  -5.259   0.889
  450   2HG1  VAL  60          2HG1      VAL  60   0.725  -3.642   0.282
  451   3HG1  VAL  60          3HG1      VAL  60   0.547  -4.988  -0.847
  452   1HG2  VAL  60          1HG2      VAL  60   3.938  -4.817   1.721
  453   2HG2  VAL  60          2HG2      VAL  60   3.058  -3.319   1.423
  454   3HG2  VAL  60          3HG2      VAL  60   2.305  -4.614   2.353
  455    H    LYS  61           H        LYS  61   4.507  -6.671   1.833
  456    HA   LYS  61           HA       LYS  61   3.007  -7.339   4.134
  457   1HB   LYS  61          1HB       LYS  61   3.752  -9.532   2.406
  458   2HB   LYS  61          2HB       LYS  61   4.537  -9.687   3.972
  459   1HG   LYS  61          1HG       LYS  61   1.750  -8.970   4.243
  460   2HG   LYS  61          2HG       LYS  61   1.963 -10.460   3.322
  461   1HD   LYS  61          1HD       LYS  61   2.807 -11.598   5.097
  462   2HD   LYS  61          2HD       LYS  61   3.587 -10.169   5.777
  463   1HE   LYS  61          1HE       LYS  61   1.360  -9.339   6.471
  464   2HE   LYS  61          2HE       LYS  61   0.649 -10.842   5.884
  465   1HZ   LYS  61          1HZ       LYS  61   2.467 -11.852   7.476
  466   2HZ   LYS  61          2HZ       LYS  61   2.286 -10.363   8.257
  467   3HZ   LYS  61          3HZ       LYS  61   0.949 -11.378   8.055
  468    H    VAL  62           H        VAL  62   4.875  -8.716   5.622
  469    HA   VAL  62           HA       VAL  62   7.080  -6.776   5.676
  470    HB   VAL  62           HB       VAL  62   6.105  -8.611   7.870
  471   1HG1  VAL  62          1HG1      VAL  62   8.182  -6.423   7.883
  472   2HG1  VAL  62          2HG1      VAL  62   7.563  -7.238   9.320
  473   3HG1  VAL  62          3HG1      VAL  62   8.465  -8.150   8.109
  474   1HG2  VAL  62          1HG2      VAL  62   4.893  -6.329   6.938
  475   2HG2  VAL  62          2HG2      VAL  62   4.698  -7.013   8.551
  476   3HG2  VAL  62          3HG2      VAL  62   5.879  -5.732   8.273
  477    H    GLY  63           H        GLY  63   8.471  -7.745   4.183
  478   1HA   GLY  63          1HA       GLY  63   9.271 -10.514   4.588
  479   2HA   GLY  63          2HA       GLY  63  10.494  -9.307   4.954
  480    H    ASP  64           H        ASP  64   8.276  -8.564   2.427
  481    HA   ASP  64           HA       ASP  64  10.135  -9.524   0.380
  482   1HB   ASP  64          1HB       ASP  64   8.229  -8.764  -1.175
  483   2HB   ASP  64          2HB       ASP  64   7.947 -10.180  -0.167
  484    H    LYS  65           H        LYS  65  10.427  -8.053  -1.545
  485    HA   LYS  65           HA       LYS  65  11.092  -5.367  -0.570
  486   1HB   LYS  65          1HB       LYS  65  12.155  -7.068  -2.810
  487   2HB   LYS  65          2HB       LYS  65  12.451  -5.335  -2.769
  488   1HG   LYS  65          1HG       LYS  65  14.325  -6.063  -1.715
  489   2HG   LYS  65          2HG       LYS  65  13.262  -5.891  -0.318
  490   1HD   LYS  65          1HD       LYS  65  12.809  -8.466  -1.370
  491   2HD   LYS  65          2HD       LYS  65  14.559  -8.238  -1.326
  492   1HE   LYS  65          1HE       LYS  65  14.593  -7.950   0.973
  493   2HE   LYS  65          2HE       LYS  65  12.892  -7.492   1.040
  494   1HZ   LYS  65          1HZ       LYS  65  12.401  -9.849   0.369
  495   2HZ   LYS  65          2HZ       LYS  65  14.029 -10.201   0.666
  496   3HZ   LYS  65          3HZ       LYS  65  13.039  -9.653   1.923
  497    H    ILE  66           H        ILE  66  10.200  -3.571  -1.421
  498    HA   ILE  66           HA       ILE  66   8.472  -3.885  -3.775
  499    HB   ILE  66           HB       ILE  66   7.565  -3.443  -1.176
  500   1HG1  ILE  66          1HG1      ILE  66   5.385  -3.278  -2.225
  501   2HG1  ILE  66          2HG1      ILE  66   6.129  -2.855  -3.766
  502   1HG2  ILE  66          1HG2      ILE  66   7.451  -0.859  -2.709
  503   2HG2  ILE  66          2HG2      ILE  66   6.398  -1.239  -1.347
  504   3HG2  ILE  66          3HG2      ILE  66   8.143  -1.136  -1.112
  505   1HD1  ILE  66          1HD1      ILE  66   7.295  -5.272  -2.897
  506   2HD1  ILE  66          2HD1      ILE  66   5.545  -5.424  -2.716
  507   3HD1  ILE  66          3HD1      ILE  66   6.238  -4.997  -4.282
  508    H    SER  67           H        SER  67   7.974  -1.796  -4.872
  509    HA   SER  67           HA       SER  67   9.935   0.316  -4.421
  510   1HB   SER  67          1HB       SER  67   9.625  -0.770  -7.208
  511   2HB   SER  67          2HB       SER  67  10.913   0.238  -6.550
  512    HG   SER  67           HG       SER  67  10.952  -2.345  -6.801
  513    H    GLU  68           H        GLU  68   9.311   2.330  -5.164
  514    HA   GLU  68           HA       GLU  68   6.717   3.089  -5.176
  515   1HB   GLU  68          1HB       GLU  68   7.483   5.025  -6.704
  516   2HB   GLU  68          2HB       GLU  68   8.252   4.840  -5.135
  517   1HG   GLU  68          1HG       GLU  68  10.154   5.029  -6.274
  518   2HG   GLU  68          2HG       GLU  68   9.884   3.343  -6.711
  519    H    GLY  69           H        GLY  69   5.107   2.154  -6.277
  520   1HA   GLY  69          1HA       GLY  69   5.196   2.292  -9.196
  521   2HA   GLY  69          2HA       GLY  69   3.760   2.055  -8.212
  522    H    GLY  70           H        GLY  70   3.706  -0.084  -6.987
  523   1HA   GLY  70          1HA       GLY  70   4.875  -2.361  -7.122
  524   2HA   GLY  70          2HA       GLY  70   4.613  -2.183  -8.851
  525    H    LEU  71           H        LEU  71   1.988  -0.792  -8.148
  526    HA   LEU  71           HA       LEU  71  -0.198  -1.316  -7.770
  527   1HB   LEU  71          1HB       LEU  71   0.109  -2.400  -9.907
  528   2HB   LEU  71          2HB       LEU  71   0.768  -3.827  -9.134
  529    HG   LEU  71           HG       LEU  71  -1.327  -4.535  -8.363
  530   1HD1  LEU  71          1HD1      LEU  71  -1.962  -1.686  -8.410
  531   2HD1  LEU  71          2HD1      LEU  71  -3.276  -2.716  -8.970
  532   3HD1  LEU  71          3HD1      LEU  71  -2.577  -2.969  -7.371
  533   1HD2  LEU  71          1HD2      LEU  71  -1.016  -3.820 -11.094
  534   2HD2  LEU  71          2HD2      LEU  71  -1.942  -5.150 -10.398
  535   3HD2  LEU  71          3HD2      LEU  71  -2.705  -3.579 -10.644
  536    H    ILE  72           H        ILE  72   0.788  -1.432  -5.424
  537    HA   ILE  72           HA       ILE  72   1.080  -3.802  -4.047
  538    HB   ILE  72           HB       ILE  72   0.300  -1.039  -3.277
  539   1HG1  ILE  72          1HG1      ILE  72   2.321  -2.732  -1.890
  540   2HG1  ILE  72          2HG1      ILE  72   2.651  -2.211  -3.540
  541   1HG2  ILE  72          1HG2      ILE  72  -0.372  -3.429  -1.651
  542   2HG2  ILE  72          2HG2      ILE  72   0.386  -2.075  -0.812
  543   3HG2  ILE  72          3HG2      ILE  72  -1.125  -1.834  -1.689
  544   1HD1  ILE  72          1HD1      ILE  72   1.733  -0.103  -1.726
  545   2HD1  ILE  72          2HD1      ILE  72   3.301  -0.811  -1.340
  546   3HD1  ILE  72          3HD1      ILE  72   3.022  -0.096  -2.927
  547    H    VAL  73           H        VAL  73  -1.874  -1.857  -3.642
  548    HA   VAL  73           HA       VAL  73  -3.443  -4.335  -3.884
  549    HB   VAL  73           HB       VAL  73  -4.868  -3.665  -2.044
  550   1HG1  VAL  73          1HG1      VAL  73  -2.100  -4.343  -1.782
  551   2HG1  VAL  73          2HG1      VAL  73  -2.601  -3.353  -0.410
  552   3HG1  VAL  73          3HG1      VAL  73  -3.468  -4.842  -0.789
  553   1HG2  VAL  73          1HG2      VAL  73  -3.086  -1.243  -1.927
  554   2HG2  VAL  73          2HG2      VAL  73  -4.834  -1.301  -2.156
  555   3HG2  VAL  73          3HG2      VAL  73  -4.133  -1.731  -0.595
  556    H    VAL  74           H        VAL  74  -5.535  -4.138  -4.660
  557    HA   VAL  74           HA       VAL  74  -6.169  -1.559  -5.955
  558    HB   VAL  74           HB       VAL  74  -6.926  -4.355  -6.840
  559   1HG1  VAL  74          1HG1      VAL  74  -8.399  -2.156  -7.309
  560   2HG1  VAL  74          2HG1      VAL  74  -7.262  -2.050  -8.653
  561   3HG1  VAL  74          3HG1      VAL  74  -8.255  -3.492  -8.452
  562   1HG2  VAL  74          1HG2      VAL  74  -4.798  -2.445  -7.712
  563   2HG2  VAL  74          2HG2      VAL  74  -4.692  -4.179  -7.408
  564   3HG2  VAL  74          3HG2      VAL  74  -5.493  -3.586  -8.863
  565    H    VAL  75           H        VAL  75  -8.131  -0.659  -5.517
  566    HA   VAL  75           HA       VAL  75  -9.986  -2.254  -3.894
  567    HB   VAL  75           HB       VAL  75 -10.637  -0.174  -2.764
  568   1HG1  VAL  75          1HG1      VAL  75  -8.118  -1.540  -2.521
  569   2HG1  VAL  75          2HG1      VAL  75  -7.975   0.133  -1.983
  570   3HG1  VAL  75          3HG1      VAL  75  -9.184  -0.926  -1.259
  571   1HG2  VAL  75          1HG2      VAL  75  -8.589   0.982  -4.596
  572   2HG2  VAL  75          2HG2      VAL  75 -10.195   1.586  -4.188
  573   3HG2  VAL  75          3HG2      VAL  75  -8.877   1.723  -3.023
  574    H    GLU  76           H        GLU  76 -12.190  -1.011  -3.773
  575    HA   GLU  76           HA       GLU  76 -13.184  -0.924  -6.483
  576   1HB   GLU  76          1HB       GLU  76 -14.246  -1.614  -3.968
  577   2HB   GLU  76          2HB       GLU  76 -15.139  -0.191  -4.489
  578   1HG   GLU  76          1HG       GLU  76 -15.439  -1.430  -6.711
  579   2HG   GLU  76          2HG       GLU  76 -14.929  -2.863  -5.821
  580    H    ALA  77           H        ALA  77 -12.569   1.284  -3.839
  581    HA   ALA  77           HA       ALA  77 -12.404   3.536  -3.779
  582   1HB   ALA  77          1HB       ALA  77 -12.795   4.580  -6.240
  583   2HB   ALA  77          2HB       ALA  77 -12.214   2.958  -6.610
  584   3HB   ALA  77          3HB       ALA  77 -11.252   4.023  -5.589
  585    H    GLU  78           H        GLU  78 -14.891   2.115  -3.490
  586    HA   GLU  78           HA       GLU  78 -17.126   3.258  -4.601
  587   1HB   GLU  78          1HB       GLU  78 -16.616   1.516  -2.535
  588   2HB   GLU  78          2HB       GLU  78 -17.327   2.890  -1.698
  589   1HG   GLU  78          1HG       GLU  78 -18.948   2.454  -3.932
  590   2HG   GLU  78          2HG       GLU  78 -18.588   0.854  -3.285
  591    H    GLY  79           H        GLY  79 -15.847   4.179  -1.434
  592   1HA   GLY  79          1HA       GLY  79 -15.453   6.845  -1.711
  593   2HA   GLY  79          2HA       GLY  79 -16.062   6.121  -0.233
  594    H    THR  80           H        THR  80 -18.259   6.231   0.249
  595    HA   THR  80           HA       THR  80 -19.809   8.052  -1.476
  596    HB   THR  80           HB       THR  80 -21.797   6.871  -0.994
  597    HG1  THR  80           HG1      THR  80 -22.066   5.639   0.716
  598   1HG2  THR  80          1HG2      THR  80 -20.261   5.661  -2.551
  599   2HG2  THR  80          2HG2      THR  80 -19.779   4.656  -1.184
  600   3HG2  THR  80          3HG2      THR  80 -21.454   4.651  -1.735
  601    H    ALA  81           H        ALA  81 -19.474   9.960  -0.441
  602    HA   ALA  81           HA       ALA  81 -20.050  10.072   2.442
  603   1HB   ALA  81          1HB       ALA  81 -17.932  10.972   2.167
  604   2HB   ALA  81          2HB       ALA  81 -18.352  11.756   0.644
  605   3HB   ALA  81          3HB       ALA  81 -18.960  12.406   2.167

  No H/Q in entry =         605
  Start of MODEL   10
    1    H1   ALA   1           H1       ALA   1 -13.466   6.024  -9.632
    2    H2   ALA   1           H2       ALA   1 -14.845   5.906 -10.645
    3    H3   ALA   1           H3       ALA   1 -14.898   5.286  -9.047
    4    HA   ALA   1           HA       ALA   1 -14.675   3.480 -10.455
    5   1HB   ALA   1          1HB       ALA   1 -13.925   4.767 -12.419
    6   2HB   ALA   1          2HB       ALA   1 -12.320   4.893 -11.698
    7   3HB   ALA   1          3HB       ALA   1 -12.963   3.314 -12.151
    8    H    LEU   2           H        LEU   2 -12.896   1.786 -10.395
    9    HA   LEU   2           HA       LEU   2 -11.943   1.493  -7.803
   10   1HB   LEU   2          1HB       LEU   2 -10.979   0.212 -10.360
   11   2HB   LEU   2          2HB       LEU   2 -10.491  -0.307  -8.758
   12    HG   LEU   2           HG       LEU   2 -13.263  -0.331  -8.637
   13   1HD1  LEU   2          1HD1      LEU   2 -13.280  -0.042 -11.106
   14   2HD1  LEU   2          2HD1      LEU   2 -12.404  -1.566 -11.246
   15   3HD1  LEU   2          3HD1      LEU   2 -14.027  -1.542 -10.556
   16   1HD2  LEU   2          1HD2      LEU   2 -11.071  -2.308  -8.799
   17   2HD2  LEU   2          2HD2      LEU   2 -12.313  -2.085  -7.567
   18   3HD2  LEU   2          3HD2      LEU   2 -12.706  -2.910  -9.076
   19    H    VAL   3           H        VAL   3  -9.476   0.961  -7.447
   20    HA   VAL   3           HA       VAL   3  -7.768   2.991  -8.662
   21    HB   VAL   3           HB       VAL   3  -8.565   2.929  -5.773
   22   1HG1  VAL   3          1HG1      VAL   3  -6.132   2.657  -5.709
   23   2HG1  VAL   3          2HG1      VAL   3  -5.949   4.066  -6.757
   24   3HG1  VAL   3          3HG1      VAL   3  -6.620   4.256  -5.137
   25   1HG2  VAL   3          1HG2      VAL   3  -8.391   4.922  -7.969
   26   2HG2  VAL   3          2HG2      VAL   3  -9.684   4.628  -6.806
   27   3HG2  VAL   3          3HG2      VAL   3  -8.225   5.484  -6.305
   28    H    GLU   4           H        GLU   4  -5.484   2.706  -8.100
   29    HA   GLU   4           HA       GLU   4  -4.822  -0.033  -7.263
   30   1HB   GLU   4          1HB       GLU   4  -3.843   1.468  -9.685
   31   2HB   GLU   4          2HB       GLU   4  -2.950   0.116  -9.006
   32   1HG   GLU   4          1HG       GLU   4  -4.957  -1.302  -9.315
   33   2HG   GLU   4          2HG       GLU   4  -5.745   0.057 -10.114
   34    H    LEU   5           H        LEU   5  -3.980   0.423  -5.293
   35    HA   LEU   5           HA       LEU   5  -2.521   2.690  -4.576
   36   1HB   LEU   5          1HB       LEU   5  -3.317   0.251  -3.364
   37   2HB   LEU   5          2HB       LEU   5  -1.602   0.451  -3.059
   38    HG   LEU   5           HG       LEU   5  -3.126   1.369  -1.285
   39   1HD1  LEU   5          1HD1      LEU   5  -0.730   2.106  -1.787
   40   2HD1  LEU   5          2HD1      LEU   5  -1.459   3.540  -2.509
   41   3HD1  LEU   5          3HD1      LEU   5  -1.728   3.177  -0.805
   42   1HD2  LEU   5          1HD2      LEU   5  -4.409   2.530  -3.470
   43   2HD2  LEU   5          2HD2      LEU   5  -4.737   2.822  -1.762
   44   3HD2  LEU   5          3HD2      LEU   5  -3.618   3.867  -2.635
   45    H    LYS   6           H        LYS   6  -0.208   2.738  -3.892
   46    HA   LYS   6           HA       LYS   6   1.594   0.960  -5.295
   47   1HB   LYS   6          1HB       LYS   6   1.204   3.831  -6.087
   48   2HB   LYS   6          2HB       LYS   6   2.755   3.037  -6.322
   49   1HG   LYS   6          1HG       LYS   6   1.933   2.448  -8.311
   50   2HG   LYS   6          2HG       LYS   6   1.028   1.228  -7.413
   51   1HD   LYS   6          1HD       LYS   6  -0.750   2.179  -8.418
   52   2HD   LYS   6          2HD       LYS   6  -0.598   3.368  -7.124
   53   1HE   LYS   6          1HE       LYS   6   1.010   4.580  -8.739
   54   2HE   LYS   6          2HE       LYS   6   0.283   3.562  -9.982
   55   1HZ   LYS   6          1HZ       LYS   6  -1.545   4.983  -8.211
   56   2HZ   LYS   6          2HZ       LYS   6  -0.686   5.924  -9.326
   57   3HZ   LYS   6          3HZ       LYS   6  -1.672   4.661  -9.866
   58    H    VAL   7           H        VAL   7   3.805   1.241  -4.696
   59    HA   VAL   7           HA       VAL   7   4.258   1.661  -1.998
   60    HB   VAL   7           HB       VAL   7   6.234   1.804  -4.280
   61   1HG1  VAL   7          1HG1      VAL   7   6.925   2.769  -1.975
   62   2HG1  VAL   7          2HG1      VAL   7   6.957   1.081  -1.474
   63   3HG1  VAL   7          3HG1      VAL   7   7.995   1.628  -2.786
   64   1HG2  VAL   7          1HG2      VAL   7   4.883  -0.282  -4.058
   65   2HG2  VAL   7          2HG2      VAL   7   6.623  -0.508  -3.906
   66   3HG2  VAL   7          3HG2      VAL   7   5.607  -0.509  -2.467
   67    HA   PRO   8           HA       PRO   8   4.429   6.076  -1.619
   68   1HB   PRO   8          1HB       PRO   8   5.673   6.282   0.762
   69   2HB   PRO   8          2HB       PRO   8   4.007   5.702   0.615
   70   1HG   PRO   8          1HG       PRO   8   6.538   4.121   0.924
   71   2HG   PRO   8          2HG       PRO   8   4.984   3.910   1.751
   72   1HD   PRO   8          1HD       PRO   8   5.731   2.394  -0.371
   73   2HD   PRO   8          2HD       PRO   8   4.037   2.807  -0.045
   74    H    ASP   9           H        ASP   9   6.243   7.647  -0.525
   75    HA   ASP   9           HA       ASP   9   8.448   7.545  -2.388
   76   1HB   ASP   9          1HB       ASP   9   7.174   9.546  -0.659
   77   2HB   ASP   9          2HB       ASP   9   8.926   9.704  -0.762
   78    H    ILE  10           H        ILE  10   9.768   5.868  -1.732
   79    HA   ILE  10           HA       ILE  10  10.993   6.129   0.934
   80    HB   ILE  10           HB       ILE  10  11.785   3.685   0.289
   81   1HG1  ILE  10          1HG1      ILE  10   9.927   2.491  -0.889
   82   2HG1  ILE  10          2HG1      ILE  10   9.227   4.055  -1.283
   83   1HG2  ILE  10          1HG2      ILE  10   9.866   4.782   1.963
   84   2HG2  ILE  10          2HG2      ILE  10   9.019   3.485   1.120
   85   3HG2  ILE  10          3HG2      ILE  10  10.496   3.136   2.022
   86   1HD1  ILE  10          1HD1      ILE  10  11.256   4.628  -2.533
   87   2HD1  ILE  10          2HD1      ILE  10  11.912   3.032  -2.171
   88   3HD1  ILE  10          3HD1      ILE  10  10.462   3.184  -3.163
   89    H    GLY  11           H        GLY  11  12.275   7.846  -0.222
   90   1HA   GLY  11          1HA       GLY  11  14.774   6.640  -1.123
   91   2HA   GLY  11          2HA       GLY  11  14.543   8.312  -0.634
   92    H    GLY  12           H        GLY  12  14.280   6.015  -3.250
   93   1HA   GLY  12          1HA       GLY  12  14.653   8.104  -5.182
   94   2HA   GLY  12          2HA       GLY  12  13.032   7.430  -5.229
   95    H    HIS  13           H        HIS  13  13.646   4.745  -4.653
   96    HA   HIS  13           HA       HIS  13  14.749   3.968  -7.230
   97   1HB   HIS  13          1HB       HIS  13  16.135   2.165  -6.061
   98   2HB   HIS  13          2HB       HIS  13  16.753   3.811  -6.001
   99    HD1  HIS  13           HD1      HIS  13  18.100   3.291  -3.857
  100    HD2  HIS  13           HD2      HIS  13  13.995   2.799  -3.449
  101    HE1  HIS  13           HE1      HIS  13  17.690   3.090  -1.385
  102    HE2  HIS  13           HE2      HIS  13  15.209   2.723  -1.167
  103    H    GLU  14           H        GLU  14  14.693   1.384  -7.267
  104    HA   GLU  14           HA       GLU  14  12.042   0.612  -6.228
  105   1HB   GLU  14          1HB       GLU  14  13.404  -0.191  -8.810
  106   2HB   GLU  14          2HB       GLU  14  11.903  -0.892  -8.225
  107   1HG   GLU  14          1HG       GLU  14  10.877   0.678  -9.412
  108   2HG   GLU  14          2HG       GLU  14  11.390   1.807  -8.159
  109    H    ASN  15           H        ASN  15  13.092  -0.174  -4.334
  110    HA   ASN  15           HA       ASN  15  13.418  -2.883  -4.166
  111   1HB   ASN  15          1HB       ASN  15  15.942  -3.036  -3.817
  112   2HB   ASN  15          2HB       ASN  15  15.395  -2.883  -5.484
  113   1HD2  ASN  15          2HD2      ASN  15  17.899  -2.298  -5.180
  114   2HD2  ASN  15          1HD2      ASN  15  18.196  -0.597  -5.175
  115    H    VAL  16           H        VAL  16  12.121  -1.858  -2.419
  116    HA   VAL  16           HA       VAL  16  13.851  -1.336  -0.098
  117    HB   VAL  16           HB       VAL  16  12.040   0.278   0.699
  118   1HG1  VAL  16          1HG1      VAL  16  14.370   0.653  -0.734
  119   2HG1  VAL  16          2HG1      VAL  16  13.192   1.661  -1.577
  120   3HG1  VAL  16          3HG1      VAL  16  13.476   1.889   0.150
  121   1HG2  VAL  16          1HG2      VAL  16  10.894  -0.506  -1.772
  122   2HG2  VAL  16          2HG2      VAL  16  10.262   0.626  -0.579
  123   3HG2  VAL  16          3HG2      VAL  16  11.301   1.205  -1.885
  124    H    ASP  17           H        ASP  17  13.348  -2.489   1.643
  125    HA   ASP  17           HA       ASP  17  11.275  -4.436   1.528
  126   1HB   ASP  17          1HB       ASP  17  13.569  -3.869   3.183
  127   2HB   ASP  17          2HB       ASP  17  12.172  -4.237   4.190
  128    H    ILE  18           H        ILE  18   9.334  -4.531   2.584
  129    HA   ILE  18           HA       ILE  18   8.154  -2.041   3.341
  130    HB   ILE  18           HB       ILE  18   7.110  -4.875   3.382
  131   1HG1  ILE  18          1HG1      ILE  18   5.827  -2.815   1.730
  132   2HG1  ILE  18          2HG1      ILE  18   7.500  -3.145   1.296
  133   1HG2  ILE  18          1HG2      ILE  18   5.688  -2.321   4.124
  134   2HG2  ILE  18          2HG2      ILE  18   4.872  -3.845   3.774
  135   3HG2  ILE  18          3HG2      ILE  18   5.969  -3.727   5.150
  136   1HD1  ILE  18          1HD1      ILE  18   6.055  -5.597   1.701
  137   2HD1  ILE  18          2HD1      ILE  18   5.243  -4.570   0.517
  138   3HD1  ILE  18          3HD1      ILE  18   6.930  -5.026   0.280
  139    H    ILE  19           H        ILE  19   7.026  -1.740   5.421
  140    HA   ILE  19           HA       ILE  19   8.485  -3.108   7.590
  141    HB   ILE  19           HB       ILE  19   9.227  -1.217   8.523
  142   1HG1  ILE  19          1HG1      ILE  19   6.656   0.229   7.861
  143   2HG1  ILE  19          2HG1      ILE  19   6.954  -0.650   9.354
  144   1HG2  ILE  19          1HG2      ILE  19   8.332  -0.029   5.899
  145   2HG2  ILE  19          2HG2      ILE  19   9.417   0.771   7.037
  146   3HG2  ILE  19          3HG2      ILE  19   9.900  -0.745   6.278
  147   1HD1  ILE  19          1HD1      ILE  19   8.782   0.882   9.884
  148   2HD1  ILE  19          2HD1      ILE  19   8.459   1.773   8.398
  149   3HD1  ILE  19          3HD1      ILE  19   7.249   1.729   9.679
  150    H    ALA  20           H        ALA  20   5.514  -1.525   6.596
  151    HA   ALA  20           HA       ALA  20   4.134  -2.855   8.835
  152   1HB   ALA  20          1HB       ALA  20   4.151  -0.334   8.849
  153   2HB   ALA  20          2HB       ALA  20   3.158  -0.404   7.394
  154   3HB   ALA  20          3HB       ALA  20   2.557  -1.087   8.903
  155    H    VAL  21           H        VAL  21   1.736  -3.222   8.290
  156    HA   VAL  21           HA       VAL  21   1.113  -3.637   5.521
  157    HB   VAL  21           HB       VAL  21   2.527  -5.621   6.040
  158   1HG1  VAL  21          1HG1      VAL  21   1.653  -5.733   8.444
  159   2HG1  VAL  21          2HG1      VAL  21   0.278  -6.603   7.764
  160   3HG1  VAL  21          3HG1      VAL  21   1.908  -7.255   7.590
  161   1HG2  VAL  21          1HG2      VAL  21  -0.234  -5.682   5.045
  162   2HG2  VAL  21          2HG2      VAL  21   1.258  -6.247   4.294
  163   3HG2  VAL  21          3HG2      VAL  21   0.433  -7.255   5.483
  164    H    GLU  22           H        GLU  22  -0.983  -3.269   5.284
  165    HA   GLU  22           HA       GLU  22  -2.932  -4.307   7.131
  166   1HB   GLU  22          1HB       GLU  22  -2.508  -1.326   6.885
  167   2HB   GLU  22          2HB       GLU  22  -3.936  -2.063   7.597
  168   1HG   GLU  22          1HG       GLU  22  -2.413  -3.192   9.238
  169   2HG   GLU  22          2HG       GLU  22  -1.109  -2.189   8.604
  170    H    VAL  23           H        VAL  23  -3.761  -5.350   5.317
  171    HA   VAL  23           HA       VAL  23  -5.618  -3.820   3.770
  172    HB   VAL  23           HB       VAL  23  -4.655  -4.702   1.557
  173   1HG1  VAL  23          1HG1      VAL  23  -4.579  -2.289   2.739
  174   2HG1  VAL  23          2HG1      VAL  23  -2.851  -2.587   2.543
  175   3HG1  VAL  23          3HG1      VAL  23  -3.915  -2.610   1.137
  176   1HG2  VAL  23          1HG2      VAL  23  -2.250  -4.908   3.353
  177   2HG2  VAL  23          2HG2      VAL  23  -2.943  -6.152   2.313
  178   3HG2  VAL  23          3HG2      VAL  23  -2.129  -4.759   1.600
  179    H    ASN  24           H        ASN  24  -7.330  -5.059   3.877
  180    HA   ASN  24           HA       ASN  24  -6.993  -7.962   3.525
  181   1HB   ASN  24          1HB       ASN  24  -9.322  -6.636   4.902
  182   2HB   ASN  24          2HB       ASN  24  -8.878  -8.339   4.915
  183   1HD2  ASN  24          2HD2      ASN  24  -7.165  -9.026   6.200
  184   2HD2  ASN  24          1HD2      ASN  24  -6.533  -8.055   7.481
  185    H    VAL  25           H        VAL  25  -7.264  -8.119   1.379
  186    HA   VAL  25           HA       VAL  25  -8.807  -6.771  -0.382
  187    HB   VAL  25           HB       VAL  25  -9.085  -9.038  -1.580
  188   1HG1  VAL  25          1HG1      VAL  25  -7.338  -7.316  -2.023
  189   2HG1  VAL  25          2HG1      VAL  25  -6.290  -8.164  -0.886
  190   3HG1  VAL  25          3HG1      VAL  25  -6.826  -8.970  -2.361
  191   1HG2  VAL  25          1HG2      VAL  25  -8.586 -10.115   0.819
  192   2HG2  VAL  25          2HG2      VAL  25  -8.215 -10.933  -0.698
  193   3HG2  VAL  25          3HG2      VAL  25  -6.946 -10.072   0.173
  194    H    GLY  26           H        GLY  26 -10.779  -6.064   0.408
  195   1HA   GLY  26          1HA       GLY  26 -12.774  -8.135   1.046
  196   2HA   GLY  26          2HA       GLY  26 -13.121  -6.940  -0.194
  197    H    ASP  27           H        ASP  27 -11.240  -5.780   2.412
  198    HA   ASP  27           HA       ASP  27 -13.394  -5.075   4.153
  199   1HB   ASP  27          1HB       ASP  27 -10.475  -4.712   4.084
  200   2HB   ASP  27          2HB       ASP  27 -11.352  -3.399   4.863
  201    H    THR  28           H        THR  28 -13.665  -2.706   4.813
  202    HA   THR  28           HA       THR  28 -14.193  -1.182   2.374
  203    HB   THR  28           HB       THR  28 -15.103  -0.483   5.162
  204    HG1  THR  28           HG1      THR  28 -17.013  -1.634   4.626
  205   1HG2  THR  28          1HG2      THR  28 -15.414   0.845   2.754
  206   2HG2  THR  28          2HG2      THR  28 -16.946   0.007   3.000
  207   3HG2  THR  28          3HG2      THR  28 -16.335   1.104   4.237
  208    H    ILE  29           H        ILE  29 -12.440  -0.045   1.785
  209    HA   ILE  29           HA       ILE  29 -10.729   1.217   3.747
  210    HB   ILE  29           HB       ILE  29  -9.542   2.111   1.694
  211   1HG1  ILE  29          1HG1      ILE  29 -10.632   0.117  -0.090
  212   2HG1  ILE  29          2HG1      ILE  29 -11.896   1.225   0.434
  213   1HG2  ILE  29          1HG2      ILE  29  -9.814  -0.729   2.487
  214   2HG2  ILE  29          2HG2      ILE  29  -8.910  -0.381   1.013
  215   3HG2  ILE  29          3HG2      ILE  29  -8.410   0.337   2.544
  216   1HD1  ILE  29          1HD1      ILE  29  -9.272   2.176  -0.662
  217   2HD1  ILE  29          2HD1      ILE  29 -10.668   1.830  -1.683
  218   3HD1  ILE  29          3HD1      ILE  29 -10.766   3.088  -0.451
  219    H    ALA  30           H        ALA  30 -10.203   3.500   3.681
  220    HA   ALA  30           HA       ALA  30 -12.377   5.195   2.648
  221   1HB   ALA  30          1HB       ALA  30 -12.808   4.944   4.994
  222   2HB   ALA  30          2HB       ALA  30 -11.132   5.324   5.391
  223   3HB   ALA  30          3HB       ALA  30 -12.182   6.570   4.715
  224    H    VAL  31           H        VAL  31 -11.556   7.648   3.150
  225    HA   VAL  31           HA       VAL  31  -9.125   7.873   1.577
  226    HB   VAL  31           HB       VAL  31  -9.721  10.354   1.663
  227   1HG1  VAL  31          1HG1      VAL  31 -11.381   8.248   0.334
  228   2HG1  VAL  31          2HG1      VAL  31 -11.702   9.961   0.063
  229   3HG1  VAL  31          3HG1      VAL  31 -10.129   9.281  -0.359
  230   1HG2  VAL  31          1HG2      VAL  31 -11.337   9.780   3.667
  231   2HG2  VAL  31          2HG2      VAL  31 -11.699  11.086   2.539
  232   3HG2  VAL  31          3HG2      VAL  31 -12.486   9.518   2.355
  233    H    ASP  32           H        ASP  32  -8.646   6.922   4.158
  234    HA   ASP  32           HA       ASP  32  -6.539   8.456   5.029
  235   1HB   ASP  32          1HB       ASP  32  -7.523   9.397   7.181
  236   2HB   ASP  32          2HB       ASP  32  -7.958  10.238   5.696
  237    H    ASP  33           H        ASP  33  -6.104   6.090   4.957
  238    HA   ASP  33           HA       ASP  33  -6.282   5.012   7.649
  239   1HB   ASP  33          1HB       ASP  33  -7.010   2.759   6.713
  240   2HB   ASP  33          2HB       ASP  33  -8.252   4.005   6.791
  241    H    THR  34           H        THR  34  -4.175   4.769   8.049
  242    HA   THR  34           HA       THR  34  -2.120   4.479   6.265
  243    HB   THR  34           HB       THR  34  -1.150   3.053   8.329
  244    HG1  THR  34           HG1      THR  34  -2.953   4.832   9.557
  245   1HG2  THR  34          1HG2      THR  34  -0.193   5.125   7.501
  246   2HG2  THR  34          2HG2      THR  34  -1.477   6.037   8.296
  247   3HG2  THR  34          3HG2      THR  34  -0.315   5.128   9.263
  248    H    LEU  35           H        LEU  35  -1.658   3.027   4.807
  249    HA   LEU  35           HA       LEU  35  -2.744   0.331   5.036
  250   1HB   LEU  35          1HB       LEU  35  -1.270   1.654   2.754
  251   2HB   LEU  35          2HB       LEU  35  -2.032   0.076   2.701
  252    HG   LEU  35           HG       LEU  35  -3.449   2.721   3.040
  253   1HD1  LEU  35          1HD1      LEU  35  -2.766   1.048   0.732
  254   2HD1  LEU  35          2HD1      LEU  35  -4.456   1.545   0.812
  255   3HD1  LEU  35          3HD1      LEU  35  -3.178   2.760   0.814
  256   1HD2  LEU  35          1HD2      LEU  35  -4.298  -0.067   3.451
  257   2HD2  LEU  35          2HD2      LEU  35  -4.957   1.432   4.105
  258   3HD2  LEU  35          3HD2      LEU  35  -5.380   0.923   2.470
  259    H    ILE  36           H        ILE  36   0.333   2.043   4.804
  260    HA   ILE  36           HA       ILE  36   1.674  -0.090   6.181
  261    HB   ILE  36           HB       ILE  36   3.458  -0.347   4.380
  262   1HG1  ILE  36          1HG1      ILE  36   2.934   0.058   2.128
  263   2HG1  ILE  36          2HG1      ILE  36   1.232   0.339   2.475
  264   1HG2  ILE  36          1HG2      ILE  36   1.401  -1.855   5.087
  265   2HG2  ILE  36          2HG2      ILE  36   0.966  -1.588   3.401
  266   3HG2  ILE  36          3HG2      ILE  36   2.520  -2.319   3.808
  267   1HD1  ILE  36          1HD1      ILE  36   3.464   2.165   3.330
  268   2HD1  ILE  36          2HD1      ILE  36   2.495   2.378   1.871
  269   3HD1  ILE  36          3HD1      ILE  36   1.730   2.465   3.457
  270    H    THR  37           H        THR  37   4.219   0.397   5.980
  271    HA   THR  37           HA       THR  37   4.688   3.274   5.985
  272    HB   THR  37           HB       THR  37   5.365   1.506   8.338
  273    HG1  THR  37           HG1      THR  37   3.621   2.246   9.220
  274   1HG2  THR  37          1HG2      THR  37   5.889   4.420   7.849
  275   2HG2  THR  37          2HG2      THR  37   5.951   3.661   9.439
  276   3HG2  THR  37          3HG2      THR  37   7.068   3.153   8.174
  277    H    LEU  38           H        LEU  38   5.561   1.948   3.972
  278    HA   LEU  38           HA       LEU  38   7.764   0.382   3.883
  279   1HB   LEU  38          1HB       LEU  38   7.045   2.751   2.183
  280   2HB   LEU  38          2HB       LEU  38   8.454   1.769   1.836
  281    HG   LEU  38           HG       LEU  38   6.753   0.969   0.425
  282   1HD1  LEU  38          1HD1      LEU  38   8.051  -0.704   1.926
  283   2HD1  LEU  38          2HD1      LEU  38   6.470  -0.982   2.656
  284   3HD1  LEU  38          3HD1      LEU  38   6.709  -1.267   0.932
  285   1HD2  LEU  38          1HD2      LEU  38   4.987   2.040   2.120
  286   2HD2  LEU  38          2HD2      LEU  38   4.545   0.862   0.886
  287   3HD2  LEU  38          3HD2      LEU  38   4.807   0.340   2.551
  288    H    GLU  39           H        GLU  39  10.068   0.945   3.327
  289    HA   GLU  39           HA       GLU  39  11.164   3.412   4.228
  290   1HB   GLU  39          1HB       GLU  39  10.668   2.595   6.423
  291   2HB   GLU  39          2HB       GLU  39  11.374   1.028   6.059
  292   1HG   GLU  39          1HG       GLU  39  13.575   2.194   5.774
  293   2HG   GLU  39          2HG       GLU  39  12.802   3.648   6.405
  294    H    THR  40           H        THR  40  13.445   3.537   3.970
  295    HA   THR  40           HA       THR  40  14.480   1.492   2.145
  296    HB   THR  40           HB       THR  40  16.021   3.163   1.353
  297    HG1  THR  40           HG1      THR  40  16.463   4.957   2.412
  298   1HG2  THR  40          1HG2      THR  40  13.187   3.951   1.585
  299   2HG2  THR  40          2HG2      THR  40  14.332   5.187   1.064
  300   3HG2  THR  40          3HG2      THR  40  14.183   3.685   0.155
  301    H    ASP  41           H        ASP  41  16.066   3.702   4.424
  302    HA   ASP  41           HA       ASP  41  17.123   1.558   6.015
  303   1HB   ASP  41          1HB       ASP  41  19.538   2.346   5.525
  304   2HB   ASP  41          2HB       ASP  41  18.761   1.272   4.365
  305    H    LYS  42           H        LYS  42  15.601   4.085   6.254
  306    HA   LYS  42           HA       LYS  42  16.510   4.994   8.692
  307   1HB   LYS  42          1HB       LYS  42  18.078   6.045   6.544
  308   2HB   LYS  42          2HB       LYS  42  17.155   7.359   7.257
  309   1HG   LYS  42          1HG       LYS  42  18.935   5.465   8.778
  310   2HG   LYS  42          2HG       LYS  42  19.370   7.101   8.275
  311   1HD   LYS  42          1HD       LYS  42  16.921   7.356   9.598
  312   2HD   LYS  42          2HD       LYS  42  17.864   6.228  10.573
  313   1HE   LYS  42          1HE       LYS  42  19.757   7.880  10.463
  314   2HE   LYS  42          2HE       LYS  42  18.626   9.017   9.729
  315   1HZ   LYS  42          1HZ       LYS  42  17.293   8.184  11.923
  316   2HZ   LYS  42          2HZ       LYS  42  18.890   8.209  12.478
  317   3HZ   LYS  42          3HZ       LYS  42  18.199   9.607  11.823
  318    H    ALA  43           H        ALA  43  15.090   6.065   5.635
  319    HA   ALA  43           HA       ALA  43  13.115   7.658   7.101
  320   1HB   ALA  43          1HB       ALA  43  14.425   7.951   4.587
  321   2HB   ALA  43          2HB       ALA  43  12.686   7.845   4.314
  322   3HB   ALA  43          3HB       ALA  43  13.334   9.071   5.404
  323    H    THR  44           H        THR  44  11.147   6.890   7.482
  324    HA   THR  44           HA       THR  44  10.250   4.532   5.969
  325    HB   THR  44           HB       THR  44   8.814   4.023   7.871
  326    HG1  THR  44           HG1      THR  44   9.887   6.389   9.006
  327   1HG2  THR  44          1HG2      THR  44  11.659   4.090   8.049
  328   2HG2  THR  44          2HG2      THR  44  10.959   4.410   9.637
  329   3HG2  THR  44          3HG2      THR  44  10.521   2.945   8.759
  330    H    MET  45           H        MET  45   8.753   4.876   4.480
  331    HA   MET  45           HA       MET  45   7.080   7.273   4.650
  332   1HB   MET  45          1HB       MET  45   8.419   6.074   2.534
  333   2HB   MET  45          2HB       MET  45   6.737   5.631   2.267
  334   1HG   MET  45          1HG       MET  45   7.808   8.424   2.612
  335   2HG   MET  45          2HG       MET  45   7.299   7.680   1.100
  336   1HE   MET  45          1HE       MET  45   6.163  10.136   1.155
  337   2HE   MET  45          2HE       MET  45   4.605  10.444   1.921
  338   3HE   MET  45          3HE       MET  45   6.088  10.531   2.872
  339    H    ASP  46           H        ASP  46   4.936   7.206   4.995
  340    HA   ASP  46           HA       ASP  46   3.663   4.555   5.121
  341   1HB   ASP  46          1HB       ASP  46   2.230   5.422   6.912
  342   2HB   ASP  46          2HB       ASP  46   3.932   5.543   7.350
  343    H    VAL  47           H        VAL  47   1.610   4.293   4.325
  344    HA   VAL  47           HA       VAL  47   0.614   6.539   2.697
  345    HB   VAL  47           HB       VAL  47   0.288   3.569   2.242
  346   1HG1  VAL  47          1HG1      VAL  47  -1.394   5.701   1.434
  347   2HG1  VAL  47          2HG1      VAL  47  -0.527   5.135   0.005
  348   3HG1  VAL  47          3HG1      VAL  47  -1.479   4.002   0.966
  349   1HG2  VAL  47          1HG2      VAL  47   2.505   4.741   1.702
  350   2HG2  VAL  47          2HG2      VAL  47   1.751   3.776   0.433
  351   3HG2  VAL  47          3HG2      VAL  47   1.612   5.534   0.403
  352    HA   PRO  48           HA       PRO  48  -2.887   6.070   5.493
  353   1HB   PRO  48          1HB       PRO  48  -3.922   8.498   5.162
  354   2HB   PRO  48          2HB       PRO  48  -2.393   8.277   6.023
  355   1HG   PRO  48          1HG       PRO  48  -2.879   9.222   3.235
  356   2HG   PRO  48          2HG       PRO  48  -1.674   9.770   4.412
  357   1HD   PRO  48          1HD       PRO  48  -1.221   7.962   2.328
  358   2HD   PRO  48          2HD       PRO  48  -0.170   8.206   3.736
  359    H    ALA  49           H        ALA  49  -2.899   5.236   2.563
  360    HA   ALA  49           HA       ALA  49  -4.405   4.582   0.997
  361   1HB   ALA  49          1HB       ALA  49  -6.849   4.484   1.881
  362   2HB   ALA  49          2HB       ALA  49  -5.629   3.405   2.560
  363   3HB   ALA  49          3HB       ALA  49  -6.105   4.860   3.436
  364    H    GLU  50           H        GLU  50  -5.883   5.359  -0.549
  365    HA   GLU  50           HA       GLU  50  -6.920   8.059  -0.228
  366   1HB   GLU  50          1HB       GLU  50  -4.503   7.904  -1.339
  367   2HB   GLU  50          2HB       GLU  50  -5.456   7.528  -2.768
  368   1HG   GLU  50          1HG       GLU  50  -5.074   9.848  -2.813
  369   2HG   GLU  50          2HG       GLU  50  -6.754   9.633  -2.325
  370    H    VAL  51           H        VAL  51  -8.789   6.526  -0.153
  371    HA   VAL  51           HA       VAL  51 -10.306   6.679  -2.482
  372    HB   VAL  51           HB       VAL  51 -10.364   3.985  -2.667
  373   1HG1  VAL  51          1HG1      VAL  51  -9.805   6.070  -4.309
  374   2HG1  VAL  51          2HG1      VAL  51  -8.284   5.179  -4.356
  375   3HG1  VAL  51          3HG1      VAL  51  -9.790   4.376  -4.801
  376   1HG2  VAL  51          1HG2      VAL  51  -8.148   4.262  -1.128
  377   2HG2  VAL  51          2HG2      VAL  51  -8.418   2.921  -2.239
  378   3HG2  VAL  51          3HG2      VAL  51  -7.436   4.295  -2.741
  379    H    ALA  52           H        ALA  52 -12.418   5.783  -2.242
  380    HA   ALA  52           HA       ALA  52 -13.003   4.849   0.496
  381   1HB   ALA  52          1HB       ALA  52 -14.641   6.673  -1.242
  382   2HB   ALA  52          2HB       ALA  52 -15.143   6.033   0.322
  383   3HB   ALA  52          3HB       ALA  52 -13.759   7.120   0.221
  384    H    GLY  53           H        GLY  53 -12.794   2.685  -0.466
  385   1HA   GLY  53          1HA       GLY  53 -14.137   1.559  -2.517
  386   2HA   GLY  53          2HA       GLY  53 -15.396   1.756  -1.315
  387    H    VAL  54           H        VAL  54 -13.645  -0.535  -2.582
  388    HA   VAL  54           HA       VAL  54 -12.914  -1.870  -0.066
  389    HB   VAL  54           HB       VAL  54 -14.618  -3.096  -2.240
  390   1HG1  VAL  54          1HG1      VAL  54 -12.953  -4.601  -1.044
  391   2HG1  VAL  54          2HG1      VAL  54 -13.907  -4.325   0.413
  392   3HG1  VAL  54          3HG1      VAL  54 -14.645  -5.095  -0.989
  393   1HG2  VAL  54          1HG2      VAL  54 -15.689  -1.410  -0.648
  394   2HG2  VAL  54          2HG2      VAL  54 -16.448  -2.997  -0.777
  395   3HG2  VAL  54          3HG2      VAL  54 -15.430  -2.616   0.612
  396    H    VAL  55           H        VAL  55 -11.149  -3.201  -0.191
  397    HA   VAL  55           HA       VAL  55  -9.547  -3.043  -2.574
  398    HB   VAL  55           HB       VAL  55  -9.017  -4.566  -0.023
  399   1HG1  VAL  55          1HG1      VAL  55  -7.791  -5.423  -2.021
  400   2HG1  VAL  55          2HG1      VAL  55  -7.093  -3.815  -2.230
  401   3HG1  VAL  55          3HG1      VAL  55  -6.732  -4.750  -0.780
  402   1HG2  VAL  55          1HG2      VAL  55  -9.208  -1.940  -0.112
  403   2HG2  VAL  55          2HG2      VAL  55  -7.930  -2.730   0.811
  404   3HG2  VAL  55          3HG2      VAL  55  -7.583  -2.070  -0.788
  405    H    LYS  56           H        LYS  56  -8.867  -4.699  -3.876
  406    HA   LYS  56           HA       LYS  56 -10.453  -7.180  -3.725
  407   1HB   LYS  56          1HB       LYS  56  -9.320  -6.771  -6.335
  408   2HB   LYS  56          2HB       LYS  56 -11.011  -6.954  -5.884
  409   1HG   LYS  56          1HG       LYS  56  -9.588  -4.325  -5.634
  410   2HG   LYS  56          2HG       LYS  56 -10.333  -4.845  -7.146
  411   1HD   LYS  56          1HD       LYS  56 -11.953  -4.984  -4.653
  412   2HD   LYS  56          2HD       LYS  56 -11.658  -3.399  -5.370
  413   1HE   LYS  56          1HE       LYS  56 -13.397  -3.817  -6.699
  414   2HE   LYS  56          2HE       LYS  56 -12.354  -4.970  -7.531
  415   1HZ   LYS  56          1HZ       LYS  56 -13.163  -6.558  -5.663
  416   2HZ   LYS  56          2HZ       LYS  56 -14.454  -5.470  -5.538
  417   3HZ   LYS  56          3HZ       LYS  56 -14.153  -6.263  -7.002
  418    H    GLU  57           H        GLU  57  -7.395  -5.746  -4.763
  419    HA   GLU  57           HA       GLU  57  -6.169  -8.372  -4.452
  420   1HB   GLU  57          1HB       GLU  57  -5.717  -6.152  -6.344
  421   2HB   GLU  57          2HB       GLU  57  -4.278  -6.999  -5.792
  422   1HG   GLU  57          1HG       GLU  57  -6.085  -9.011  -6.442
  423   2HG   GLU  57          2HG       GLU  57  -6.269  -7.802  -7.712
  424    H    VAL  58           H        VAL  58  -3.700  -8.132  -3.996
  425    HA   VAL  58           HA       VAL  58  -2.901  -5.979  -2.275
  426    HB   VAL  58           HB       VAL  58  -4.296  -7.170  -0.679
  427   1HG1  VAL  58          1HG1      VAL  58  -3.562  -9.430  -2.065
  428   2HG1  VAL  58          2HG1      VAL  58  -2.707  -9.606  -0.532
  429   3HG1  VAL  58          3HG1      VAL  58  -4.459  -9.393  -0.546
  430   1HG2  VAL  58          1HG2      VAL  58  -1.332  -7.503  -0.266
  431   2HG2  VAL  58          2HG2      VAL  58  -2.359  -6.174   0.273
  432   3HG2  VAL  58          3HG2      VAL  58  -2.525  -7.770   1.007
  433    H    LYS  59           H        LYS  59  -0.783  -5.770  -2.498
  434    HA   LYS  59           HA       LYS  59   0.867  -8.152  -2.965
  435   1HB   LYS  59          1HB       LYS  59   1.347  -5.626  -4.514
  436   2HB   LYS  59          2HB       LYS  59   1.924  -7.254  -4.853
  437   1HG   LYS  59          1HG       LYS  59  -0.767  -7.603  -4.996
  438   2HG   LYS  59          2HG       LYS  59  -0.593  -5.952  -5.594
  439   1HD   LYS  59          1HD       LYS  59   1.403  -7.150  -6.943
  440   2HD   LYS  59          2HD       LYS  59   0.286  -8.506  -6.780
  441   1HE   LYS  59          1HE       LYS  59  -1.418  -6.538  -7.526
  442   2HE   LYS  59          2HE       LYS  59   0.051  -6.031  -8.360
  443   1HZ   LYS  59          1HZ       LYS  59   0.076  -8.561  -9.026
  444   2HZ   LYS  59          2HZ       LYS  59  -1.590  -8.416  -8.775
  445   3HZ   LYS  59          3HZ       LYS  59  -0.819  -7.427  -9.908
  446    H    VAL  60           H        VAL  60   1.122  -7.561  -0.599
  447    HA   VAL  60           HA       VAL  60   3.648  -6.348  -0.218
  448    HB   VAL  60           HB       VAL  60   2.792  -4.209  -0.331
  449   1HG1  VAL  60          1HG1      VAL  60   0.271  -5.192   1.000
  450   2HG1  VAL  60          2HG1      VAL  60   0.579  -3.525   0.516
  451   3HG1  VAL  60          3HG1      VAL  60   0.481  -4.794  -0.707
  452   1HG2  VAL  60          1HG2      VAL  60   3.863  -4.503   1.865
  453   2HG2  VAL  60          2HG2      VAL  60   2.605  -3.268   1.899
  454   3HG2  VAL  60          3HG2      VAL  60   2.290  -4.867   2.573
  455    H    LYS  61           H        LYS  61   4.325  -6.379   2.032
  456    HA   LYS  61           HA       LYS  61   2.748  -7.486   4.098
  457   1HB   LYS  61          1HB       LYS  61   3.308  -9.427   2.367
  458   2HB   LYS  61          2HB       LYS  61   4.823  -9.453   3.258
  459   1HG   LYS  61          1HG       LYS  61   3.872 -10.690   4.820
  460   2HG   LYS  61          2HG       LYS  61   2.730  -9.386   5.156
  461   1HD   LYS  61          1HD       LYS  61   1.613 -10.413   2.936
  462   2HD   LYS  61          2HD       LYS  61   2.379 -11.864   3.585
  463   1HE   LYS  61          1HE       LYS  61   0.710 -10.088   5.328
  464   2HE   LYS  61          2HE       LYS  61  -0.038 -11.308   4.298
  465   1HZ   LYS  61          1HZ       LYS  61   2.138 -12.406   5.755
  466   2HZ   LYS  61          2HZ       LYS  61   1.028 -11.685   6.809
  467   3HZ   LYS  61          3HZ       LYS  61   0.516 -12.888   5.732
  468    H    VAL  62           H        VAL  62   4.547  -8.623   5.744
  469    HA   VAL  62           HA       VAL  62   6.481  -6.459   6.143
  470    HB   VAL  62           HB       VAL  62   5.567  -8.591   8.081
  471   1HG1  VAL  62          1HG1      VAL  62   7.391  -6.219   8.379
  472   2HG1  VAL  62          2HG1      VAL  62   6.615  -7.005   9.754
  473   3HG1  VAL  62          3HG1      VAL  62   7.730  -7.913   8.734
  474   1HG2  VAL  62          1HG2      VAL  62   4.074  -6.508   7.191
  475   2HG2  VAL  62          2HG2      VAL  62   3.922  -7.232   8.792
  476   3HG2  VAL  62          3HG2      VAL  62   4.890  -5.775   8.573
  477    H    GLY  63           H        GLY  63   7.927  -7.331   4.493
  478   1HA   GLY  63          1HA       GLY  63   9.294  -9.815   5.274
  479   2HA   GLY  63          2HA       GLY  63  10.232  -8.339   5.119
  480    H    ASP  64           H        ASP  64   9.068  -7.224   2.851
  481    HA   ASP  64           HA       ASP  64  10.168  -8.992   0.819
  482   1HB   ASP  64          1HB       ASP  64   8.164  -8.519  -0.673
  483   2HB   ASP  64          2HB       ASP  64   7.898  -9.655   0.646
  484    H    LYS  65           H        LYS  65  10.921  -7.929  -1.017
  485    HA   LYS  65           HA       LYS  65  11.588  -5.168  -0.635
  486   1HB   LYS  65          1HB       LYS  65  12.377  -7.342  -2.432
  487   2HB   LYS  65          2HB       LYS  65  12.321  -5.771  -3.221
  488   1HG   LYS  65          1HG       LYS  65  13.634  -5.247  -0.857
  489   2HG   LYS  65          2HG       LYS  65  14.240  -6.836  -1.326
  490   1HD   LYS  65          1HD       LYS  65  14.073  -4.916  -3.532
  491   2HD   LYS  65          2HD       LYS  65  15.196  -4.451  -2.252
  492   1HE   LYS  65          1HE       LYS  65  16.300  -5.763  -4.004
  493   2HE   LYS  65          2HE       LYS  65  16.338  -6.584  -2.445
  494   1HZ   LYS  65          1HZ       LYS  65  14.287  -7.798  -3.260
  495   2HZ   LYS  65          2HZ       LYS  65  14.660  -7.207  -4.800
  496   3HZ   LYS  65          3HZ       LYS  65  15.753  -8.215  -3.993
  497    H    ILE  66           H        ILE  66  10.764  -3.390  -1.622
  498    HA   ILE  66           HA       ILE  66   8.669  -3.795  -3.627
  499    HB   ILE  66           HB       ILE  66   8.110  -3.106  -1.030
  500   1HG1  ILE  66          1HG1      ILE  66   5.867  -2.643  -1.850
  501   2HG1  ILE  66          2HG1      ILE  66   6.496  -2.402  -3.479
  502   1HG2  ILE  66          1HG2      ILE  66   8.070  -0.542  -2.613
  503   2HG2  ILE  66          2HG2      ILE  66   7.285  -0.788  -1.053
  504   3HG2  ILE  66          3HG2      ILE  66   9.040  -0.886  -1.182
  505   1HD1  ILE  66          1HD1      ILE  66   7.419  -4.909  -2.644
  506   2HD1  ILE  66          2HD1      ILE  66   5.717  -4.821  -2.182
  507   3HD1  ILE  66          3HD1      ILE  66   6.192  -4.554  -3.861
  508    H    SER  67           H        SER  67   8.028  -1.592  -4.625
  509    HA   SER  67           HA       SER  67  10.216   0.299  -4.817
  510   1HB   SER  67          1HB       SER  67  10.163   0.060  -7.376
  511   2HB   SER  67          2HB       SER  67  11.023  -1.181  -6.465
  512    HG   SER  67           HG       SER  67   8.973  -1.477  -8.136
  513    H    GLU  68           H        GLU  68   9.594   2.303  -5.526
  514    HA   GLU  68           HA       GLU  68   7.069   3.238  -5.149
  515   1HB   GLU  68          1HB       GLU  68   9.230   4.243  -6.989
  516   2HB   GLU  68          2HB       GLU  68   7.731   5.124  -6.734
  517   1HG   GLU  68          1HG       GLU  68   8.211   5.421  -4.420
  518   2HG   GLU  68          2HG       GLU  68   9.595   4.333  -4.513
  519    H    GLY  69           H        GLY  69   5.379   2.094  -5.997
  520   1HA   GLY  69          1HA       GLY  69   5.012   2.361  -8.897
  521   2HA   GLY  69          2HA       GLY  69   3.735   2.115  -7.718
  522    H    GLY  70           H        GLY  70   4.104  -0.055  -6.426
  523   1HA   GLY  70          1HA       GLY  70   4.965  -2.339  -6.664
  524   2HA   GLY  70          2HA       GLY  70   4.813  -2.136  -8.403
  525    H    LEU  71           H        LEU  71   2.186  -0.690  -7.870
  526    HA   LEU  71           HA       LEU  71  -0.034  -1.163  -7.643
  527   1HB   LEU  71          1HB       LEU  71   0.516  -2.336  -9.741
  528   2HB   LEU  71          2HB       LEU  71   0.871  -3.790  -8.827
  529    HG   LEU  71           HG       LEU  71  -1.410  -4.096  -8.237
  530   1HD1  LEU  71          1HD1      LEU  71  -1.581  -1.238  -8.804
  531   2HD1  LEU  71          2HD1      LEU  71  -2.942  -2.170  -9.426
  532   3HD1  LEU  71          3HD1      LEU  71  -2.537  -2.238  -7.710
  533   1HD2  LEU  71          1HD2      LEU  71  -0.752  -4.703 -10.558
  534   2HD2  LEU  71          2HD2      LEU  71  -2.470  -4.349 -10.375
  535   3HD2  LEU  71          3HD2      LEU  71  -1.396  -3.152 -11.099
  536    H    ILE  72           H        ILE  72   0.997  -1.336  -5.245
  537    HA   ILE  72           HA       ILE  72   1.079  -3.675  -3.832
  538    HB   ILE  72           HB       ILE  72   0.350  -0.878  -3.097
  539   1HG1  ILE  72          1HG1      ILE  72   2.349  -2.505  -1.638
  540   2HG1  ILE  72          2HG1      ILE  72   2.688  -2.179  -3.335
  541   1HG2  ILE  72          1HG2      ILE  72  -0.390  -3.251  -1.501
  542   2HG2  ILE  72          2HG2      ILE  72   0.460  -1.970  -0.633
  543   3HG2  ILE  72          3HG2      ILE  72  -1.047  -1.615  -1.476
  544   1HD1  ILE  72          1HD1      ILE  72   1.851   0.230  -2.072
  545   2HD1  ILE  72          2HD1      ILE  72   3.134  -0.517  -1.121
  546   3HD1  ILE  72          3HD1      ILE  72   3.398  -0.156  -2.827
  547    H    VAL  73           H        VAL  73  -1.805  -1.632  -3.431
  548    HA   VAL  73           HA       VAL  73  -3.434  -4.077  -3.676
  549    HB   VAL  73           HB       VAL  73  -4.932  -3.243  -1.960
  550   1HG1  VAL  73          1HG1      VAL  73  -2.267  -4.087  -1.541
  551   2HG1  VAL  73          2HG1      VAL  73  -2.639  -2.880  -0.309
  552   3HG1  VAL  73          3HG1      VAL  73  -3.663  -4.305  -0.485
  553   1HG2  VAL  73          1HG2      VAL  73  -3.041  -0.898  -1.807
  554   2HG2  VAL  73          2HG2      VAL  73  -4.735  -0.869  -2.296
  555   3HG2  VAL  73          3HG2      VAL  73  -4.305  -1.243  -0.627
  556    H    VAL  74           H        VAL  74  -5.670  -3.737  -4.280
  557    HA   VAL  74           HA       VAL  74  -6.123  -1.269  -5.838
  558    HB   VAL  74           HB       VAL  74  -6.994  -4.043  -6.681
  559   1HG1  VAL  74          1HG1      VAL  74  -8.201  -1.807  -7.378
  560   2HG1  VAL  74          2HG1      VAL  74  -6.858  -1.707  -8.517
  561   3HG1  VAL  74          3HG1      VAL  74  -7.934  -3.104  -8.541
  562   1HG2  VAL  74          1HG2      VAL  74  -4.550  -2.459  -7.341
  563   2HG2  VAL  74          2HG2      VAL  74  -4.718  -4.187  -7.023
  564   3HG2  VAL  74          3HG2      VAL  74  -5.260  -3.517  -8.561
  565    H    VAL  75           H        VAL  75  -8.068  -0.315  -5.473
  566    HA   VAL  75           HA       VAL  75 -10.018  -1.827  -3.884
  567    HB   VAL  75           HB       VAL  75 -10.686   0.274  -2.858
  568   1HG1  VAL  75          1HG1      VAL  75  -8.094  -0.970  -2.557
  569   2HG1  VAL  75          2HG1      VAL  75  -8.072   0.717  -2.046
  570   3HG1  VAL  75          3HG1      VAL  75  -9.222  -0.407  -1.324
  571   1HG2  VAL  75          1HG2      VAL  75  -9.594   1.476  -5.023
  572   2HG2  VAL  75          2HG2      VAL  75 -10.005   2.306  -3.523
  573   3HG2  VAL  75          3HG2      VAL  75  -8.350   1.769  -3.808
  574    H    GLU  76           H        GLU  76 -12.191  -0.491  -3.882
  575    HA   GLU  76           HA       GLU  76 -13.052  -0.430  -6.667
  576   1HB   GLU  76          1HB       GLU  76 -14.203  -1.382  -4.283
  577   2HB   GLU  76          2HB       GLU  76 -15.156   0.027  -4.734
  578   1HG   GLU  76          1HG       GLU  76 -15.104  -1.134  -7.102
  579   2HG   GLU  76          2HG       GLU  76 -14.834  -2.574  -6.123
  580    H    ALA  77           H        ALA  77 -12.859   1.614  -3.816
  581    HA   ALA  77           HA       ALA  77 -13.077   3.837  -3.479
  582   1HB   ALA  77          1HB       ALA  77 -11.933   5.148  -4.922
  583   2HB   ALA  77          2HB       ALA  77 -12.694   4.442  -6.348
  584   3HB   ALA  77          3HB       ALA  77 -11.414   3.568  -5.505
  585    H    GLU  78           H        GLU  78 -14.710   5.217  -3.235
  586    HA   GLU  78           HA       GLU  78 -16.907   5.875  -3.270
  587   1HB   GLU  78          1HB       GLU  78 -17.502   7.004  -5.401
  588   2HB   GLU  78          2HB       GLU  78 -15.910   7.441  -4.797
  589   1HG   GLU  78          1HG       GLU  78 -14.872   5.927  -6.391
  590   2HG   GLU  78          2HG       GLU  78 -16.461   5.441  -6.980
  591    H    GLY  79           H        GLY  79 -17.209   3.321  -3.069
  592   1HA   GLY  79          1HA       GLY  79 -18.398   1.435  -3.680
  593   2HA   GLY  79          2HA       GLY  79 -18.505   2.077  -5.312
  594    H    THR  80           H        THR  80 -19.529   4.103  -2.720
  595    HA   THR  80           HA       THR  80 -21.563   4.867  -2.046
  596    HB   THR  80           HB       THR  80 -23.152   5.348  -3.738
  597    HG1  THR  80           HG1      THR  80 -23.670   3.810  -5.041
  598   1HG2  THR  80          1HG2      THR  80 -20.341   5.546  -4.483
  599   2HG2  THR  80          2HG2      THR  80 -21.454   5.581  -5.851
  600   3HG2  THR  80          3HG2      THR  80 -21.626   6.753  -4.545
  601    H    ALA  81           H        ALA  81 -24.045   4.221  -2.039
  602    HA   ALA  81           HA       ALA  81 -24.424   1.337  -1.960
  603   1HB   ALA  81          1HB       ALA  81 -24.954   2.972   0.513
  604   2HB   ALA  81          2HB       ALA  81 -23.489   2.021   0.268
  605   3HB   ALA  81          3HB       ALA  81 -25.060   1.221   0.329

  No H/Q in entry =         605
  Start of MODEL   11
    1    H1   ALA   1           H1       ALA   1 -13.213   6.080  -9.895
    2    H2   ALA   1           H2       ALA   1 -14.335   6.182 -11.189
    3    H3   ALA   1           H3       ALA   1 -14.868   5.730  -9.622
    4    HA   ALA   1           HA       ALA   1 -14.786   3.745 -10.618
    5   1HB   ALA   1          1HB       ALA   1 -13.512   3.175 -12.444
    6   2HB   ALA   1          2HB       ALA   1 -12.180   4.235 -11.983
    7   3HB   ALA   1          3HB       ALA   1 -13.656   4.919 -12.661
    8    H    LEU   2           H        LEU   2 -12.709   2.005 -10.768
    9    HA   LEU   2           HA       LEU   2 -12.033   1.598  -8.069
   10   1HB   LEU   2          1HB       LEU   2 -11.090   0.378 -10.644
   11   2HB   LEU   2          2HB       LEU   2 -10.365  -0.082  -9.116
   12    HG   LEU   2           HG       LEU   2 -13.005  -0.395  -8.541
   13   1HD1  LEU   2          1HD1      LEU   2 -12.657  -0.648 -11.477
   14   2HD1  LEU   2          2HD1      LEU   2 -13.661  -1.843 -10.657
   15   3HD1  LEU   2          3HD1      LEU   2 -14.059  -0.130 -10.541
   16   1HD2  LEU   2          1HD2      LEU   2 -10.813  -1.944  -8.559
   17   2HD2  LEU   2          2HD2      LEU   2 -12.436  -2.564  -8.261
   18   3HD2  LEU   2          3HD2      LEU   2 -11.721  -2.698  -9.868
   19    H    VAL   3           H        VAL   3  -9.641   1.128  -7.460
   20    HA   VAL   3           HA       VAL   3  -7.890   3.261  -8.466
   21    HB   VAL   3           HB       VAL   3  -8.683   2.773  -5.606
   22   1HG1  VAL   3          1HG1      VAL   3  -6.244   2.696  -5.610
   23   2HG1  VAL   3          2HG1      VAL   3  -6.191   4.223  -6.495
   24   3HG1  VAL   3          3HG1      VAL   3  -6.831   4.179  -4.851
   25   1HG2  VAL   3          1HG2      VAL   3  -9.321   4.700  -7.524
   26   2HG2  VAL   3          2HG2      VAL   3  -9.711   4.727  -5.804
   27   3HG2  VAL   3          3HG2      VAL   3  -8.237   5.501  -6.386
   28    H    GLU   4           H        GLU   4  -5.618   2.940  -7.912
   29    HA   GLU   4           HA       GLU   4  -4.910   0.152  -7.320
   30   1HB   GLU   4          1HB       GLU   4  -4.010   1.824  -9.657
   31   2HB   GLU   4          2HB       GLU   4  -3.051   0.471  -9.071
   32   1HG   GLU   4          1HG       GLU   4  -4.319  -0.384 -10.839
   33   2HG   GLU   4          2HG       GLU   4  -5.125  -0.948  -9.377
   34    H    LEU   5           H        LEU   5  -3.953   0.390  -5.382
   35    HA   LEU   5           HA       LEU   5  -2.546   2.657  -4.513
   36   1HB   LEU   5          1HB       LEU   5  -3.268   0.123  -3.463
   37   2HB   LEU   5          2HB       LEU   5  -1.546   0.327  -3.195
   38    HG   LEU   5           HG       LEU   5  -2.969   1.087  -1.298
   39   1HD1  LEU   5          1HD1      LEU   5  -0.658   2.057  -2.050
   40   2HD1  LEU   5          2HD1      LEU   5  -1.608   3.505  -2.382
   41   3HD1  LEU   5          3HD1      LEU   5  -1.576   2.826  -0.755
   42   1HD2  LEU   5          1HD2      LEU   5  -4.542   2.205  -3.242
   43   2HD2  LEU   5          2HD2      LEU   5  -4.632   2.565  -1.519
   44   3HD2  LEU   5          3HD2      LEU   5  -3.690   3.604  -2.587
   45    H    LYS   6           H        LYS   6  -0.244   2.823  -4.007
   46    HA   LYS   6           HA       LYS   6   1.540   1.151  -5.585
   47   1HB   LYS   6          1HB       LYS   6   1.210   4.115  -6.032
   48   2HB   LYS   6          2HB       LYS   6   2.610   3.208  -6.583
   49   1HG   LYS   6          1HG       LYS   6   0.611   1.705  -7.610
   50   2HG   LYS   6          2HG       LYS   6  -0.121   3.311  -7.656
   51   1HD   LYS   6          1HD       LYS   6   2.398   3.800  -8.599
   52   2HD   LYS   6          2HD       LYS   6   2.071   2.191  -9.242
   53   1HE   LYS   6          1HE       LYS   6   0.087   2.951 -10.332
   54   2HE   LYS   6          2HE       LYS   6   0.174   4.514  -9.520
   55   1HZ   LYS   6          1HZ       LYS   6   2.576   4.236 -10.824
   56   2HZ   LYS   6          2HZ       LYS   6   1.425   3.671 -11.928
   57   3HZ   LYS   6          3HZ       LYS   6   1.287   5.229 -11.283
   58    H    VAL   7           H        VAL   7   3.634   1.127  -4.890
   59    HA   VAL   7           HA       VAL   7   4.224   1.472  -2.239
   60    HB   VAL   7           HB       VAL   7   6.072   1.524  -4.622
   61   1HG1  VAL   7          1HG1      VAL   7   7.081   2.557  -2.551
   62   2HG1  VAL   7          2HG1      VAL   7   6.904   0.981  -1.789
   63   3HG1  VAL   7          3HG1      VAL   7   7.931   1.159  -3.206
   64   1HG2  VAL   7          1HG2      VAL   7   4.660  -0.492  -4.238
   65   2HG2  VAL   7          2HG2      VAL   7   6.399  -0.790  -4.213
   66   3HG2  VAL   7          3HG2      VAL   7   5.496  -0.708  -2.700
   67    HA   PRO   8           HA       PRO   8   4.672   5.845  -1.727
   68   1HB   PRO   8          1HB       PRO   8   5.856   5.890   0.690
   69   2HB   PRO   8          2HB       PRO   8   4.162   5.427   0.479
   70   1HG   PRO   8          1HG       PRO   8   6.568   3.688   0.867
   71   2HG   PRO   8          2HG       PRO   8   4.944   3.524   1.560
   72   1HD   PRO   8          1HD       PRO   8   5.836   2.094  -0.603
   73   2HD   PRO   8          2HD       PRO   8   4.129   2.460  -0.298
   74    H    ASP   9           H        ASP   9   6.540   7.273  -0.569
   75    HA   ASP   9           HA       ASP   9   8.783   7.080  -2.372
   76   1HB   ASP   9          1HB       ASP   9   7.593   9.103  -0.614
   77   2HB   ASP   9          2HB       ASP   9   9.354   9.147  -0.653
   78    H    ILE  10           H        ILE  10   9.768   5.140  -1.613
   79    HA   ILE  10           HA       ILE  10  11.006   5.312   1.044
   80    HB   ILE  10           HB       ILE  10  11.669   2.833   0.333
   81   1HG1  ILE  10          1HG1      ILE  10   9.798   1.766  -0.886
   82   2HG1  ILE  10          2HG1      ILE  10   9.092   3.353  -1.170
   83   1HG2  ILE  10          1HG2      ILE  10   8.999   3.705   1.425
   84   2HG2  ILE  10          2HG2      ILE  10   9.622   2.057   1.508
   85   3HG2  ILE  10          3HG2      ILE  10  10.468   3.361   2.342
   86   1HD1  ILE  10          1HD1      ILE  10  11.080   3.984  -2.461
   87   2HD1  ILE  10          2HD1      ILE  10  11.739   2.369  -2.208
   88   3HD1  ILE  10          3HD1      ILE  10  10.254   2.580  -3.137
   89    H    GLY  11           H        GLY  11  12.381   6.993  -0.125
   90   1HA   GLY  11          1HA       GLY  11  14.880   5.687  -0.839
   91   2HA   GLY  11          2HA       GLY  11  14.664   7.388  -0.467
   92    H    GLY  12           H        GLY  12  12.263   7.037  -2.517
   93   1HA   GLY  12          1HA       GLY  12  13.492   8.350  -4.648
   94   2HA   GLY  12          2HA       GLY  12  11.942   7.528  -4.732
   95    H    HIS  13           H        HIS  13  13.543   5.007  -3.874
   96    HA   HIS  13           HA       HIS  13  14.493   4.389  -6.591
   97   1HB   HIS  13          1HB       HIS  13  15.981   2.659  -5.321
   98   2HB   HIS  13          2HB       HIS  13  16.489   4.340  -5.416
   99    HD1  HIS  13           HD1      HIS  13  17.618   4.816  -3.270
  100    HD2  HIS  13           HD2      HIS  13  14.109   2.657  -2.725
  101    HE1  HIS  13           HE1      HIS  13  17.332   4.616  -0.780
  102    HE2  HIS  13           HE2      HIS  13  15.170   3.360  -0.474
  103    H    GLU  14           H        GLU  14  14.796   1.757  -6.568
  104    HA   GLU  14           HA       GLU  14  12.092   0.775  -5.968
  105   1HB   GLU  14          1HB       GLU  14  14.145  -0.088  -8.000
  106   2HB   GLU  14          2HB       GLU  14  12.704  -1.030  -7.645
  107   1HG   GLU  14          1HG       GLU  14  11.840   0.143  -9.348
  108   2HG   GLU  14          2HG       GLU  14  11.587   1.370  -8.107
  109    H    ASN  15           H        ASN  15  12.120  -1.743  -5.778
  110    HA   ASN  15           HA       ASN  15  12.414  -3.417  -4.258
  111   1HB   ASN  15          1HB       ASN  15  14.636  -4.416  -4.297
  112   2HB   ASN  15          2HB       ASN  15  14.178  -3.887  -5.912
  113   1HD2  ASN  15          2HD2      ASN  15  16.413  -3.591  -3.356
  114   2HD2  ASN  15          1HD2      ASN  15  17.447  -2.417  -4.089
  115    H    VAL  16           H        VAL  16  11.754  -2.630  -2.305
  116    HA   VAL  16           HA       VAL  16  13.911  -1.890  -0.456
  117    HB   VAL  16           HB       VAL  16  12.484  -0.240   0.660
  118   1HG1  VAL  16          1HG1      VAL  16  14.055   0.262  -1.343
  119   2HG1  VAL  16          2HG1      VAL  16  12.554   0.595  -2.207
  120   3HG1  VAL  16          3HG1      VAL  16  12.962   1.516  -0.758
  121   1HG2  VAL  16          1HG2      VAL  16  10.414  -1.439  -0.689
  122   2HG2  VAL  16          2HG2      VAL  16  10.320   0.076   0.212
  123   3HG2  VAL  16          3HG2      VAL  16  10.595   0.101  -1.532
  124    H    ASP  17           H        ASP  17  12.659  -1.743   1.882
  125    HA   ASP  17           HA       ASP  17  11.232  -4.313   2.083
  126   1HB   ASP  17          1HB       ASP  17  13.302  -3.048   3.851
  127   2HB   ASP  17          2HB       ASP  17  12.168  -4.222   4.509
  128    H    ILE  18           H        ILE  18   9.178  -4.163   2.698
  129    HA   ILE  18           HA       ILE  18   8.041  -1.731   3.606
  130    HB   ILE  18           HB       ILE  18   6.944  -4.541   3.481
  131   1HG1  ILE  18          1HG1      ILE  18   5.948  -2.199   1.918
  132   2HG1  ILE  18          2HG1      ILE  18   7.447  -2.979   1.424
  133   1HG2  ILE  18          1HG2      ILE  18   5.498  -2.012   4.263
  134   2HG2  ILE  18          2HG2      ILE  18   4.725  -3.559   3.913
  135   3HG2  ILE  18          3HG2      ILE  18   5.809  -3.406   5.295
  136   1HD1  ILE  18          1HD1      ILE  18   5.321  -4.888   1.921
  137   2HD1  ILE  18          2HD1      ILE  18   4.907  -3.712   0.674
  138   3HD1  ILE  18          3HD1      ILE  18   6.364  -4.691   0.513
  139    H    ILE  19           H        ILE  19   6.894  -1.455   5.647
  140    HA   ILE  19           HA       ILE  19   8.158  -2.965   7.835
  141    HB   ILE  19           HB       ILE  19   9.113  -1.163   8.713
  142   1HG1  ILE  19          1HG1      ILE  19   6.510   0.362   8.465
  143   2HG1  ILE  19          2HG1      ILE  19   6.982  -0.626   9.842
  144   1HG2  ILE  19          1HG2      ILE  19   8.033   0.211   6.270
  145   2HG2  ILE  19          2HG2      ILE  19   9.120   1.002   7.412
  146   3HG2  ILE  19          3HG2      ILE  19   9.652  -0.437   6.541
  147   1HD1  ILE  19          1HD1      ILE  19   9.034   0.929   9.957
  148   2HD1  ILE  19          2HD1      ILE  19   8.069   2.005   8.947
  149   3HD1  ILE  19          3HD1      ILE  19   7.475   1.517  10.534
  150    H    ALA  20           H        ALA  20   5.260  -1.832   6.458
  151    HA   ALA  20           HA       ALA  20   3.763  -2.977   8.668
  152   1HB   ALA  20          1HB       ALA  20   4.109  -0.412   8.927
  153   2HB   ALA  20          2HB       ALA  20   2.868  -0.308   7.677
  154   3HB   ALA  20          3HB       ALA  20   2.515  -1.114   9.206
  155    H    VAL  21           H        VAL  21   1.659  -3.629   8.120
  156    HA   VAL  21           HA       VAL  21   0.852  -3.340   5.319
  157    HB   VAL  21           HB       VAL  21   2.086  -5.468   5.467
  158   1HG1  VAL  21          1HG1      VAL  21   1.569  -5.882   7.869
  159   2HG1  VAL  21          2HG1      VAL  21  -0.060  -6.354   7.386
  160   3HG1  VAL  21          3HG1      VAL  21   1.329  -7.286   6.828
  161   1HG2  VAL  21          1HG2      VAL  21   0.200  -5.208   3.902
  162   2HG2  VAL  21          2HG2      VAL  21   0.397  -6.875   4.446
  163   3HG2  VAL  21          3HG2      VAL  21  -0.885  -5.871   5.125
  164    H    GLU  22           H        GLU  22  -1.221  -2.767   5.200
  165    HA   GLU  22           HA       GLU  22  -3.058  -3.672   7.311
  166   1HB   GLU  22          1HB       GLU  22  -3.018  -0.886   6.142
  167   2HB   GLU  22          2HB       GLU  22  -4.120  -1.485   7.373
  168   1HG   GLU  22          1HG       GLU  22  -1.304  -1.797   8.069
  169   2HG   GLU  22          2HG       GLU  22  -1.802  -0.122   7.835
  170    H    VAL  23           H        VAL  23  -2.639  -4.750   4.687
  171    HA   VAL  23           HA       VAL  23  -5.319  -4.273   3.577
  172    HB   VAL  23           HB       VAL  23  -4.322  -4.692   1.288
  173   1HG1  VAL  23          1HG1      VAL  23  -4.751  -2.379   2.671
  174   2HG1  VAL  23          2HG1      VAL  23  -3.084  -2.176   2.129
  175   3HG1  VAL  23          3HG1      VAL  23  -4.364  -2.475   0.953
  176   1HG2  VAL  23          1HG2      VAL  23  -2.073  -5.373   2.589
  177   2HG2  VAL  23          2HG2      VAL  23  -2.091  -4.791   0.924
  178   3HG2  VAL  23          3HG2      VAL  23  -1.717  -3.681   2.243
  179    H    ASN  24           H        ASN  24  -6.430  -6.084   3.754
  180    HA   ASN  24           HA       ASN  24  -5.023  -8.654   3.433
  181   1HB   ASN  24          1HB       ASN  24  -6.293  -7.898   5.651
  182   2HB   ASN  24          2HB       ASN  24  -7.678  -8.527   4.765
  183   1HD2  ASN  24          2HD2      ASN  24  -8.092 -10.376   5.795
  184   2HD2  ASN  24          1HD2      ASN  24  -6.968 -11.672   5.996
  185    H    VAL  25           H        VAL  25  -6.566  -6.741   1.525
  186    HA   VAL  25           HA       VAL  25  -7.838  -6.927  -0.329
  187    HB   VAL  25           HB       VAL  25  -6.367  -9.244  -0.250
  188   1HG1  VAL  25          1HG1      VAL  25  -8.340 -10.508   0.621
  189   2HG1  VAL  25          2HG1      VAL  25  -9.180 -10.126  -0.879
  190   3HG1  VAL  25          3HG1      VAL  25  -7.715 -11.105  -0.915
  191   1HG2  VAL  25          1HG2      VAL  25  -7.946  -7.767  -2.218
  192   2HG2  VAL  25          2HG2      VAL  25  -6.274  -8.328  -2.283
  193   3HG2  VAL  25          3HG2      VAL  25  -7.592  -9.437  -2.663
  194    H    GLY  26           H        GLY  26  -9.905  -6.398  -0.325
  195   1HA   GLY  26          1HA       GLY  26 -11.884  -8.269   0.713
  196   2HA   GLY  26          2HA       GLY  26 -12.211  -6.826  -0.233
  197    H    ASP  27           H        ASP  27 -10.378  -5.293   1.626
  198    HA   ASP  27           HA       ASP  27 -12.142  -5.173   3.977
  199   1HB   ASP  27          1HB       ASP  27  -9.339  -5.231   3.765
  200   2HB   ASP  27          2HB       ASP  27  -9.747  -3.586   4.241
  201    H    THR  28           H        THR  28 -12.940  -3.186   4.703
  202    HA   THR  28           HA       THR  28 -13.590  -1.323   2.658
  203    HB   THR  28           HB       THR  28 -13.915  -0.969   5.642
  204    HG1  THR  28           HG1      THR  28 -15.434  -2.395   5.559
  205   1HG2  THR  28          1HG2      THR  28 -14.360   1.044   4.289
  206   2HG2  THR  28          2HG2      THR  28 -15.573   0.133   3.390
  207   3HG2  THR  28          3HG2      THR  28 -15.789   0.426   5.116
  208    H    ILE  29           H        ILE  29 -12.744   0.633   2.163
  209    HA   ILE  29           HA       ILE  29 -10.512   1.606   3.815
  210    HB   ILE  29           HB       ILE  29  -9.511   2.469   1.642
  211   1HG1  ILE  29          1HG1      ILE  29 -10.929   0.255   0.246
  212   2HG1  ILE  29          2HG1      ILE  29 -11.816   1.752   0.496
  213   1HG2  ILE  29          1HG2      ILE  29  -9.599  -0.344   2.572
  214   2HG2  ILE  29          2HG2      ILE  29  -8.788  -0.008   1.045
  215   3HG2  ILE  29          3HG2      ILE  29  -8.251   0.792   2.521
  216   1HD1  ILE  29          1HD1      ILE  29  -9.129   1.598  -0.839
  217   2HD1  ILE  29          2HD1      ILE  29 -10.670   1.596  -1.698
  218   3HD1  ILE  29          3HD1      ILE  29 -10.197   2.995  -0.740
  219    H    ALA  30           H        ALA  30 -10.043   3.907   3.565
  220    HA   ALA  30           HA       ALA  30 -12.357   5.487   2.672
  221   1HB   ALA  30          1HB       ALA  30 -10.866   5.912   5.261
  222   2HB   ALA  30          2HB       ALA  30 -12.191   6.900   4.646
  223   3HB   ALA  30          3HB       ALA  30 -12.482   5.222   5.107
  224    H    VAL  31           H        VAL  31 -11.576   7.982   3.035
  225    HA   VAL  31           HA       VAL  31  -9.272   8.220   1.267
  226    HB   VAL  31           HB       VAL  31 -10.985  10.495   2.243
  227   1HG1  VAL  31          1HG1      VAL  31  -9.100  10.048  -0.040
  228   2HG1  VAL  31          2HG1      VAL  31 -10.350  11.289  -0.131
  229   3HG1  VAL  31          3HG1      VAL  31  -9.130  11.357   1.142
  230   1HG2  VAL  31          1HG2      VAL  31 -11.847   8.267   0.699
  231   2HG2  VAL  31          2HG2      VAL  31 -12.744   9.722   1.130
  232   3HG2  VAL  31          3HG2      VAL  31 -11.788   9.682  -0.352
  233    H    ASP  32           H        ASP  32  -8.606   7.411   3.855
  234    HA   ASP  32           HA       ASP  32  -6.464   8.951   4.530
  235   1HB   ASP  32          1HB       ASP  32  -7.374  10.085   6.662
  236   2HB   ASP  32          2HB       ASP  32  -7.704  10.860   5.116
  237    H    ASP  33           H        ASP  33  -6.179   6.545   4.650
  238    HA   ASP  33           HA       ASP  33  -6.336   5.729   7.449
  239   1HB   ASP  33          1HB       ASP  33  -7.092   3.416   6.676
  240   2HB   ASP  33          2HB       ASP  33  -8.312   4.687   6.664
  241    H    THR  34           H        THR  34  -4.374   5.097   8.044
  242    HA   THR  34           HA       THR  34  -2.206   4.789   6.346
  243    HB   THR  34           HB       THR  34  -1.382   3.326   8.408
  244    HG1  THR  34           HG1      THR  34  -3.226   3.221   9.573
  245   1HG2  THR  34          1HG2      THR  34  -0.555   5.568   7.672
  246   2HG2  THR  34          2HG2      THR  34  -1.779   6.277   8.728
  247   3HG2  THR  34          3HG2      THR  34  -0.504   5.266   9.410
  248    H    LEU  35           H        LEU  35  -1.807   3.349   4.870
  249    HA   LEU  35           HA       LEU  35  -3.036   0.705   5.019
  250   1HB   LEU  35          1HB       LEU  35  -1.451   2.032   2.814
  251   2HB   LEU  35          2HB       LEU  35  -2.208   0.454   2.701
  252    HG   LEU  35           HG       LEU  35  -3.582   3.127   2.932
  253   1HD1  LEU  35          1HD1      LEU  35  -3.327   1.046   0.790
  254   2HD1  LEU  35          2HD1      LEU  35  -4.662   2.199   0.802
  255   3HD1  LEU  35          3HD1      LEU  35  -3.000   2.777   0.701
  256   1HD2  LEU  35          1HD2      LEU  35  -4.640   0.345   3.285
  257   2HD2  LEU  35          2HD2      LEU  35  -4.929   1.779   4.270
  258   3HD2  LEU  35          3HD2      LEU  35  -5.668   1.643   2.675
  259    H    ILE  36           H        ILE  36   0.087   2.291   5.005
  260    HA   ILE  36           HA       ILE  36   1.312   0.016   6.277
  261    HB   ILE  36           HB       ILE  36   3.036  -0.424   4.683
  262   1HG1  ILE  36          1HG1      ILE  36   3.653   1.397   3.452
  263   2HG1  ILE  36          2HG1      ILE  36   2.579   0.666   2.277
  264   1HG2  ILE  36          1HG2      ILE  36   0.902  -1.616   4.430
  265   2HG2  ILE  36          2HG2      ILE  36   0.413  -0.437   3.214
  266   3HG2  ILE  36          3HG2      ILE  36   1.804  -1.482   2.921
  267   1HD1  ILE  36          1HD1      ILE  36   0.779   2.177   3.172
  268   2HD1  ILE  36          2HD1      ILE  36   2.056   3.019   4.049
  269   3HD1  ILE  36          3HD1      ILE  36   2.096   2.945   2.293
  270    H    THR  37           H        THR  37   3.878   0.527   6.209
  271    HA   THR  37           HA       THR  37   4.360   3.374   6.556
  272    HB   THR  37           HB       THR  37   4.881   1.356   8.752
  273    HG1  THR  37           HG1      THR  37   3.192   3.627   8.791
  274   1HG2  THR  37          1HG2      THR  37   6.321   3.649   8.259
  275   2HG2  THR  37          2HG2      THR  37   5.130   4.149   9.459
  276   3HG2  THR  37          3HG2      THR  37   6.204   2.792   9.796
  277    H    LEU  38           H        LEU  38   5.163   1.853   4.537
  278    HA   LEU  38           HA       LEU  38   7.382   0.354   4.463
  279   1HB   LEU  38          1HB       LEU  38   6.186   2.350   2.696
  280   2HB   LEU  38          2HB       LEU  38   7.896   2.081   2.404
  281    HG   LEU  38           HG       LEU  38   7.131  -0.463   2.474
  282   1HD1  LEU  38          1HD1      LEU  38   4.656   1.095   1.802
  283   2HD1  LEU  38          2HD1      LEU  38   4.919  -0.544   1.206
  284   3HD1  LEU  38          3HD1      LEU  38   4.847  -0.238   2.941
  285   1HD2  LEU  38          1HD2      LEU  38   7.558   1.526   0.436
  286   2HD2  LEU  38          2HD2      LEU  38   8.020  -0.179   0.460
  287   3HD2  LEU  38          3HD2      LEU  38   6.417   0.293  -0.101
  288    H    GLU  39           H        GLU  39   9.648   0.894   3.825
  289    HA   GLU  39           HA       GLU  39  10.820   3.376   4.463
  290   1HB   GLU  39          1HB       GLU  39  10.292   2.921   6.742
  291   2HB   GLU  39          2HB       GLU  39  10.872   1.269   6.615
  292   1HG   GLU  39          1HG       GLU  39  13.153   2.062   6.376
  293   2HG   GLU  39          2HG       GLU  39  12.591   3.733   6.436
  294    H    THR  40           H        THR  40  13.219   3.241   4.550
  295    HA   THR  40           HA       THR  40  14.200   0.876   3.086
  296    HB   THR  40           HB       THR  40  15.567   2.237   1.737
  297    HG1  THR  40           HG1      THR  40  15.030   4.294   3.600
  298   1HG2  THR  40          1HG2      THR  40  12.821   3.214   2.042
  299   2HG2  THR  40          2HG2      THR  40  13.943   4.313   1.242
  300   3HG2  THR  40          3HG2      THR  40  13.698   2.687   0.607
  301    H    ASP  41           H        ASP  41  16.920   1.765   3.105
  302    HA   ASP  41           HA       ASP  41  17.758   0.731   5.602
  303   1HB   ASP  41          1HB       ASP  41  18.979   0.768   3.295
  304   2HB   ASP  41          2HB       ASP  41  19.565   2.341   3.825
  305    H    LYS  42           H        LYS  42  17.007   3.912   4.497
  306    HA   LYS  42           HA       LYS  42  17.312   4.989   7.131
  307   1HB   LYS  42          1HB       LYS  42  19.651   5.064   6.143
  308   2HB   LYS  42          2HB       LYS  42  19.029   6.233   4.985
  309   1HG   LYS  42          1HG       LYS  42  19.878   7.635   6.567
  310   2HG   LYS  42          2HG       LYS  42  18.223   7.471   7.155
  311   1HD   LYS  42          1HD       LYS  42  19.890   5.360   8.191
  312   2HD   LYS  42          2HD       LYS  42  20.584   6.941   8.557
  313   1HE   LYS  42          1HE       LYS  42  18.815   7.569   9.868
  314   2HE   LYS  42          2HE       LYS  42  17.670   6.545   9.000
  315   1HZ   LYS  42          1HZ       LYS  42  19.793   5.242  10.540
  316   2HZ   LYS  42          2HZ       LYS  42  18.506   5.932  11.393
  317   3HZ   LYS  42          3HZ       LYS  42  18.207   4.732  10.241
  318    H    ALA  43           H        ALA  43  15.024   4.820   5.872
  319    HA   ALA  43           HA       ALA  43  14.068   7.444   5.698
  320   1HB   ALA  43          1HB       ALA  43  14.572   6.117   3.041
  321   2HB   ALA  43          2HB       ALA  43  15.181   7.672   3.607
  322   3HB   ALA  43          3HB       ALA  43  13.463   7.471   3.259
  323    H    THR  44           H        THR  44  12.150   7.096   6.601
  324    HA   THR  44           HA       THR  44  10.666   4.662   5.933
  325    HB   THR  44           HB       THR  44   9.561   4.860   7.971
  326    HG1  THR  44           HG1      THR  44   9.574   6.893   9.135
  327   1HG2  THR  44          1HG2      THR  44  12.322   5.153   8.060
  328   2HG2  THR  44          2HG2      THR  44  11.695   6.326   9.221
  329   3HG2  THR  44          3HG2      THR  44  11.260   4.622   9.365
  330    H    MET  45           H        MET  45   8.624   4.670   5.091
  331    HA   MET  45           HA       MET  45   7.327   7.230   4.549
  332   1HB   MET  45          1HB       MET  45   8.836   5.960   2.594
  333   2HB   MET  45          2HB       MET  45   7.185   5.474   2.229
  334   1HG   MET  45          1HG       MET  45   8.268   8.271   2.434
  335   2HG   MET  45          2HG       MET  45   7.673   7.450   0.995
  336   1HE   MET  45          1HE       MET  45   7.202  10.145   1.990
  337   2HE   MET  45          2HE       MET  45   5.503  10.412   1.602
  338   3HE   MET  45          3HE       MET  45   6.032  10.395   3.284
  339    H    ASP  46           H        ASP  46   5.182   7.136   4.797
  340    HA   ASP  46           HA       ASP  46   3.919   4.472   4.881
  341   1HB   ASP  46          1HB       ASP  46   2.421   5.307   6.621
  342   2HB   ASP  46          2HB       ASP  46   4.100   5.486   7.124
  343    H    VAL  47           H        VAL  47   1.418   4.736   4.704
  344    HA   VAL  47           HA       VAL  47   0.683   6.864   2.848
  345    HB   VAL  47           HB       VAL  47   0.352   3.932   2.189
  346   1HG1  VAL  47          1HG1      VAL  47  -1.340   6.073   1.505
  347   2HG1  VAL  47          2HG1      VAL  47  -0.390   5.711   0.064
  348   3HG1  VAL  47          3HG1      VAL  47  -1.338   4.441   0.838
  349   1HG2  VAL  47          1HG2      VAL  47   1.922   6.138   0.862
  350   2HG2  VAL  47          2HG2      VAL  47   2.577   4.733   1.704
  351   3HG2  VAL  47          3HG2      VAL  47   1.690   4.522   0.195
  352    HA   PRO  48           HA       PRO  48  -2.952   6.280   5.444
  353   1HB   PRO  48          1HB       PRO  48  -3.854   8.771   5.322
  354   2HB   PRO  48          2HB       PRO  48  -2.361   8.404   6.197
  355   1HG   PRO  48          1HG       PRO  48  -2.728   9.646   3.513
  356   2HG   PRO  48          2HG       PRO  48  -1.511   9.990   4.752
  357   1HD   PRO  48          1HD       PRO  48  -1.179   8.348   2.486
  358   2HD   PRO  48          2HD       PRO  48  -0.085   8.454   3.879
  359    H    ALA  49           H        ALA  49  -2.938   5.497   2.612
  360    HA   ALA  49           HA       ALA  49  -4.396   5.055   0.919
  361   1HB   ALA  49          1HB       ALA  49  -6.894   5.764   2.078
  362   2HB   ALA  49          2HB       ALA  49  -5.896   5.012   3.322
  363   3HB   ALA  49          3HB       ALA  49  -6.217   4.157   1.814
  364    H    GLU  50           H        GLU  50  -5.933   6.039  -0.611
  365    HA   GLU  50           HA       GLU  50  -6.207   8.933  -0.360
  366   1HB   GLU  50          1HB       GLU  50  -4.624   7.482  -2.402
  367   2HB   GLU  50          2HB       GLU  50  -5.582   8.849  -2.954
  368   1HG   GLU  50          1HG       GLU  50  -4.280  10.367  -1.906
  369   2HG   GLU  50          2HG       GLU  50  -3.917   9.291  -0.557
  370    H    VAL  51           H        VAL  51  -8.135   6.872  -0.085
  371    HA   VAL  51           HA       VAL  51 -10.306   7.847  -1.413
  372    HB   VAL  51           HB       VAL  51  -9.537   7.413  -3.573
  373   1HG1  VAL  51          1HG1      VAL  51  -8.232   5.055  -2.331
  374   2HG1  VAL  51          2HG1      VAL  51  -8.606   4.988  -4.055
  375   3HG1  VAL  51          3HG1      VAL  51  -7.572   6.274  -3.421
  376   1HG2  VAL  51          1HG2      VAL  51 -11.785   6.297  -3.014
  377   2HG2  VAL  51          2HG2      VAL  51 -10.986   5.838  -4.516
  378   3HG2  VAL  51          3HG2      VAL  51 -10.899   4.776  -3.112
  379    H    ALA  52           H        ALA  52 -12.204   6.560  -1.140
  380    HA   ALA  52           HA       ALA  52 -11.954   4.598   0.982
  381   1HB   ALA  52          1HB       ALA  52 -13.739   6.487   0.732
  382   2HB   ALA  52          2HB       ALA  52 -14.548   5.319  -0.316
  383   3HB   ALA  52          3HB       ALA  52 -14.214   4.912   1.369
  384    H    GLY  53           H        GLY  53 -14.139   2.948   0.459
  385   1HA   GLY  53          1HA       GLY  53 -13.405   1.655  -2.085
  386   2HA   GLY  53          2HA       GLY  53 -14.983   1.529  -1.334
  387    H    VAL  54           H        VAL  54 -13.417  -0.635  -2.232
  388    HA   VAL  54           HA       VAL  54 -12.517  -1.935   0.246
  389    HB   VAL  54           HB       VAL  54 -14.444  -3.146  -1.746
  390   1HG1  VAL  54          1HG1      VAL  54 -12.710  -4.306   0.300
  391   2HG1  VAL  54          2HG1      VAL  54 -14.403  -4.776   0.459
  392   3HG1  VAL  54          3HG1      VAL  54 -13.543  -5.075  -1.052
  393   1HG2  VAL  54          1HG2      VAL  54 -14.802  -2.053   1.029
  394   2HG2  VAL  54          2HG2      VAL  54 -15.713  -1.680  -0.434
  395   3HG2  VAL  54          3HG2      VAL  54 -15.910  -3.246   0.353
  396    H    VAL  55           H        VAL  55 -10.719  -3.180  -0.016
  397    HA   VAL  55           HA       VAL  55  -9.316  -3.081  -2.476
  398    HB   VAL  55           HB       VAL  55  -8.733  -4.828  -0.086
  399   1HG1  VAL  55          1HG1      VAL  55  -7.667  -5.545  -2.237
  400   2HG1  VAL  55          2HG1      VAL  55  -6.885  -3.965  -2.315
  401   3HG1  VAL  55          3HG1      VAL  55  -6.516  -5.067  -0.988
  402   1HG2  VAL  55          1HG2      VAL  55  -8.814  -2.299   0.247
  403   2HG2  VAL  55          2HG2      VAL  55  -7.329  -3.123   0.720
  404   3HG2  VAL  55          3HG2      VAL  55  -7.397  -2.232  -0.801
  405    H    LYS  56           H        LYS  56  -8.827  -4.642  -3.937
  406    HA   LYS  56           HA       LYS  56 -10.488  -7.077  -3.873
  407   1HB   LYS  56          1HB       LYS  56  -9.556  -6.442  -6.525
  408   2HB   LYS  56          2HB       LYS  56 -11.206  -6.667  -5.960
  409   1HG   LYS  56          1HG       LYS  56  -9.808  -4.068  -5.494
  410   2HG   LYS  56          2HG       LYS  56 -10.513  -4.433  -7.068
  411   1HD   LYS  56          1HD       LYS  56 -12.043  -4.613  -4.479
  412   2HD   LYS  56          2HD       LYS  56 -12.010  -3.168  -5.492
  413   1HE   LYS  56          1HE       LYS  56 -13.505  -4.022  -6.906
  414   2HE   LYS  56          2HE       LYS  56 -12.614  -5.538  -7.035
  415   1HZ   LYS  56          1HZ       LYS  56 -14.168  -5.043  -4.601
  416   2HZ   LYS  56          2HZ       LYS  56 -15.005  -5.460  -6.012
  417   3HZ   LYS  56          3HZ       LYS  56 -13.829  -6.503  -5.384
  418    H    GLU  57           H        GLU  57  -7.479  -5.596  -4.957
  419    HA   GLU  57           HA       GLU  57  -6.296  -8.259  -5.039
  420   1HB   GLU  57          1HB       GLU  57  -5.947  -5.859  -6.712
  421   2HB   GLU  57          2HB       GLU  57  -4.471  -6.739  -6.336
  422   1HG   GLU  57          1HG       GLU  57  -6.933  -7.954  -7.567
  423   2HG   GLU  57          2HG       GLU  57  -5.507  -7.426  -8.461
  424    H    VAL  58           H        VAL  58  -3.800  -8.111  -4.711
  425    HA   VAL  58           HA       VAL  58  -2.723  -6.168  -2.959
  426    HB   VAL  58           HB       VAL  58  -4.292  -7.198  -1.354
  427   1HG1  VAL  58          1HG1      VAL  58  -3.412  -9.599  -2.581
  428   2HG1  VAL  58          2HG1      VAL  58  -2.980  -9.670  -0.874
  429   3HG1  VAL  58          3HG1      VAL  58  -4.655  -9.387  -1.348
  430   1HG2  VAL  58          1HG2      VAL  58  -1.338  -7.434  -0.985
  431   2HG2  VAL  58          2HG2      VAL  58  -2.475  -6.302  -0.253
  432   3HG2  VAL  58          3HG2      VAL  58  -2.423  -7.977   0.295
  433    H    LYS  59           H        LYS  59  -0.541  -6.383  -2.861
  434    HA   LYS  59           HA       LYS  59   0.719  -8.948  -3.329
  435   1HB   LYS  59          1HB       LYS  59   1.042  -6.649  -5.266
  436   2HB   LYS  59          2HB       LYS  59   2.064  -8.082  -5.241
  437   1HG   LYS  59          1HG       LYS  59   0.590  -8.700  -6.854
  438   2HG   LYS  59          2HG       LYS  59  -0.266  -9.310  -5.435
  439   1HD   LYS  59          1HD       LYS  59  -1.984  -8.156  -6.359
  440   2HD   LYS  59          2HD       LYS  59  -1.238  -6.816  -5.487
  441   1HE   LYS  59          1HE       LYS  59  -0.993  -7.508  -8.402
  442   2HE   LYS  59          2HE       LYS  59  -1.651  -6.039  -7.682
  443   1HZ   LYS  59          1HZ       LYS  59   0.566  -5.484  -6.887
  444   2HZ   LYS  59          2HZ       LYS  59   1.193  -6.891  -7.586
  445   3HZ   LYS  59          3HZ       LYS  59   0.562  -5.668  -8.569
  446    H    VAL  60           H        VAL  60   0.808  -7.612  -1.048
  447    HA   VAL  60           HA       VAL  60   3.596  -6.870  -0.833
  448    HB   VAL  60           HB       VAL  60   3.108  -4.753   0.355
  449   1HG1  VAL  60          1HG1      VAL  60   3.583  -5.002  -2.169
  450   2HG1  VAL  60          2HG1      VAL  60   1.886  -4.564  -2.368
  451   3HG1  VAL  60          3HG1      VAL  60   2.996  -3.455  -1.562
  452   1HG2  VAL  60          1HG2      VAL  60   0.758  -5.366   0.944
  453   2HG2  VAL  60          2HG2      VAL  60   0.944  -3.742   0.284
  454   3HG2  VAL  60          3HG2      VAL  60   0.312  -5.039  -0.733
  455    H    LYS  61           H        LYS  61   4.233  -6.545   1.464
  456    HA   LYS  61           HA       LYS  61   2.502  -7.271   3.582
  457   1HB   LYS  61          1HB       LYS  61   2.703  -9.482   2.484
  458   2HB   LYS  61          2HB       LYS  61   4.446  -9.410   2.697
  459   1HG   LYS  61          1HG       LYS  61   4.150 -10.449   4.631
  460   2HG   LYS  61          2HG       LYS  61   3.426  -8.958   5.237
  461   1HD   LYS  61          1HD       LYS  61   1.332  -9.795   5.159
  462   2HD   LYS  61          2HD       LYS  61   1.630 -10.676   3.659
  463   1HE   LYS  61          1HE       LYS  61   3.196 -12.055   5.390
  464   2HE   LYS  61          2HE       LYS  61   1.885 -11.549   6.456
  465   1HZ   LYS  61          1HZ       LYS  61   0.619 -12.430   4.206
  466   2HZ   LYS  61          2HZ       LYS  61   1.888 -13.532   4.397
  467   3HZ   LYS  61          3HZ       LYS  61   0.783 -13.288   5.655
  468    H    VAL  62           H        VAL  62   3.456  -7.007   5.587
  469    HA   VAL  62           HA       VAL  62   5.621  -5.275   5.779
  470    HB   VAL  62           HB       VAL  62   3.997  -5.497   7.576
  471   1HG1  VAL  62          1HG1      VAL  62   4.114  -8.143   7.237
  472   2HG1  VAL  62          2HG1      VAL  62   5.198  -7.992   8.619
  473   3HG1  VAL  62          3HG1      VAL  62   3.542  -7.395   8.728
  474   1HG2  VAL  62          1HG2      VAL  62   6.646  -5.045   7.882
  475   2HG2  VAL  62          2HG2      VAL  62   5.461  -4.894   9.179
  476   3HG2  VAL  62          3HG2      VAL  62   6.408  -6.374   9.017
  477    H    GLY  63           H        GLY  63   7.323  -6.138   4.513
  478   1HA   GLY  63          1HA       GLY  63   8.740  -8.397   5.788
  479   2HA   GLY  63          2HA       GLY  63   9.574  -6.965   5.204
  480    H    ASP  64           H        ASP  64   8.951  -6.480   2.783
  481    HA   ASP  64           HA       ASP  64   9.737  -8.846   1.312
  482   1HB   ASP  64          1HB       ASP  64   7.913  -8.854  -0.237
  483   2HB   ASP  64          2HB       ASP  64   7.217  -8.887   1.380
  484    H    LYS  65           H        LYS  65   9.781  -8.173  -1.174
  485    HA   LYS  65           HA       LYS  65  11.351  -5.712  -1.248
  486   1HB   LYS  65          1HB       LYS  65  11.323  -8.232  -2.762
  487   2HB   LYS  65          2HB       LYS  65  11.580  -6.797  -3.745
  488   1HG   LYS  65          1HG       LYS  65  13.711  -6.813  -3.157
  489   2HG   LYS  65          2HG       LYS  65  13.230  -6.523  -1.483
  490   1HD   LYS  65          1HD       LYS  65  13.564  -8.675  -0.880
  491   2HD   LYS  65          2HD       LYS  65  12.975  -9.306  -2.418
  492   1HE   LYS  65          1HE       LYS  65  15.245  -8.155  -3.254
  493   2HE   LYS  65          2HE       LYS  65  15.710  -8.536  -1.596
  494   1HZ   LYS  65          1HZ       LYS  65  14.526 -10.818  -2.434
  495   2HZ   LYS  65          2HZ       LYS  65  15.310 -10.292  -3.838
  496   3HZ   LYS  65          3HZ       LYS  65  16.194 -10.538  -2.417
  497    H    ILE  66           H        ILE  66  10.305  -3.906  -1.758
  498    HA   ILE  66           HA       ILE  66   8.268  -4.043  -3.872
  499    HB   ILE  66           HB       ILE  66   7.800  -3.412  -1.192
  500   1HG1  ILE  66          1HG1      ILE  66   5.511  -2.820  -2.084
  501   2HG1  ILE  66          2HG1      ILE  66   6.184  -3.022  -3.701
  502   1HG2  ILE  66          1HG2      ILE  66   7.761  -0.891  -2.829
  503   2HG2  ILE  66          2HG2      ILE  66   6.832  -1.105  -1.350
  504   3HG2  ILE  66          3HG2      ILE  66   8.590  -1.185  -1.302
  505   1HD1  ILE  66          1HD1      ILE  66   6.971  -5.326  -2.556
  506   2HD1  ILE  66          2HD1      ILE  66   5.465  -5.029  -1.685
  507   3HD1  ILE  66          3HD1      ILE  66   5.461  -5.128  -3.447
  508    H    SER  67           H        SER  67   7.841  -1.888  -4.903
  509    HA   SER  67           HA       SER  67  10.086  -0.038  -4.849
  510   1HB   SER  67          1HB       SER  67  10.789  -0.327  -7.033
  511   2HB   SER  67          2HB       SER  67  10.375  -1.987  -6.607
  512    HG   SER  67           HG       SER  67   9.379  -1.595  -8.525
  513    H    GLU  68           H        GLU  68   9.547   2.026  -5.436
  514    HA   GLU  68           HA       GLU  68   7.042   3.019  -5.141
  515   1HB   GLU  68          1HB       GLU  68   8.987   4.200  -7.119
  516   2HB   GLU  68          2HB       GLU  68   7.784   5.046  -6.156
  517   1HG   GLU  68          1HG       GLU  68   9.074   4.274  -4.120
  518   2HG   GLU  68          2HG       GLU  68  10.349   3.792  -5.238
  519    H    GLY  69           H        GLY  69   5.232   2.366  -6.135
  520   1HA   GLY  69          1HA       GLY  69   5.009   2.706  -9.001
  521   2HA   GLY  69          2HA       GLY  69   3.706   2.321  -7.890
  522    H    GLY  70           H        GLY  70   3.822   0.047  -6.934
  523   1HA   GLY  70          1HA       GLY  70   4.818  -2.203  -7.369
  524   2HA   GLY  70          2HA       GLY  70   4.699  -1.801  -9.074
  525    H    LEU  71           H        LEU  71   2.013  -0.447  -8.048
  526    HA   LEU  71           HA       LEU  71  -0.192  -0.981  -8.066
  527   1HB   LEU  71          1HB       LEU  71   0.370  -1.965 -10.256
  528   2HB   LEU  71          2HB       LEU  71   0.754  -3.483  -9.467
  529    HG   LEU  71           HG       LEU  71  -1.505  -3.907  -8.925
  530   1HD1  LEU  71          1HD1      LEU  71  -1.774  -0.990  -9.206
  531   2HD1  LEU  71          2HD1      LEU  71  -3.146  -1.937  -9.785
  532   3HD1  LEU  71          3HD1      LEU  71  -2.597  -2.109  -8.118
  533   1HD2  LEU  71          1HD2      LEU  71  -0.780  -4.043 -11.382
  534   2HD2  LEU  71          2HD2      LEU  71  -2.507  -4.090 -11.025
  535   3HD2  LEU  71          3HD2      LEU  71  -1.768  -2.600 -11.612
  536    H    ILE  72           H        ILE  72   1.015  -1.386  -5.747
  537    HA   ILE  72           HA       ILE  72   1.094  -3.808  -4.516
  538    HB   ILE  72           HB       ILE  72   0.190  -1.151  -3.443
  539   1HG1  ILE  72          1HG1      ILE  72   2.791  -2.680  -3.328
  540   2HG1  ILE  72          2HG1      ILE  72   2.464  -1.244  -4.289
  541   1HG2  ILE  72          1HG2      ILE  72   0.067  -3.742  -2.169
  542   2HG2  ILE  72          2HG2      ILE  72   1.187  -2.672  -1.324
  543   3HG2  ILE  72          3HG2      ILE  72  -0.486  -2.176  -1.579
  544   1HD1  ILE  72          1HD1      ILE  72   1.858  -0.338  -1.833
  545   2HD1  ILE  72          2HD1      ILE  72   3.116  -1.514  -1.450
  546   3HD1  ILE  72          3HD1      ILE  72   3.446  -0.204  -2.585
  547    H    VAL  73           H        VAL  73  -1.695  -1.789  -3.680
  548    HA   VAL  73           HA       VAL  73  -3.393  -4.173  -4.033
  549    HB   VAL  73           HB       VAL  73  -4.781  -3.405  -2.186
  550   1HG1  VAL  73          1HG1      VAL  73  -1.943  -4.070  -1.883
  551   2HG1  VAL  73          2HG1      VAL  73  -2.683  -3.351  -0.453
  552   3HG1  VAL  73          3HG1      VAL  73  -3.369  -4.814  -1.160
  553   1HG2  VAL  73          1HG2      VAL  73  -2.798  -1.142  -2.003
  554   2HG2  VAL  73          2HG2      VAL  73  -4.523  -1.027  -2.349
  555   3HG2  VAL  73          3HG2      VAL  73  -3.976  -1.534  -0.750
  556    H    VAL  74           H        VAL  74  -5.654  -3.772  -4.480
  557    HA   VAL  74           HA       VAL  74  -6.198  -1.196  -5.814
  558    HB   VAL  74           HB       VAL  74  -6.896  -3.941  -6.890
  559   1HG1  VAL  74          1HG1      VAL  74  -8.319  -1.631  -7.247
  560   2HG1  VAL  74          2HG1      VAL  74  -7.245  -1.636  -8.645
  561   3HG1  VAL  74          3HG1      VAL  74  -8.311  -3.008  -8.348
  562   1HG2  VAL  74          1HG2      VAL  74  -4.802  -1.935  -7.624
  563   2HG2  VAL  74          2HG2      VAL  74  -4.650  -3.677  -7.399
  564   3HG2  VAL  74          3HG2      VAL  74  -5.450  -3.039  -8.835
  565    H    VAL  75           H        VAL  75  -8.295  -0.429  -5.541
  566    HA   VAL  75           HA       VAL  75 -10.051  -2.106  -3.890
  567    HB   VAL  75           HB       VAL  75 -10.890  -0.002  -2.882
  568   1HG1  VAL  75          1HG1      VAL  75  -8.435  -1.350  -2.398
  569   2HG1  VAL  75          2HG1      VAL  75  -8.217   0.361  -2.036
  570   3HG1  VAL  75          3HG1      VAL  75  -9.501  -0.552  -1.242
  571   1HG2  VAL  75          1HG2      VAL  75  -9.601   1.214  -4.968
  572   2HG2  VAL  75          2HG2      VAL  75 -10.229   2.029  -3.536
  573   3HG2  VAL  75          3HG2      VAL  75  -8.534   1.547  -3.604
  574    H    GLU  76           H        GLU  76 -12.327  -0.911  -3.813
  575    HA   GLU  76           HA       GLU  76 -13.253  -0.893  -6.584
  576   1HB   GLU  76          1HB       GLU  76 -14.280  -1.921  -4.134
  577   2HB   GLU  76          2HB       GLU  76 -15.395  -0.682  -4.696
  578   1HG   GLU  76          1HG       GLU  76 -14.862  -2.120  -6.979
  579   2HG   GLU  76          2HG       GLU  76 -14.900  -3.354  -5.720
  580    H    ALA  77           H        ALA  77 -12.890   1.155  -3.816
  581    HA   ALA  77           HA       ALA  77 -13.143   3.377  -3.509
  582   1HB   ALA  77          1HB       ALA  77 -13.427   4.773  -5.637
  583   2HB   ALA  77          2HB       ALA  77 -13.181   3.244  -6.482
  584   3HB   ALA  77          3HB       ALA  77 -11.932   3.865  -5.401
  585    H    GLU  78           H        GLU  78 -14.880   3.792  -2.353
  586    HA   GLU  78           HA       GLU  78 -17.053   4.092  -1.747
  587   1HB   GLU  78          1HB       GLU  78 -16.356   5.909  -3.705
  588   2HB   GLU  78          2HB       GLU  78 -17.894   5.277  -4.278
  589   1HG   GLU  78          1HG       GLU  78 -18.956   5.882  -2.196
  590   2HG   GLU  78          2HG       GLU  78 -17.412   6.417  -1.536
  591    H    GLY  79           H        GLY  79 -16.554   1.555  -2.835
  592   1HA   GLY  79          1HA       GLY  79 -19.144   0.590  -3.222
  593   2HA   GLY  79          2HA       GLY  79 -17.670  -0.300  -3.576
  594    H    THR  80           H        THR  80 -20.319   1.467  -4.869
  595    HA   THR  80           HA       THR  80 -19.369   0.844  -7.582
  596    HB   THR  80           HB       THR  80 -21.435  -0.295  -6.951
  597    HG1  THR  80           HG1      THR  80 -22.093   1.793  -8.740
  598   1HG2  THR  80          1HG2      THR  80 -22.102   1.924  -5.529
  599   2HG2  THR  80          2HG2      THR  80 -23.121   2.087  -6.960
  600   3HG2  THR  80          3HG2      THR  80 -23.212   0.627  -5.974
  601    H    ALA  81           H        ALA  81 -20.402   3.386  -5.474
  602    HA   ALA  81           HA       ALA  81 -20.894   5.319  -7.535
  603   1HB   ALA  81          1HB       ALA  81 -21.979   6.195  -5.799
  604   2HB   ALA  81          2HB       ALA  81 -20.409   6.728  -5.200
  605   3HB   ALA  81          3HB       ALA  81 -21.089   5.198  -4.647

  No H/Q in entry =         605
  Start of MODEL   12
    1    H1   ALA   1           H1       ALA   1 -12.376   4.613 -11.527
    2    H2   ALA   1           H2       ALA   1 -13.864   5.192 -12.157
    3    H3   ALA   1           H3       ALA   1 -13.164   5.938 -10.779
    4    HA   ALA   1           HA       ALA   1 -14.816   4.658  -9.918
    5   1HB   ALA   1          1HB       ALA   1 -13.973   2.646 -11.975
    6   2HB   ALA   1          2HB       ALA   1 -14.970   2.195 -10.592
    7   3HB   ALA   1          3HB       ALA   1 -15.551   3.398 -11.744
    8    H    LEU   2           H        LEU   2 -12.491   2.119 -10.655
    9    HA   LEU   2           HA       LEU   2 -11.916   1.806  -7.840
   10   1HB   LEU   2          1HB       LEU   2 -10.884   0.318 -10.257
   11   2HB   LEU   2          2HB       LEU   2 -10.557  -0.125  -8.592
   12    HG   LEU   2           HG       LEU   2 -13.326   0.006  -8.699
   13   1HD1  LEU   2          1HD1      LEU   2 -12.282  -0.493 -11.350
   14   2HD1  LEU   2          2HD1      LEU   2 -13.250  -1.845 -10.762
   15   3HD1  LEU   2          3HD1      LEU   2 -13.944  -0.225 -10.822
   16   1HD2  LEU   2          1HD2      LEU   2 -11.923  -1.631  -7.506
   17   2HD2  LEU   2          2HD2      LEU   2 -13.215  -2.398  -8.430
   18   3HD2  LEU   2          3HD2      LEU   2 -11.562  -2.417  -9.043
   19    H    VAL   3           H        VAL   3  -9.549   1.354  -7.252
   20    HA   VAL   3           HA       VAL   3  -7.745   3.248  -8.587
   21    HB   VAL   3           HB       VAL   3  -8.456   3.178  -5.664
   22   1HG1  VAL   3          1HG1      VAL   3  -6.024   2.992  -5.736
   23   2HG1  VAL   3          2HG1      VAL   3  -5.943   4.387  -6.816
   24   3HG1  VAL   3          3HG1      VAL   3  -6.521   4.585  -5.161
   25   1HG2  VAL   3          1HG2      VAL   3  -8.275   5.319  -7.764
   26   2HG2  VAL   3          2HG2      VAL   3  -9.703   4.763  -6.889
   27   3HG2  VAL   3          3HG2      VAL   3  -8.448   5.672  -6.046
   28    H    GLU   4           H        GLU   4  -5.534   2.784  -8.380
   29    HA   GLU   4           HA       GLU   4  -4.917   0.083  -7.379
   30   1HB   GLU   4          1HB       GLU   4  -3.501   1.467  -9.657
   31   2HB   GLU   4          2HB       GLU   4  -3.355  -0.214  -9.166
   32   1HG   GLU   4          1HG       GLU   4  -5.008  -0.802 -10.510
   33   2HG   GLU   4          2HG       GLU   4  -6.089   0.375  -9.766
   34    H    LEU   5           H        LEU   5  -3.942   0.446  -5.464
   35    HA   LEU   5           HA       LEU   5  -2.358   2.741  -4.915
   36   1HB   LEU   5          1HB       LEU   5  -3.566   0.800  -3.394
   37   2HB   LEU   5          2HB       LEU   5  -1.864   0.410  -3.216
   38    HG   LEU   5           HG       LEU   5  -1.936   3.151  -2.828
   39   1HD1  LEU   5          1HD1      LEU   5  -4.557   2.277  -2.485
   40   2HD1  LEU   5          2HD1      LEU   5  -3.905   2.416  -0.853
   41   3HD1  LEU   5          3HD1      LEU   5  -3.864   3.805  -1.940
   42   1HD2  LEU   5          1HD2      LEU   5  -0.593   1.483  -1.622
   43   2HD2  LEU   5          2HD2      LEU   5  -1.408   2.600  -0.528
   44   3HD2  LEU   5          3HD2      LEU   5  -2.037   0.968  -0.750
   45    H    LYS   6           H        LYS   6  -0.098   2.691  -4.224
   46    HA   LYS   6           HA       LYS   6   1.566   0.571  -5.281
   47   1HB   LYS   6          1HB       LYS   6   1.561   3.357  -6.432
   48   2HB   LYS   6          2HB       LYS   6   2.940   2.276  -6.584
   49   1HG   LYS   6          1HG       LYS   6   1.919   1.756  -8.527
   50   2HG   LYS   6          2HG       LYS   6   1.026   0.646  -7.487
   51   1HD   LYS   6          1HD       LYS   6  -0.816   1.631  -8.289
   52   2HD   LYS   6          2HD       LYS   6  -0.392   2.990  -7.245
   53   1HE   LYS   6          1HE       LYS   6  -0.598   4.077  -9.245
   54   2HE   LYS   6          2HE       LYS   6   1.114   3.660  -9.299
   55   1HZ   LYS   6          1HZ       LYS   6  -0.023   1.489 -10.394
   56   2HZ   LYS   6          2HZ       LYS   6  -1.067   2.706 -10.933
   57   3HZ   LYS   6          3HZ       LYS   6   0.585   2.797 -11.279
   58    H    VAL   7           H        VAL   7   3.823   0.843  -4.721
   59    HA   VAL   7           HA       VAL   7   4.272   1.450  -2.079
   60    HB   VAL   7           HB       VAL   7   6.271   1.501  -4.343
   61   1HG1  VAL   7          1HG1      VAL   7   6.875   2.542  -2.012
   62   2HG1  VAL   7          2HG1      VAL   7   7.002   0.851  -1.530
   63   3HG1  VAL   7          3HG1      VAL   7   8.006   1.472  -2.837
   64   1HG2  VAL   7          1HG2      VAL   7   4.909  -0.589  -4.019
   65   2HG2  VAL   7          2HG2      VAL   7   6.655  -0.790  -3.904
   66   3HG2  VAL   7          3HG2      VAL   7   5.676  -0.746  -2.439
   67    HA   PRO   8           HA       PRO   8   4.381   5.881  -1.953
   68   1HB   PRO   8          1HB       PRO   8   5.589   6.233   0.431
   69   2HB   PRO   8          2HB       PRO   8   3.924   5.652   0.290
   70   1HG   PRO   8          1HG       PRO   8   6.439   4.088   0.773
   71   2HG   PRO   8          2HG       PRO   8   4.849   3.915   1.541
   72   1HD   PRO   8          1HD       PRO   8   5.706   2.304  -0.475
   73   2HD   PRO   8          2HD       PRO   8   3.996   2.690  -0.213
   74    H    ASP   9           H        ASP   9   6.153   7.527  -0.909
   75    HA   ASP   9           HA       ASP   9   8.449   7.269  -2.673
   76   1HB   ASP   9          1HB       ASP   9   6.962   9.441  -1.398
   77   2HB   ASP   9          2HB       ASP   9   8.707   9.669  -1.332
   78    H    ILE  10           H        ILE  10   9.631   5.659  -1.568
   79    HA   ILE  10           HA       ILE  10  10.633   6.370   1.097
   80    HB   ILE  10           HB       ILE  10  11.698   3.971   0.823
   81   1HG1  ILE  10          1HG1      ILE  10  10.227   2.462  -0.449
   82   2HG1  ILE  10          2HG1      ILE  10   9.299   3.843  -1.018
   83   1HG2  ILE  10          1HG2      ILE  10   9.747   4.945   2.317
   84   2HG2  ILE  10          2HG2      ILE  10   8.768   3.885   1.301
   85   3HG2  ILE  10          3HG2      ILE  10  10.094   3.217   2.257
   86   1HD1  ILE  10          1HD1      ILE  10  12.235   3.667  -1.538
   87   2HD1  ILE  10          2HD1      ILE  10  11.079   2.809  -2.557
   88   3HD1  ILE  10          3HD1      ILE  10  10.996   4.564  -2.415
   89    H    GLY  11           H        GLY  11  11.687   8.015  -0.712
   90   1HA   GLY  11          1HA       GLY  11  14.424   6.967  -1.079
   91   2HA   GLY  11          2HA       GLY  11  14.058   8.637  -0.672
   92    H    GLY  12           H        GLY  12  13.783   6.194  -3.209
   93   1HA   GLY  12          1HA       GLY  12  14.252   8.254  -5.204
   94   2HA   GLY  12          2HA       GLY  12  12.694   7.448  -5.310
   95    H    HIS  13           H        HIS  13  13.474   4.853  -4.587
   96    HA   HIS  13           HA       HIS  13  14.780   4.050  -7.059
   97   1HB   HIS  13          1HB       HIS  13  16.145   2.361  -5.565
   98   2HB   HIS  13          2HB       HIS  13  16.752   3.985  -5.864
   99    HD1  HIS  13           HD1      HIS  13  15.569   1.740  -3.174
  100    HD2  HIS  13           HD2      HIS  13  16.554   5.750  -3.631
  101    HE1  HIS  13           HE1      HIS  13  15.808   2.643  -0.840
  102    HE2  HIS  13           HE2      HIS  13  16.321   5.092  -1.142
  103    H    GLU  14           H        GLU  14  14.607   1.688  -7.426
  104    HA   GLU  14           HA       GLU  14  12.109   0.691  -6.246
  105   1HB   GLU  14          1HB       GLU  14  13.491  -0.106  -8.818
  106   2HB   GLU  14          2HB       GLU  14  11.969  -0.766  -8.236
  107   1HG   GLU  14          1HG       GLU  14  10.784   1.050  -8.851
  108   2HG   GLU  14          2HG       GLU  14  12.098   2.168  -8.486
  109    H    ASN  15           H        ASN  15  13.005  -0.159  -4.381
  110    HA   ASN  15           HA       ASN  15  13.518  -2.800  -4.188
  111   1HB   ASN  15          1HB       ASN  15  16.066  -2.802  -3.783
  112   2HB   ASN  15          2HB       ASN  15  15.510  -2.794  -5.455
  113   1HD2  ASN  15          2HD2      ASN  15  16.279  -1.287  -6.759
  114   2HD2  ASN  15          1HD2      ASN  15  17.133   0.132  -6.267
  115    H    VAL  16           H        VAL  16  12.188  -1.920  -2.437
  116    HA   VAL  16           HA       VAL  16  13.862  -1.246  -0.118
  117    HB   VAL  16           HB       VAL  16  12.240   0.427   0.632
  118   1HG1  VAL  16          1HG1      VAL  16  14.210   0.867  -1.046
  119   2HG1  VAL  16          2HG1      VAL  16  12.896   1.250  -2.161
  120   3HG1  VAL  16          3HG1      VAL  16  13.065   2.149  -0.651
  121   1HG2  VAL  16          1HG2      VAL  16  10.681  -0.712  -1.514
  122   2HG2  VAL  16          2HG2      VAL  16  10.168   0.322  -0.180
  123   3HG2  VAL  16          3HG2      VAL  16  10.788   1.041  -1.667
  124    H    ASP  17           H        ASP  17  13.333  -2.316   1.690
  125    HA   ASP  17           HA       ASP  17  11.317  -4.347   1.568
  126   1HB   ASP  17          1HB       ASP  17  13.671  -4.101   2.922
  127   2HB   ASP  17          2HB       ASP  17  12.507  -3.744   4.195
  128    H    ILE  18           H        ILE  18   9.341  -4.412   2.523
  129    HA   ILE  18           HA       ILE  18   8.153  -1.947   3.312
  130    HB   ILE  18           HB       ILE  18   7.132  -4.784   3.304
  131   1HG1  ILE  18          1HG1      ILE  18   5.888  -2.627   1.712
  132   2HG1  ILE  18          2HG1      ILE  18   7.519  -3.090   1.238
  133   1HG2  ILE  18          1HG2      ILE  18   5.662  -2.275   4.100
  134   2HG2  ILE  18          2HG2      ILE  18   4.885  -3.816   3.738
  135   3HG2  ILE  18          3HG2      ILE  18   5.987  -3.684   5.108
  136   1HD1  ILE  18          1HD1      ILE  18   5.880  -5.412   1.674
  137   2HD1  ILE  18          2HD1      ILE  18   5.138  -4.319   0.506
  138   3HD1  ILE  18          3HD1      ILE  18   6.776  -4.917   0.238
  139    H    ILE  19           H        ILE  19   7.003  -1.649   5.371
  140    HA   ILE  19           HA       ILE  19   8.407  -3.021   7.570
  141    HB   ILE  19           HB       ILE  19   9.296  -1.158   8.388
  142   1HG1  ILE  19          1HG1      ILE  19   6.660   0.293   8.050
  143   2HG1  ILE  19          2HG1      ILE  19   7.153  -0.600   9.482
  144   1HG2  ILE  19          1HG2      ILE  19   8.208   0.027   5.850
  145   2HG2  ILE  19          2HG2      ILE  19   9.235   0.938   6.956
  146   3HG2  ILE  19          3HG2      ILE  19   9.846  -0.533   6.198
  147   1HD1  ILE  19          1HD1      ILE  19   9.160   0.999   9.529
  148   2HD1  ILE  19          2HD1      ILE  19   8.202   1.990   8.429
  149   3HD1  ILE  19          3HD1      ILE  19   7.582   1.603  10.033
  150    H    ALA  20           H        ALA  20   5.416  -1.881   6.317
  151    HA   ALA  20           HA       ALA  20   4.059  -2.999   8.657
  152   1HB   ALA  20          1HB       ALA  20   4.246  -0.441   8.718
  153   2HB   ALA  20          2HB       ALA  20   3.064  -0.463   7.409
  154   3HB   ALA  20          3HB       ALA  20   2.656  -1.163   8.977
  155    H    VAL  21           H        VAL  21   1.827  -3.585   8.253
  156    HA   VAL  21           HA       VAL  21   0.999  -3.709   5.465
  157    HB   VAL  21           HB       VAL  21   1.313  -6.186   7.171
  158   1HG1  VAL  21          1HG1      VAL  21  -0.443  -5.613   4.929
  159   2HG1  VAL  21          2HG1      VAL  21   0.629  -6.977   4.610
  160   3HG1  VAL  21          3HG1      VAL  21  -0.424  -6.995   6.025
  161   1HG2  VAL  21          1HG2      VAL  21   2.718  -5.174   4.719
  162   2HG2  VAL  21          2HG2      VAL  21   3.412  -5.707   6.251
  163   3HG2  VAL  21          3HG2      VAL  21   2.703  -6.884   5.146
  164    H    GLU  22           H        GLU  22  -1.109  -3.290   5.292
  165    HA   GLU  22           HA       GLU  22  -2.961  -4.127   7.368
  166   1HB   GLU  22          1HB       GLU  22  -2.872  -1.226   6.548
  167   2HB   GLU  22          2HB       GLU  22  -3.858  -1.954   7.806
  168   1HG   GLU  22          1HG       GLU  22  -0.855  -1.839   7.891
  169   2HG   GLU  22          2HG       GLU  22  -1.910  -0.631   8.620
  170    H    VAL  23           H        VAL  23  -3.536  -5.473   5.505
  171    HA   VAL  23           HA       VAL  23  -5.714  -4.299   4.045
  172    HB   VAL  23           HB       VAL  23  -4.789  -5.122   1.806
  173   1HG1  VAL  23          1HG1      VAL  23  -5.021  -2.709   2.695
  174   2HG1  VAL  23          2HG1      VAL  23  -3.266  -2.768   2.861
  175   3HG1  VAL  23          3HG1      VAL  23  -4.010  -2.997   1.278
  176   1HG2  VAL  23          1HG2      VAL  23  -2.216  -4.932   3.370
  177   2HG2  VAL  23          2HG2      VAL  23  -2.891  -6.376   2.615
  178   3HG2  VAL  23          3HG2      VAL  23  -2.322  -5.041   1.613
  179    H    ASN  24           H        ASN  24  -7.187  -5.800   3.371
  180    HA   ASN  24           HA       ASN  24  -6.467  -8.639   3.557
  181   1HB   ASN  24          1HB       ASN  24  -8.400  -7.155   5.218
  182   2HB   ASN  24          2HB       ASN  24  -8.972  -8.692   4.578
  183   1HD2  ASN  24          2HD2      ASN  24  -7.182 -10.460   4.764
  184   2HD2  ASN  24          1HD2      ASN  24  -6.465 -10.591   6.331
  185    H    VAL  25           H        VAL  25  -7.232  -6.550   1.445
  186    HA   VAL  25           HA       VAL  25  -8.280  -6.560  -0.568
  187    HB   VAL  25           HB       VAL  25  -8.895  -9.417   0.178
  188   1HG1  VAL  25          1HG1      VAL  25  -9.508  -7.848  -2.293
  189   2HG1  VAL  25          2HG1      VAL  25  -9.164  -9.575  -2.403
  190   3HG1  VAL  25          3HG1      VAL  25 -10.515  -9.005  -1.423
  191   1HG2  VAL  25          1HG2      VAL  25  -6.717  -8.089  -1.395
  192   2HG2  VAL  25          2HG2      VAL  25  -6.584  -9.238  -0.063
  193   3HG2  VAL  25          3HG2      VAL  25  -7.129  -9.785  -1.648
  194    H    GLY  26           H        GLY  26 -10.543  -8.800   0.972
  195   1HA   GLY  26          1HA       GLY  26 -12.832  -8.646   1.184
  196   2HA   GLY  26          2HA       GLY  26 -12.767  -7.149   0.263
  197    H    ASP  27           H        ASP  27 -11.463  -5.383   1.634
  198    HA   ASP  27           HA       ASP  27 -12.822  -5.304   4.227
  199   1HB   ASP  27          1HB       ASP  27 -10.185  -5.644   4.117
  200   2HB   ASP  27          2HB       ASP  27 -10.215  -3.893   3.931
  201    H    THR  28           H        THR  28 -12.974  -3.015   5.089
  202    HA   THR  28           HA       THR  28 -13.902  -1.295   2.931
  203    HB   THR  28           HB       THR  28 -14.135  -0.934   5.925
  204    HG1  THR  28           HG1      THR  28 -15.738  -2.238   4.029
  205   1HG2  THR  28          1HG2      THR  28 -14.686   0.879   3.852
  206   2HG2  THR  28          2HG2      THR  28 -16.238   0.275   4.433
  207   3HG2  THR  28          3HG2      THR  28 -15.101   1.014   5.561
  208    H    ILE  29           H        ILE  29 -12.784   0.379   2.178
  209    HA   ILE  29           HA       ILE  29 -10.579   1.439   3.822
  210    HB   ILE  29           HB       ILE  29  -9.411   1.995   1.714
  211   1HG1  ILE  29          1HG1      ILE  29 -10.803   0.124   0.013
  212   2HG1  ILE  29          2HG1      ILE  29 -11.908   1.380   0.563
  213   1HG2  ILE  29          1HG2      ILE  29  -9.606  -0.455   3.004
  214   2HG2  ILE  29          2HG2      ILE  29  -9.691  -0.850   1.289
  215   3HG2  ILE  29          3HG2      ILE  29  -8.321   0.067   1.915
  216   1HD1  ILE  29          1HD1      ILE  29  -9.272   1.847  -0.807
  217   2HD1  ILE  29          2HD1      ILE  29 -10.863   1.952  -1.561
  218   3HD1  ILE  29          3HD1      ILE  29 -10.410   3.090  -0.291
  219    H    ALA  30           H        ALA  30 -10.286   3.639   3.910
  220    HA   ALA  30           HA       ALA  30 -12.295   5.293   2.531
  221   1HB   ALA  30          1HB       ALA  30 -13.126   6.012   4.459
  222   2HB   ALA  30          2HB       ALA  30 -11.523   6.495   5.010
  223   3HB   ALA  30          3HB       ALA  30 -12.098   4.853   5.301
  224    H    VAL  31           H        VAL  31 -11.516   7.770   3.221
  225    HA   VAL  31           HA       VAL  31  -8.982   8.020   1.813
  226    HB   VAL  31           HB       VAL  31 -10.741  10.279   2.757
  227   1HG1  VAL  31          1HG1      VAL  31  -8.494   9.985   0.807
  228   2HG1  VAL  31          2HG1      VAL  31  -9.701  11.252   0.583
  229   3HG1  VAL  31          3HG1      VAL  31  -8.740  11.201   2.061
  230   1HG2  VAL  31          1HG2      VAL  31 -10.921   8.747   0.163
  231   2HG2  VAL  31          2HG2      VAL  31 -12.121   8.755   1.455
  232   3HG2  VAL  31          3HG2      VAL  31 -11.798  10.229   0.541
  233    H    ASP  32           H        ASP  32  -8.608   6.956   4.331
  234    HA   ASP  32           HA       ASP  32  -6.573   8.446   5.406
  235   1HB   ASP  32          1HB       ASP  32  -7.773   9.200   7.583
  236   2HB   ASP  32          2HB       ASP  32  -7.915  10.206   6.145
  237    H    ASP  33           H        ASP  33  -6.151   6.076   5.236
  238    HA   ASP  33           HA       ASP  33  -6.412   4.888   7.866
  239   1HB   ASP  33          1HB       ASP  33  -7.188   2.689   6.826
  240   2HB   ASP  33          2HB       ASP  33  -8.398   3.962   6.965
  241    H    THR  34           H        THR  34  -4.227   4.842   8.142
  242    HA   THR  34           HA       THR  34  -2.241   4.421   6.335
  243    HB   THR  34           HB       THR  34  -1.198   3.096   8.421
  244    HG1  THR  34           HG1      THR  34  -2.123   3.762  10.286
  245   1HG2  THR  34          1HG2      THR  34  -0.361   5.193   7.444
  246   2HG2  THR  34          2HG2      THR  34  -1.569   6.073   8.383
  247   3HG2  THR  34          3HG2      THR  34  -0.301   5.166   9.208
  248    H    LEU  35           H        LEU  35  -1.891   2.923   4.900
  249    HA   LEU  35           HA       LEU  35  -2.935   0.234   5.287
  250   1HB   LEU  35          1HB       LEU  35  -1.698   1.634   2.921
  251   2HB   LEU  35          2HB       LEU  35  -2.114  -0.070   2.909
  252    HG   LEU  35           HG       LEU  35  -3.994   2.273   3.137
  253   1HD1  LEU  35          1HD1      LEU  35  -2.986   0.897   0.949
  254   2HD1  LEU  35          2HD1      LEU  35  -4.597   0.222   1.197
  255   3HD1  LEU  35          3HD1      LEU  35  -4.393   1.960   0.976
  256   1HD2  LEU  35          1HD2      LEU  35  -4.350  -0.572   3.892
  257   2HD2  LEU  35          2HD2      LEU  35  -5.100   0.880   4.553
  258   3HD2  LEU  35          3HD2      LEU  35  -5.668   0.214   3.023
  259    H    ILE  36           H        ILE  36   0.128   1.922   4.786
  260    HA   ILE  36           HA       ILE  36   1.523  -0.195   6.169
  261    HB   ILE  36           HB       ILE  36   3.270  -0.431   4.370
  262   1HG1  ILE  36          1HG1      ILE  36   2.890   0.162   2.159
  263   2HG1  ILE  36          2HG1      ILE  36   1.156   0.338   2.387
  264   1HG2  ILE  36          1HG2      ILE  36   1.146  -1.906   4.943
  265   2HG2  ILE  36          2HG2      ILE  36   0.768  -1.535   3.263
  266   3HG2  ILE  36          3HG2      ILE  36   2.285  -2.336   3.671
  267   1HD1  ILE  36          1HD1      ILE  36   3.213   2.232   3.494
  268   2HD1  ILE  36          2HD1      ILE  36   2.361   2.461   1.967
  269   3HD1  ILE  36          3HD1      ILE  36   1.463   2.443   3.483
  270    H    THR  37           H        THR  37   4.056   0.365   5.928
  271    HA   THR  37           HA       THR  37   4.462   3.250   6.005
  272    HB   THR  37           HB       THR  37   5.121   1.429   8.327
  273    HG1  THR  37           HG1      THR  37   3.224   3.473   7.929
  274   1HG2  THR  37          1HG2      THR  37   6.578   3.616   7.595
  275   2HG2  THR  37          2HG2      THR  37   5.408   4.298   8.723
  276   3HG2  THR  37          3HG2      THR  37   6.449   2.967   9.229
  277    H    LEU  38           H        LEU  38   5.371   1.981   3.976
  278    HA   LEU  38           HA       LEU  38   7.562   0.432   3.845
  279   1HB   LEU  38          1HB       LEU  38   6.769   2.824   2.245
  280   2HB   LEU  38          2HB       LEU  38   8.311   2.057   1.922
  281    HG   LEU  38           HG       LEU  38   6.859   1.101   0.372
  282   1HD1  LEU  38          1HD1      LEU  38   8.168  -0.504   1.909
  283   2HD1  LEU  38          2HD1      LEU  38   6.575  -0.935   2.529
  284   3HD1  LEU  38          3HD1      LEU  38   6.945  -1.155   0.819
  285   1HD2  LEU  38          1HD2      LEU  38   4.828   1.988   1.742
  286   2HD2  LEU  38          2HD2      LEU  38   4.630   0.605   0.665
  287   3HD2  LEU  38          3HD2      LEU  38   4.807   0.352   2.402
  288    H    GLU  39           H        GLU  39   9.853   0.892   3.436
  289    HA   GLU  39           HA       GLU  39  11.107   3.267   4.257
  290   1HB   GLU  39          1HB       GLU  39  10.289   2.602   6.475
  291   2HB   GLU  39          2HB       GLU  39  11.123   1.062   6.321
  292   1HG   GLU  39          1HG       GLU  39  13.265   2.317   6.147
  293   2HG   GLU  39          2HG       GLU  39  12.369   3.794   6.500
  294    H    THR  40           H        THR  40  13.426   3.111   4.228
  295    HA   THR  40           HA       THR  40  14.414   0.619   3.009
  296    HB   THR  40           HB       THR  40  14.636   1.887   1.145
  297    HG1  THR  40           HG1      THR  40  16.646   3.046   1.115
  298   1HG2  THR  40          1HG2      THR  40  14.644   4.324   2.892
  299   2HG2  THR  40          2HG2      THR  40  14.959   4.378   1.157
  300   3HG2  THR  40          3HG2      THR  40  13.404   3.795   1.755
  301    H    ASP  41           H        ASP  41  16.170   3.560   3.816
  302    HA   ASP  41           HA       ASP  41  17.404   2.265   6.119
  303   1HB   ASP  41          1HB       ASP  41  19.680   3.084   5.180
  304   2HB   ASP  41          2HB       ASP  41  18.999   1.583   4.557
  305    H    LYS  42           H        LYS  42  17.189   5.155   4.080
  306    HA   LYS  42           HA       LYS  42  17.460   6.781   6.521
  307   1HB   LYS  42          1HB       LYS  42  19.456   6.932   5.032
  308   2HB   LYS  42          2HB       LYS  42  18.415   7.561   3.763
  309   1HG   LYS  42          1HG       LYS  42  18.877   9.584   4.543
  310   2HG   LYS  42          2HG       LYS  42  17.874   9.185   5.938
  311   1HD   LYS  42          1HD       LYS  42  19.731   8.561   7.231
  312   2HD   LYS  42          2HD       LYS  42  20.782   8.442   5.818
  313   1HE   LYS  42          1HE       LYS  42  19.742  11.082   5.924
  314   2HE   LYS  42          2HE       LYS  42  20.346  10.671   7.529
  315   1HZ   LYS  42          1HZ       LYS  42  22.070   9.943   5.311
  316   2HZ   LYS  42          2HZ       LYS  42  21.882  11.604   5.570
  317   3HZ   LYS  42          3HZ       LYS  42  22.462  10.615   6.814
  318    H    ALA  43           H        ALA  43  14.996   5.874   5.635
  319    HA   ALA  43           HA       ALA  43  13.476   8.193   5.557
  320   1HB   ALA  43          1HB       ALA  43  14.614   7.698   3.050
  321   2HB   ALA  43          2HB       ALA  43  13.340   8.852   3.442
  322   3HB   ALA  43          3HB       ALA  43  12.921   7.224   2.910
  323    H    THR  44           H        THR  44  11.393   7.734   6.005
  324    HA   THR  44           HA       THR  44  10.440   4.992   5.519
  325    HB   THR  44           HB       THR  44   9.624   4.747   7.689
  326    HG1  THR  44           HG1      THR  44   9.769   7.557   7.819
  327   1HG2  THR  44          1HG2      THR  44  12.303   5.494   7.473
  328   2HG2  THR  44          2HG2      THR  44  11.681   6.342   8.888
  329   3HG2  THR  44          3HG2      THR  44  11.538   4.587   8.778
  330    H    MET  45           H        MET  45   8.648   4.999   4.333
  331    HA   MET  45           HA       MET  45   6.973   7.419   4.344
  332   1HB   MET  45          1HB       MET  45   7.995   5.757   2.235
  333   2HB   MET  45          2HB       MET  45   6.239   5.764   2.184
  334   1HG   MET  45          1HG       MET  45   8.053   8.164   2.119
  335   2HG   MET  45          2HG       MET  45   7.111   7.511   0.780
  336   1HE   MET  45          1HE       MET  45   7.616  10.099   2.778
  337   2HE   MET  45          2HE       MET  45   6.095  10.987   2.883
  338   3HE   MET  45          3HE       MET  45   6.581   9.911   4.194
  339    H    ASP  46           H        ASP  46   4.676   7.183   4.183
  340    HA   ASP  46           HA       ASP  46   3.574   4.587   4.951
  341   1HB   ASP  46          1HB       ASP  46   2.171   5.719   6.706
  342   2HB   ASP  46          2HB       ASP  46   3.887   5.635   7.090
  343    H    VAL  47           H        VAL  47   1.443   4.255   4.302
  344    HA   VAL  47           HA       VAL  47   0.333   6.400   2.610
  345    HB   VAL  47           HB       VAL  47   0.068   3.414   2.245
  346   1HG1  VAL  47          1HG1      VAL  47  -1.686   5.477   1.446
  347   2HG1  VAL  47          2HG1      VAL  47  -0.828   4.939  -0.001
  348   3HG1  VAL  47          3HG1      VAL  47  -1.722   3.777   0.980
  349   1HG2  VAL  47          1HG2      VAL  47   2.260   4.391   1.610
  350   2HG2  VAL  47          2HG2      VAL  47   1.373   3.712   0.245
  351   3HG2  VAL  47          3HG2      VAL  47   1.418   5.459   0.486
  352    HA   PRO  48           HA       PRO  48  -3.106   5.894   5.468
  353   1HB   PRO  48          1HB       PRO  48  -4.196   8.295   5.113
  354   2HB   PRO  48          2HB       PRO  48  -2.649   8.120   5.951
  355   1HG   PRO  48          1HG       PRO  48  -3.206   9.053   3.180
  356   2HG   PRO  48          2HG       PRO  48  -1.948   9.575   4.311
  357   1HD   PRO  48          1HD       PRO  48  -1.652   7.729   2.198
  358   2HD   PRO  48          2HD       PRO  48  -0.487   8.045   3.499
  359    H    ALA  49           H        ALA  49  -3.152   4.952   2.604
  360    HA   ALA  49           HA       ALA  49  -4.636   4.338   0.990
  361   1HB   ALA  49          1HB       ALA  49  -7.087   4.387   2.401
  362   2HB   ALA  49          2HB       ALA  49  -5.828   3.896   3.533
  363   3HB   ALA  49          3HB       ALA  49  -6.060   3.001   2.033
  364    H    GLU  50           H        GLU  50  -4.820   5.885  -0.519
  365    HA   GLU  50           HA       GLU  50  -6.516   8.206   0.002
  366   1HB   GLU  50          1HB       GLU  50  -4.452   7.565  -2.085
  367   2HB   GLU  50          2HB       GLU  50  -5.594   8.881  -2.324
  368   1HG   GLU  50          1HG       GLU  50  -4.094  10.152  -1.289
  369   2HG   GLU  50          2HG       GLU  50  -4.645   9.375   0.194
  370    H    VAL  51           H        VAL  51  -8.307   6.549  -0.005
  371    HA   VAL  51           HA       VAL  51  -9.645   6.682  -2.560
  372    HB   VAL  51           HB       VAL  51 -10.120   4.047  -2.124
  373   1HG1  VAL  51          1HG1      VAL  51  -8.531   5.643  -3.968
  374   2HG1  VAL  51          2HG1      VAL  51  -7.990   3.968  -3.860
  375   3HG1  VAL  51          3HG1      VAL  51  -9.662   4.329  -4.292
  376   1HG2  VAL  51          1HG2      VAL  51  -7.268   4.566  -1.303
  377   2HG2  VAL  51          2HG2      VAL  51  -8.514   3.691  -0.413
  378   3HG2  VAL  51          3HG2      VAL  51  -7.832   2.999  -1.885
  379    H    ALA  52           H        ALA  52 -11.736   5.065  -2.223
  380    HA   ALA  52           HA       ALA  52 -12.796   5.209   0.455
  381   1HB   ALA  52          1HB       ALA  52 -13.796   7.041  -1.698
  382   2HB   ALA  52          2HB       ALA  52 -14.749   6.613  -0.279
  383   3HB   ALA  52          3HB       ALA  52 -13.216   7.462  -0.084
  384    H    GLY  53           H        GLY  53 -12.596   2.920  -0.583
  385   1HA   GLY  53          1HA       GLY  53 -14.133   1.848  -2.518
  386   2HA   GLY  53          2HA       GLY  53 -15.304   2.143  -1.245
  387    H    VAL  54           H        VAL  54 -13.408  -0.159  -2.564
  388    HA   VAL  54           HA       VAL  54 -12.746  -1.531  -0.070
  389    HB   VAL  54           HB       VAL  54 -14.579  -2.725  -2.157
  390   1HG1  VAL  54          1HG1      VAL  54 -12.879  -3.925  -0.155
  391   2HG1  VAL  54          2HG1      VAL  54 -14.575  -4.310   0.140
  392   3HG1  VAL  54          3HG1      VAL  54 -13.842  -4.692  -1.418
  393   1HG2  VAL  54          1HG2      VAL  54 -15.113  -1.867   0.688
  394   2HG2  VAL  54          2HG2      VAL  54 -15.759  -1.126  -0.777
  395   3HG2  VAL  54          3HG2      VAL  54 -16.242  -2.762  -0.330
  396    H    VAL  55           H        VAL  55 -11.051  -2.964  -0.266
  397    HA   VAL  55           HA       VAL  55  -9.528  -2.825  -2.699
  398    HB   VAL  55           HB       VAL  55  -8.971  -4.422  -0.199
  399   1HG1  VAL  55          1HG1      VAL  55  -7.216  -3.801  -2.580
  400   2HG1  VAL  55          2HG1      VAL  55  -6.656  -4.534  -1.077
  401   3HG1  VAL  55          3HG1      VAL  55  -7.811  -5.392  -2.099
  402   1HG2  VAL  55          1HG2      VAL  55  -9.025  -1.763  -0.299
  403   2HG2  VAL  55          2HG2      VAL  55  -7.830  -2.648   0.650
  404   3HG2  VAL  55          3HG2      VAL  55  -7.403  -2.019  -0.942
  405    H    LYS  56           H        LYS  56  -8.768  -4.605  -3.892
  406    HA   LYS  56           HA       LYS  56 -10.476  -7.002  -3.791
  407   1HB   LYS  56          1HB       LYS  56  -9.468  -6.509  -6.453
  408   2HB   LYS  56          2HB       LYS  56 -11.129  -6.754  -5.929
  409   1HG   LYS  56          1HG       LYS  56  -9.802  -4.093  -5.600
  410   2HG   LYS  56          2HG       LYS  56 -10.504  -4.572  -7.145
  411   1HD   LYS  56          1HD       LYS  56 -12.073  -4.743  -4.593
  412   2HD   LYS  56          2HD       LYS  56 -11.972  -3.239  -5.510
  413   1HE   LYS  56          1HE       LYS  56 -13.412  -3.969  -7.051
  414   2HE   LYS  56          2HE       LYS  56 -12.594  -5.525  -7.190
  415   1HZ   LYS  56          1HZ       LYS  56 -13.937  -5.429  -4.730
  416   2HZ   LYS  56          2HZ       LYS  56 -15.025  -4.965  -5.939
  417   3HZ   LYS  56          3HZ       LYS  56 -14.226  -6.453  -6.044
  418    H    GLU  57           H        GLU  57  -7.469  -5.553  -4.932
  419    HA   GLU  57           HA       GLU  57  -6.245  -8.189  -4.816
  420   1HB   GLU  57          1HB       GLU  57  -5.859  -5.848  -6.556
  421   2HB   GLU  57          2HB       GLU  57  -4.380  -6.664  -6.066
  422   1HG   GLU  57          1HG       GLU  57  -5.038  -8.684  -7.072
  423   2HG   GLU  57          2HG       GLU  57  -6.706  -8.143  -7.247
  424    H    VAL  58           H        VAL  58  -3.917  -8.211  -4.157
  425    HA   VAL  58           HA       VAL  58  -2.959  -6.112  -2.442
  426    HB   VAL  58           HB       VAL  58  -4.610  -7.227  -0.964
  427   1HG1  VAL  58          1HG1      VAL  58  -3.685  -9.549  -2.143
  428   2HG1  VAL  58          2HG1      VAL  58  -3.036  -9.620  -0.504
  429   3HG1  VAL  58          3HG1      VAL  58  -4.773  -9.439  -0.757
  430   1HG2  VAL  58          1HG2      VAL  58  -2.468  -6.174  -0.143
  431   2HG2  VAL  58          2HG2      VAL  58  -3.204  -7.356   0.939
  432   3HG2  VAL  58          3HG2      VAL  58  -1.805  -7.806  -0.038
  433    H    LYS  59           H        LYS  59  -0.830  -6.115  -2.666
  434    HA   LYS  59           HA       LYS  59   0.612  -8.649  -2.824
  435   1HB   LYS  59          1HB       LYS  59   1.013  -6.432  -4.831
  436   2HB   LYS  59          2HB       LYS  59   1.861  -7.973  -4.786
  437   1HG   LYS  59          1HG       LYS  59   0.323  -8.497  -6.357
  438   2HG   LYS  59          2HG       LYS  59  -0.639  -8.887  -4.927
  439   1HD   LYS  59          1HD       LYS  59  -2.043  -7.156  -5.244
  440   2HD   LYS  59          2HD       LYS  59  -0.753  -6.077  -5.773
  441   1HE   LYS  59          1HE       LYS  59  -1.962  -8.268  -7.455
  442   2HE   LYS  59          2HE       LYS  59  -2.421  -6.568  -7.542
  443   1HZ   LYS  59          1HZ       LYS  59   0.116  -6.246  -7.922
  444   2HZ   LYS  59          2HZ       LYS  59   0.068  -7.866  -8.405
  445   3HZ   LYS  59          3HZ       LYS  59  -0.877  -6.715  -9.207
  446    H    VAL  60           H        VAL  60   1.153  -7.939  -0.662
  447    HA   VAL  60           HA       VAL  60   3.679  -6.696  -0.538
  448    HB   VAL  60           HB       VAL  60   2.879  -4.557  -0.702
  449   1HG1  VAL  60          1HG1      VAL  60   0.340  -5.480   0.627
  450   2HG1  VAL  60          2HG1      VAL  60   0.670  -3.805   0.185
  451   3HG1  VAL  60          3HG1      VAL  60   0.574  -5.047  -1.067
  452   1HG2  VAL  60          1HG2      VAL  60   3.793  -5.072   1.702
  453   2HG2  VAL  60          2HG2      VAL  60   3.102  -3.495   1.321
  454   3HG2  VAL  60          3HG2      VAL  60   2.140  -4.694   2.184
  455    H    LYS  61           H        LYS  61   4.634  -6.892   1.491
  456    HA   LYS  61           HA       LYS  61   3.034  -8.099   3.627
  457   1HB   LYS  61          1HB       LYS  61   4.425  -9.733   2.017
  458   2HB   LYS  61          2HB       LYS  61   5.702  -9.307   3.147
  459   1HG   LYS  61          1HG       LYS  61   4.936 -10.976   4.399
  460   2HG   LYS  61          2HG       LYS  61   3.599  -9.899   4.808
  461   1HD   LYS  61          1HD       LYS  61   2.123 -11.029   3.520
  462   2HD   LYS  61          2HD       LYS  61   3.321 -11.383   2.274
  463   1HE   LYS  61          1HE       LYS  61   3.039 -13.484   3.098
  464   2HE   LYS  61          2HE       LYS  61   4.301 -12.928   4.196
  465   1HZ   LYS  61          1HZ       LYS  61   1.470 -12.537   4.900
  466   2HZ   LYS  61          2HZ       LYS  61   2.192 -14.047   5.143
  467   3HZ   LYS  61          3HZ       LYS  61   2.814 -12.677   5.917
  468    H    VAL  62           H        VAL  62   4.346  -8.278   5.687
  469    HA   VAL  62           HA       VAL  62   5.617  -5.729   6.144
  470    HB   VAL  62           HB       VAL  62   4.029  -6.735   7.779
  471   1HG1  VAL  62          1HG1      VAL  62   5.845  -8.949   7.562
  472   2HG1  VAL  62          2HG1      VAL  62   5.716  -8.425   9.241
  473   3HG1  VAL  62          3HG1      VAL  62   4.265  -8.869   8.341
  474   1HG2  VAL  62          1HG2      VAL  62   6.714  -5.713   8.403
  475   2HG2  VAL  62          2HG2      VAL  62   5.128  -5.134   8.915
  476   3HG2  VAL  62          3HG2      VAL  62   5.877  -6.500   9.741
  477    H    GLY  63           H        GLY  63   7.275  -6.807   4.432
  478   1HA   GLY  63          1HA       GLY  63   9.365  -8.267   5.867
  479   2HA   GLY  63          2HA       GLY  63   9.769  -6.668   5.263
  480    H    ASP  64           H        ASP  64   8.988  -6.422   2.828
  481    HA   ASP  64           HA       ASP  64  10.400  -8.523   1.406
  482   1HB   ASP  64          1HB       ASP  64   8.675  -9.028  -0.151
  483   2HB   ASP  64          2HB       ASP  64   7.945  -9.150   1.446
  484    H    LYS  65           H        LYS  65  11.182  -7.890  -0.636
  485    HA   LYS  65           HA       LYS  65  11.905  -5.174  -0.838
  486   1HB   LYS  65          1HB       LYS  65  12.118  -7.488  -2.756
  487   2HB   LYS  65          2HB       LYS  65  12.710  -5.882  -3.157
  488   1HG   LYS  65          1HG       LYS  65  13.860  -6.305  -0.723
  489   2HG   LYS  65          2HG       LYS  65  13.854  -7.928  -1.414
  490   1HD   LYS  65          1HD       LYS  65  14.661  -6.211  -3.481
  491   2HD   LYS  65          2HD       LYS  65  15.539  -5.685  -2.042
  492   1HE   LYS  65          1HE       LYS  65  16.250  -8.032  -1.679
  493   2HE   LYS  65          2HE       LYS  65  15.459  -8.472  -3.191
  494   1HZ   LYS  65          1HZ       LYS  65  17.169  -6.288  -3.648
  495   2HZ   LYS  65          2HZ       LYS  65  18.039  -7.487  -2.833
  496   3HZ   LYS  65          3HZ       LYS  65  17.260  -7.850  -4.291
  497    H    ILE  66           H        ILE  66  10.811  -3.505  -1.602
  498    HA   ILE  66           HA       ILE  66   8.796  -3.961  -3.677
  499    HB   ILE  66           HB       ILE  66   8.130  -3.394  -1.068
  500   1HG1  ILE  66          1HG1      ILE  66   5.881  -3.057  -1.939
  501   2HG1  ILE  66          2HG1      ILE  66   6.536  -2.736  -3.545
  502   1HG2  ILE  66          1HG2      ILE  66   8.061  -0.791  -2.579
  503   2HG2  ILE  66          2HG2      ILE  66   7.090  -1.119  -1.145
  504   3HG2  ILE  66          3HG2      ILE  66   8.849  -1.131  -1.040
  505   1HD1  ILE  66          1HD1      ILE  66   7.612  -5.189  -2.747
  506   2HD1  ILE  66          2HD1      ILE  66   5.900  -5.235  -2.312
  507   3HD1  ILE  66          3HD1      ILE  66   6.380  -4.896  -3.976
  508    H    SER  67           H        SER  67   8.096  -1.809  -4.692
  509    HA   SER  67           HA       SER  67  10.149   0.240  -4.686
  510   1HB   SER  67          1HB       SER  67  10.260   0.051  -7.263
  511   2HB   SER  67          2HB       SER  67  11.194  -1.095  -6.302
  512    HG   SER  67           HG       SER  67   9.340  -1.627  -8.108
  513    H    GLU  68           H        GLU  68   9.512   2.184  -5.665
  514    HA   GLU  68           HA       GLU  68   6.890   2.965  -5.370
  515   1HB   GLU  68          1HB       GLU  68   9.289   4.074  -6.649
  516   2HB   GLU  68          2HB       GLU  68   7.777   4.683  -7.308
  517   1HG   GLU  68          1HG       GLU  68   7.254   4.913  -4.689
  518   2HG   GLU  68          2HG       GLU  68   9.006   5.110  -4.668
  519    H    GLY  69           H        GLY  69   5.320   1.736  -6.303
  520   1HA   GLY  69          1HA       GLY  69   5.246   1.787  -9.250
  521   2HA   GLY  69          2HA       GLY  69   3.831   1.751  -8.212
  522    H    GLY  70           H        GLY  70   4.133  -0.282  -6.549
  523   1HA   GLY  70          1HA       GLY  70   4.838  -2.607  -6.485
  524   2HA   GLY  70          2HA       GLY  70   4.823  -2.603  -8.242
  525    H    LEU  71           H        LEU  71   2.216  -0.967  -7.969
  526    HA   LEU  71           HA       LEU  71  -0.034  -1.330  -7.784
  527   1HB   LEU  71          1HB       LEU  71   0.539  -2.547  -9.846
  528   2HB   LEU  71          2HB       LEU  71   0.806  -4.004  -8.907
  529    HG   LEU  71           HG       LEU  71  -1.486  -4.276  -8.449
  530   1HD1  LEU  71          1HD1      LEU  71  -1.778  -1.409  -9.306
  531   2HD1  LEU  71          2HD1      LEU  71  -3.153  -2.503  -9.165
  532   3HD1  LEU  71          3HD1      LEU  71  -2.171  -2.135  -7.746
  533   1HD2  LEU  71          1HD2      LEU  71  -0.780  -4.735 -10.803
  534   2HD2  LEU  71          2HD2      LEU  71  -2.500  -4.399 -10.605
  535   3HD2  LEU  71          3HD2      LEU  71  -1.428  -3.154 -11.244
  536    H    ILE  72           H        ILE  72   1.076  -1.615  -5.356
  537    HA   ILE  72           HA       ILE  72   0.948  -3.903  -3.917
  538    HB   ILE  72           HB       ILE  72   0.281  -1.077  -3.216
  539   1HG1  ILE  72          1HG1      ILE  72   2.291  -2.745  -1.801
  540   2HG1  ILE  72          2HG1      ILE  72   2.612  -2.347  -3.486
  541   1HG2  ILE  72          1HG2      ILE  72  -0.415  -3.454  -1.588
  542   2HG2  ILE  72          2HG2      ILE  72   0.388  -2.125  -0.749
  543   3HG2  ILE  72          3HG2      ILE  72  -1.129  -1.842  -1.604
  544   1HD1  ILE  72          1HD1      ILE  72   1.802   0.036  -2.270
  545   2HD1  ILE  72          2HD1      ILE  72   2.923  -0.738  -1.151
  546   3HD1  ILE  72          3HD1      ILE  72   3.421  -0.411  -2.810
  547    H    VAL  73           H        VAL  73  -1.822  -1.736  -3.487
  548    HA   VAL  73           HA       VAL  73  -3.598  -4.050  -3.894
  549    HB   VAL  73           HB       VAL  73  -5.004  -3.328  -2.058
  550   1HG1  VAL  73          1HG1      VAL  73  -2.260  -4.189  -1.744
  551   2HG1  VAL  73          2HG1      VAL  73  -2.842  -3.334  -0.316
  552   3HG1  VAL  73          3HG1      VAL  73  -3.718  -4.742  -0.919
  553   1HG2  VAL  73          1HG2      VAL  73  -3.240  -0.967  -2.134
  554   2HG2  VAL  73          2HG2      VAL  73  -4.945  -1.100  -1.702
  555   3HG2  VAL  73          3HG2      VAL  73  -3.701  -1.534  -0.528
  556    H    VAL  74           H        VAL  74  -5.643  -3.645  -4.702
  557    HA   VAL  74           HA       VAL  74  -6.057  -0.952  -5.852
  558    HB   VAL  74           HB       VAL  74  -6.862  -3.642  -6.989
  559   1HG1  VAL  74          1HG1      VAL  74  -8.252  -1.338  -7.338
  560   2HG1  VAL  74          2HG1      VAL  74  -7.102  -1.246  -8.671
  561   3HG1  VAL  74          3HG1      VAL  74  -8.169  -2.641  -8.520
  562   1HG2  VAL  74          1HG2      VAL  74  -4.557  -1.882  -7.394
  563   2HG2  VAL  74          2HG2      VAL  74  -4.745  -3.605  -7.723
  564   3HG2  VAL  74          3HG2      VAL  74  -5.341  -2.415  -8.881
  565    H    VAL  75           H        VAL  75  -7.986   0.019  -5.409
  566    HA   VAL  75           HA       VAL  75  -9.982  -1.587  -3.979
  567    HB   VAL  75           HB       VAL  75 -10.585   0.391  -2.724
  568   1HG1  VAL  75          1HG1      VAL  75  -8.284  -1.095  -2.410
  569   2HG1  VAL  75          2HG1      VAL  75  -7.733   0.572  -2.235
  570   3HG1  VAL  75          3HG1      VAL  75  -9.019  -0.044  -1.198
  571   1HG2  VAL  75          1HG2      VAL  75  -9.469   1.797  -4.785
  572   2HG2  VAL  75          2HG2      VAL  75  -9.963   2.475  -3.236
  573   3HG2  VAL  75          3HG2      VAL  75  -8.284   2.005  -3.497
  574    H    GLU  76           H        GLU  76 -12.188  -0.658  -4.005
  575    HA   GLU  76           HA       GLU  76 -13.001  -0.210  -6.721
  576   1HB   GLU  76          1HB       GLU  76 -14.211  -1.128  -4.290
  577   2HB   GLU  76          2HB       GLU  76 -15.172   0.200  -4.932
  578   1HG   GLU  76          1HG       GLU  76 -15.056  -1.058  -7.164
  579   2HG   GLU  76          2HG       GLU  76 -14.531  -2.435  -6.196
  580    H    ALA  77           H        ALA  77 -12.754   1.682  -3.774
  581    HA   ALA  77           HA       ALA  77 -12.928   3.893  -3.329
  582   1HB   ALA  77          1HB       ALA  77 -11.811   5.284  -4.742
  583   2HB   ALA  77          2HB       ALA  77 -12.541   4.586  -6.189
  584   3HB   ALA  77          3HB       ALA  77 -11.259   3.720  -5.340
  585    H    GLU  78           H        GLU  78 -14.328   5.654  -3.338
  586    HA   GLU  78           HA       GLU  78 -16.486   6.440  -3.291
  587   1HB   GLU  78          1HB       GLU  78 -17.181   7.321  -5.466
  588   2HB   GLU  78          2HB       GLU  78 -15.471   7.606  -5.174
  589   1HG   GLU  78          1HG       GLU  78 -14.804   6.137  -6.797
  590   2HG   GLU  78          2HG       GLU  78 -16.279   5.177  -6.688
  591    H    GLY  79           H        GLY  79 -16.856   3.924  -2.686
  592   1HA   GLY  79          1HA       GLY  79 -17.973   1.901  -3.556
  593   2HA   GLY  79          2HA       GLY  79 -18.995   2.980  -4.494
  594    H    THR  80           H        THR  80 -18.331   1.671  -1.333
  595    HA   THR  80           HA       THR  80 -21.009   2.525  -0.486
  596    HB   THR  80           HB       THR  80 -20.890   0.694   1.143
  597    HG1  THR  80           HG1      THR  80 -19.120  -0.482   1.416
  598   1HG2  THR  80          1HG2      THR  80 -21.729   0.150  -1.090
  599   2HG2  THR  80          2HG2      THR  80 -20.091  -0.273  -1.590
  600   3HG2  THR  80          3HG2      THR  80 -20.900  -1.212  -0.336
  601    H    ALA  81           H        ALA  81 -21.061   2.533   2.102
  602    HA   ALA  81           HA       ALA  81 -18.830   3.529   3.495
  603   1HB   ALA  81          1HB       ALA  81 -20.086   5.911   3.686
  604   2HB   ALA  81          2HB       ALA  81 -20.418   5.505   2.001
  605   3HB   ALA  81          3HB       ALA  81 -18.753   5.584   2.577

  No H/Q in entry =         605
  Start of MODEL   13
    1    H1   ALA   1           H1       ALA   1 -13.494   4.850  -9.592
    2    H2   ALA   1           H2       ALA   1 -13.351   4.050 -11.101
    3    H3   ALA   1           H3       ALA   1 -14.702   5.064 -10.793
    4    HA   ALA   1           HA       ALA   1 -15.573   3.618  -9.234
    5   1HB   ALA   1          1HB       ALA   1 -15.468   3.043 -11.843
    6   2HB   ALA   1          2HB       ALA   1 -16.308   2.031 -10.669
    7   3HB   ALA   1          3HB       ALA   1 -14.683   1.601 -11.200
    8    H    LEU   2           H        LEU   2 -12.348   2.603 -10.244
    9    HA   LEU   2           HA       LEU   2 -12.069   1.199  -7.675
   10   1HB   LEU   2          1HB       LEU   2 -11.240   0.227 -10.405
   11   2HB   LEU   2          2HB       LEU   2 -10.585  -0.443  -8.922
   12    HG   LEU   2           HG       LEU   2 -13.486  -0.411  -8.881
   13   1HD1  LEU   2          1HD1      LEU   2 -12.908  -0.662 -11.376
   14   2HD1  LEU   2          2HD1      LEU   2 -12.313  -2.259 -10.924
   15   3HD1  LEU   2          3HD1      LEU   2 -14.002  -1.834 -10.643
   16   1HD2  LEU   2          1HD2      LEU   2 -12.056  -1.692  -7.357
   17   2HD2  LEU   2          2HD2      LEU   2 -13.160  -2.737  -8.251
   18   3HD2  LEU   2          3HD2      LEU   2 -11.461  -2.641  -8.719
   19    H    VAL   3           H        VAL   3  -9.553   0.547  -7.548
   20    HA   VAL   3           HA       VAL   3  -7.839   2.682  -8.505
   21    HB   VAL   3           HB       VAL   3  -8.539   2.345  -5.595
   22   1HG1  VAL   3          1HG1      VAL   3  -6.128   3.783  -6.706
   23   2HG1  VAL   3          2HG1      VAL   3  -6.686   3.858  -5.034
   24   3HG1  VAL   3          3HG1      VAL   3  -6.110   2.329  -5.704
   25   1HG2  VAL   3          1HG2      VAL   3  -8.874   4.418  -7.658
   26   2HG2  VAL   3          2HG2      VAL   3  -9.875   4.034  -6.257
   27   3HG2  VAL   3          3HG2      VAL   3  -8.410   4.995  -6.058
   28    H    GLU   4           H        GLU   4  -5.580   2.343  -7.950
   29    HA   GLU   4           HA       GLU   4  -4.893  -0.399  -7.171
   30   1HB   GLU   4          1HB       GLU   4  -2.989   0.190  -9.081
   31   2HB   GLU   4          2HB       GLU   4  -4.363  -0.883  -9.302
   32   1HG   GLU   4          1HG       GLU   4  -5.663   1.063 -10.145
   33   2HG   GLU   4          2HG       GLU   4  -4.189   2.026 -10.054
   34    H    LEU   5           H        LEU   5  -4.150   0.331  -5.188
   35    HA   LEU   5           HA       LEU   5  -2.588   2.554  -4.673
   36   1HB   LEU   5          1HB       LEU   5  -3.402   0.217  -3.259
   37   2HB   LEU   5          2HB       LEU   5  -1.689   0.451  -2.977
   38    HG   LEU   5           HG       LEU   5  -3.045   1.516  -1.242
   39   1HD1  LEU   5          1HD1      LEU   5  -0.870   2.471  -1.832
   40   2HD1  LEU   5          2HD1      LEU   5  -1.655   3.518  -3.015
   41   3HD1  LEU   5          3HD1      LEU   5  -2.006   3.710  -1.298
   42   1HD2  LEU   5          1HD2      LEU   5  -4.797   2.118  -3.226
   43   2HD2  LEU   5          2HD2      LEU   5  -4.795   2.869  -1.630
   44   3HD2  LEU   5          3HD2      LEU   5  -4.002   3.674  -2.983
   45    H    LYS   6           H        LYS   6  -0.252   2.453  -3.878
   46    HA   LYS   6           HA       LYS   6   1.469   0.585  -5.233
   47   1HB   LYS   6          1HB       LYS   6   1.127   3.402  -6.187
   48   2HB   LYS   6          2HB       LYS   6   2.697   2.624  -6.317
   49   1HG   LYS   6          1HG       LYS   6   2.008   1.800  -8.257
   50   2HG   LYS   6          2HG       LYS   6   0.928   0.752  -7.336
   51   1HD   LYS   6          1HD       LYS   6  -0.640   1.744  -8.640
   52   2HD   LYS   6          2HD       LYS   6  -0.562   2.974  -7.376
   53   1HE   LYS   6          1HE       LYS   6   0.538   4.465  -8.702
   54   2HE   LYS   6          2HE       LYS   6   1.354   3.205  -9.628
   55   1HZ   LYS   6          1HZ       LYS   6  -1.368   2.974 -10.144
   56   2HZ   LYS   6          2HZ       LYS   6  -0.994   4.618 -10.272
   57   3HZ   LYS   6          3HZ       LYS   6  -0.154   3.484 -11.205
   58    H    VAL   7           H        VAL   7   3.752   0.979  -4.762
   59    HA   VAL   7           HA       VAL   7   4.268   1.379  -2.075
   60    HB   VAL   7           HB       VAL   7   6.187   1.726  -4.386
   61   1HG1  VAL   7          1HG1      VAL   7   6.824   2.584  -2.020
   62   2HG1  VAL   7          2HG1      VAL   7   6.981   0.872  -1.638
   63   3HG1  VAL   7          3HG1      VAL   7   7.963   1.582  -2.917
   64   1HG2  VAL   7          1HG2      VAL   7   4.954  -0.447  -4.283
   65   2HG2  VAL   7          2HG2      VAL   7   6.706  -0.585  -4.148
   66   3HG2  VAL   7          3HG2      VAL   7   5.699  -0.724  -2.709
   67    HA   PRO   8           HA       PRO   8   4.101   5.775  -1.639
   68   1HB   PRO   8          1HB       PRO   8   5.557   6.064   0.640
   69   2HB   PRO   8          2HB       PRO   8   3.887   5.485   0.614
   70   1HG   PRO   8          1HG       PRO   8   6.428   3.933   0.864
   71   2HG   PRO   8          2HG       PRO   8   4.871   3.680   1.673
   72   1HD   PRO   8          1HD       PRO   8   5.711   2.206  -0.461
   73   2HD   PRO   8          2HD       PRO   8   4.000   2.508  -0.099
   74    H    ASP   9           H        ASP   9   5.854   7.489  -0.664
   75    HA   ASP   9           HA       ASP   9   8.022   7.419  -2.622
   76   1HB   ASP   9          1HB       ASP   9   6.397   9.484  -1.331
   77   2HB   ASP   9          2HB       ASP   9   8.109   9.891  -1.410
   78    H    ILE  10           H        ILE  10   8.799   5.676  -0.910
   79    HA   ILE  10           HA       ILE  10   9.824   6.287   1.549
   80    HB   ILE  10           HB       ILE  10  11.785   4.656   0.788
   81   1HG1  ILE  10          1HG1      ILE  10  11.148   3.158  -0.974
   82   2HG1  ILE  10          2HG1      ILE  10   9.584   3.940  -1.157
   83   1HG2  ILE  10          1HG2      ILE  10   9.953   4.275   2.445
   84   2HG2  ILE  10          2HG2      ILE  10   8.959   3.664   1.119
   85   3HG2  ILE  10          3HG2      ILE  10  10.453   2.834   1.559
   86   1HD1  ILE  10          1HD1      ILE  10  12.064   5.524  -1.603
   87   2HD1  ILE  10          2HD1      ILE  10  11.510   4.401  -2.844
   88   3HD1  ILE  10          3HD1      ILE  10  10.460   5.714  -2.312
   89    H    GLY  11           H        GLY  11  11.000   7.389  -1.523
   90   1HA   GLY  11          1HA       GLY  11  12.708   9.297  -0.297
   91   2HA   GLY  11          2HA       GLY  11  12.589   8.971  -2.019
   92    H    GLY  12           H        GLY  12  13.491   6.551  -2.438
   93   1HA   GLY  12          1HA       GLY  12  15.418   5.240  -1.205
   94   2HA   GLY  12          2HA       GLY  12  16.278   6.727  -1.572
   95    H    HIS  13           H        HIS  13  14.326   4.199  -3.133
   96    HA   HIS  13           HA       HIS  13  14.962   4.687  -5.768
   97   1HB   HIS  13          1HB       HIS  13  16.800   2.964  -6.105
   98   2HB   HIS  13          2HB       HIS  13  17.287   4.478  -5.350
   99    HD1  HIS  13           HD1      HIS  13  19.234   2.433  -4.782
  100    HD2  HIS  13           HD2      HIS  13  15.737   2.664  -2.548
  101    HE1  HIS  13           HE1      HIS  13  19.729   1.226  -2.632
  102    HE2  HIS  13           HE2      HIS  13  17.627   1.453  -1.262
  103    H    GLU  14           H        GLU  14  15.159   2.369  -7.002
  104    HA   GLU  14           HA       GLU  14  12.691   1.082  -6.438
  105   1HB   GLU  14          1HB       GLU  14  13.352  -0.470  -8.264
  106   2HB   GLU  14          2HB       GLU  14  13.479   1.224  -8.718
  107   1HG   GLU  14          1HG       GLU  14  15.957   0.206  -7.617
  108   2HG   GLU  14          2HG       GLU  14  15.417  -0.721  -9.016
  109    H    ASN  15           H        ASN  15  12.640  -1.424  -6.374
  110    HA   ASN  15           HA       ASN  15  12.821  -3.186  -4.916
  111   1HB   ASN  15          1HB       ASN  15  15.158  -4.148  -4.877
  112   2HB   ASN  15          2HB       ASN  15  14.497  -3.845  -6.480
  113   1HD2  ASN  15          2HD2      ASN  15  16.886  -2.967  -4.154
  114   2HD2  ASN  15          1HD2      ASN  15  17.799  -1.913  -5.173
  115    H    VAL  16           H        VAL  16  12.159  -2.313  -2.950
  116    HA   VAL  16           HA       VAL  16  14.363  -1.693  -1.096
  117    HB   VAL  16           HB       VAL  16  13.071  -0.007   0.006
  118   1HG1  VAL  16          1HG1      VAL  16  13.582   0.155  -2.863
  119   2HG1  VAL  16          2HG1      VAL  16  12.413   1.338  -2.278
  120   3HG1  VAL  16          3HG1      VAL  16  14.024   1.262  -1.564
  121   1HG2  VAL  16          1HG2      VAL  16  10.851  -1.343  -1.179
  122   2HG2  VAL  16          2HG2      VAL  16  10.850  -0.075   0.047
  123   3HG2  VAL  16          3HG2      VAL  16  10.812   0.351  -1.665
  124    H    ASP  17           H        ASP  17  12.483  -1.411   1.157
  125    HA   ASP  17           HA       ASP  17  11.345  -4.098   1.327
  126   1HB   ASP  17          1HB       ASP  17  13.187  -2.965   3.439
  127   2HB   ASP  17          2HB       ASP  17  12.414  -4.548   3.456
  128    H    ILE  18           H        ILE  18   9.335  -3.983   2.044
  129    HA   ILE  18           HA       ILE  18   8.184  -1.616   3.069
  130    HB   ILE  18           HB       ILE  18   7.198  -4.472   3.015
  131   1HG1  ILE  18          1HG1      ILE  18   6.039  -2.227   1.437
  132   2HG1  ILE  18          2HG1      ILE  18   7.586  -2.896   0.926
  133   1HG2  ILE  18          1HG2      ILE  18   5.761  -1.975   3.886
  134   2HG2  ILE  18          2HG2      ILE  18   4.939  -3.466   3.431
  135   3HG2  ILE  18          3HG2      ILE  18   6.031  -3.449   4.815
  136   1HD1  ILE  18          1HD1      ILE  18   5.721  -5.005   1.464
  137   2HD1  ILE  18          2HD1      ILE  18   5.041  -3.850   0.318
  138   3HD1  ILE  18          3HD1      ILE  18   6.589  -4.623  -0.021
  139    H    ILE  19           H        ILE  19   7.062  -1.496   5.232
  140    HA   ILE  19           HA       ILE  19   8.629  -2.959   7.254
  141    HB   ILE  19           HB       ILE  19   9.513  -1.148   8.170
  142   1HG1  ILE  19          1HG1      ILE  19   6.770   0.120   8.214
  143   2HG1  ILE  19          2HG1      ILE  19   7.525  -0.786   9.517
  144   1HG2  ILE  19          1HG2      ILE  19   9.156  -0.374   5.632
  145   2HG2  ILE  19          2HG2      ILE  19   8.270   0.906   6.461
  146   3HG2  ILE  19          3HG2      ILE  19   9.961   0.610   6.847
  147   1HD1  ILE  19          1HD1      ILE  19   8.493   1.838   8.411
  148   2HD1  ILE  19          2HD1      ILE  19   7.606   1.606   9.919
  149   3HD1  ILE  19          3HD1      ILE  19   9.227   0.935   9.736
  150    H    ALA  20           H        ALA  20   5.541  -2.150   6.159
  151    HA   ALA  20           HA       ALA  20   4.384  -3.463   8.469
  152   1HB   ALA  20          1HB       ALA  20   4.513  -0.877   8.793
  153   2HB   ALA  20          2HB       ALA  20   3.123  -0.872   7.707
  154   3HB   ALA  20          3HB       ALA  20   3.048  -1.755   9.231
  155    H    VAL  21           H        VAL  21   2.087  -3.969   8.167
  156    HA   VAL  21           HA       VAL  21   1.099  -3.817   5.432
  157    HB   VAL  21           HB       VAL  21   2.396  -5.911   5.495
  158   1HG1  VAL  21          1HG1      VAL  21   1.665  -6.156   8.055
  159   2HG1  VAL  21          2HG1      VAL  21   0.457  -7.207   7.314
  160   3HG1  VAL  21          3HG1      VAL  21   2.174  -7.527   7.068
  161   1HG2  VAL  21          1HG2      VAL  21  -0.006  -5.527   4.390
  162   2HG2  VAL  21          2HG2      VAL  21   0.877  -7.046   4.248
  163   3HG2  VAL  21          3HG2      VAL  21  -0.401  -6.879   5.452
  164    H    GLU  22           H        GLU  22  -1.062  -3.584   5.348
  165    HA   GLU  22           HA       GLU  22  -2.803  -4.633   7.375
  166   1HB   GLU  22          1HB       GLU  22  -2.270  -1.669   7.223
  167   2HB   GLU  22          2HB       GLU  22  -3.739  -2.330   7.926
  168   1HG   GLU  22          1HG       GLU  22  -2.270  -3.650   9.481
  169   2HG   GLU  22          2HG       GLU  22  -0.914  -2.698   8.878
  170    H    VAL  23           H        VAL  23  -3.427  -5.574   5.275
  171    HA   VAL  23           HA       VAL  23  -5.576  -4.006   4.097
  172    HB   VAL  23           HB       VAL  23  -4.794  -4.804   1.778
  173   1HG1  VAL  23          1HG1      VAL  23  -3.507  -2.561   3.312
  174   2HG1  VAL  23          2HG1      VAL  23  -3.274  -2.783   1.578
  175   3HG1  VAL  23          3HG1      VAL  23  -4.890  -2.488   2.220
  176   1HG2  VAL  23          1HG2      VAL  23  -2.271  -5.086   3.387
  177   2HG2  VAL  23          2HG2      VAL  23  -3.015  -6.255   2.298
  178   3HG2  VAL  23          3HG2      VAL  23  -2.252  -4.806   1.646
  179    H    ASN  24           H        ASN  24  -7.276  -5.254   4.287
  180    HA   ASN  24           HA       ASN  24  -6.966  -8.137   3.779
  181   1HB   ASN  24          1HB       ASN  24  -9.149  -6.911   5.453
  182   2HB   ASN  24          2HB       ASN  24  -8.680  -8.604   5.344
  183   1HD2  ASN  24          2HD2      ASN  24  -8.125  -9.031   7.392
  184   2HD2  ASN  24          1HD2      ASN  24  -6.879  -8.213   8.266
  185    H    VAL  25           H        VAL  25  -7.458  -8.185   1.667
  186    HA   VAL  25           HA       VAL  25  -9.198  -6.761   0.161
  187    HB   VAL  25           HB       VAL  25  -9.427  -8.711  -1.305
  188   1HG1  VAL  25          1HG1      VAL  25  -7.383  -7.358  -1.369
  189   2HG1  VAL  25          2HG1      VAL  25  -6.648  -8.431  -0.177
  190   3HG1  VAL  25          3HG1      VAL  25  -7.067  -9.045  -1.776
  191   1HG2  VAL  25          1HG2      VAL  25  -8.770 -10.131   1.157
  192   2HG2  VAL  25          2HG2      VAL  25  -9.609 -10.697  -0.288
  193   3HG2  VAL  25          3HG2      VAL  25  -7.846 -10.679  -0.241
  194    H    GLY  26           H        GLY  26 -11.232  -6.213   0.601
  195   1HA   GLY  26          1HA       GLY  26 -13.066  -8.338   1.524
  196   2HA   GLY  26          2HA       GLY  26 -13.538  -7.084   0.388
  197    H    ASP  27           H        ASP  27 -11.804  -5.212   2.158
  198    HA   ASP  27           HA       ASP  27 -13.868  -4.792   4.220
  199   1HB   ASP  27          1HB       ASP  27 -11.006  -5.058   4.478
  200   2HB   ASP  27          2HB       ASP  27 -11.520  -3.469   5.036
  201    H    THR  28           H        THR  28 -14.450  -2.643   4.698
  202    HA   THR  28           HA       THR  28 -14.332  -0.878   2.438
  203    HB   THR  28           HB       THR  28 -15.442  -0.248   5.172
  204    HG1  THR  28           HG1      THR  28 -16.547  -1.759   3.061
  205   1HG2  THR  28          1HG2      THR  28 -15.291   1.592   3.473
  206   2HG2  THR  28          2HG2      THR  28 -16.429   0.669   2.491
  207   3HG2  THR  28          3HG2      THR  28 -16.907   1.247   4.087
  208    H    ILE  29           H        ILE  29 -13.314   1.090   2.258
  209    HA   ILE  29           HA       ILE  29 -11.623   2.003   4.458
  210    HB   ILE  29           HB       ILE  29  -9.694   2.321   2.939
  211   1HG1  ILE  29          1HG1      ILE  29  -9.882   0.636   0.888
  212   2HG1  ILE  29          2HG1      ILE  29 -11.591   1.037   1.030
  213   1HG2  ILE  29          1HG2      ILE  29 -10.387   0.115   4.340
  214   2HG2  ILE  29          2HG2      ILE  29 -10.141  -0.576   2.735
  215   3HG2  ILE  29          3HG2      ILE  29  -8.842   0.324   3.518
  216   1HD1  ILE  29          1HD1      ILE  29  -9.399   3.072   0.747
  217   2HD1  ILE  29          2HD1      ILE  29 -10.346   2.430  -0.593
  218   3HD1  ILE  29          3HD1      ILE  29 -11.137   3.356   0.679
  219    H    ALA  30           H        ALA  30 -10.637   4.167   3.969
  220    HA   ALA  30           HA       ALA  30 -12.361   5.734   2.167
  221   1HB   ALA  30          1HB       ALA  30 -12.929   5.945   4.630
  222   2HB   ALA  30          2HB       ALA  30 -11.382   6.771   4.812
  223   3HB   ALA  30          3HB       ALA  30 -12.625   7.449   3.759
  224    H    VAL  31           H        VAL  31 -11.265   8.180   2.380
  225    HA   VAL  31           HA       VAL  31  -8.683   7.796   1.091
  226    HB   VAL  31           HB       VAL  31 -10.110  10.423   1.452
  227   1HG1  VAL  31          1HG1      VAL  31  -7.658  10.108   0.602
  228   2HG1  VAL  31          2HG1      VAL  31  -8.453   9.644  -0.902
  229   3HG1  VAL  31          3HG1      VAL  31  -8.743  11.239  -0.208
  230   1HG2  VAL  31          1HG2      VAL  31 -11.560   8.592   0.423
  231   2HG2  VAL  31          2HG2      VAL  31 -11.367  10.082  -0.501
  232   3HG2  VAL  31          3HG2      VAL  31 -10.448   8.644  -0.944
  233    H    ASP  32           H        ASP  32  -8.537   7.256   3.801
  234    HA   ASP  32           HA       ASP  32  -6.375   8.801   4.618
  235   1HB   ASP  32          1HB       ASP  32  -7.525   9.942   6.614
  236   2HB   ASP  32          2HB       ASP  32  -7.726  10.678   5.027
  237    H    ASP  33           H        ASP  33  -6.160   6.347   4.738
  238    HA   ASP  33           HA       ASP  33  -6.341   5.606   7.536
  239   1HB   ASP  33          1HB       ASP  33  -7.238   3.277   6.733
  240   2HB   ASP  33          2HB       ASP  33  -8.366   4.596   7.030
  241    H    THR  34           H        THR  34  -4.246   5.239   7.884
  242    HA   THR  34           HA       THR  34  -2.268   4.620   6.144
  243    HB   THR  34           HB       THR  34  -1.418   3.221   8.284
  244    HG1  THR  34           HG1      THR  34  -2.580   3.644   9.967
  245   1HG2  THR  34          1HG2      THR  34  -1.450   6.205   7.987
  246   2HG2  THR  34          2HG2      THR  34  -0.434   5.307   9.115
  247   3HG2  THR  34          3HG2      THR  34  -0.224   5.092   7.375
  248    H    LEU  35           H        LEU  35  -1.911   3.068   4.769
  249    HA   LEU  35           HA       LEU  35  -3.210   0.480   5.103
  250   1HB   LEU  35          1HB       LEU  35  -1.621   1.625   2.802
  251   2HB   LEU  35          2HB       LEU  35  -2.401   0.055   2.797
  252    HG   LEU  35           HG       LEU  35  -3.777   2.735   2.944
  253   1HD1  LEU  35          1HD1      LEU  35  -3.253   0.762   0.783
  254   2HD1  LEU  35          2HD1      LEU  35  -4.785   1.635   0.776
  255   3HD1  LEU  35          3HD1      LEU  35  -3.265   2.526   0.730
  256   1HD2  LEU  35          1HD2      LEU  35  -4.709  -0.016   3.483
  257   2HD2  LEU  35          2HD2      LEU  35  -5.307   1.527   4.093
  258   3HD2  LEU  35          3HD2      LEU  35  -5.754   0.986   2.476
  259    H    ILE  36           H        ILE  36   0.020   1.879   4.660
  260    HA   ILE  36           HA       ILE  36   1.167  -0.283   6.205
  261    HB   ILE  36           HB       ILE  36   2.936  -0.766   4.480
  262   1HG1  ILE  36          1HG1      ILE  36   2.673  -0.261   2.224
  263   2HG1  ILE  36          2HG1      ILE  36   0.963   0.119   2.398
  264   1HG2  ILE  36          1HG2      ILE  36   0.644  -2.005   5.027
  265   2HG2  ILE  36          2HG2      ILE  36   0.412  -1.709   3.305
  266   3HG2  ILE  36          3HG2      ILE  36   1.822  -2.610   3.864
  267   1HD1  ILE  36          1HD1      ILE  36   1.590   2.196   3.569
  268   2HD1  ILE  36          2HD1      ILE  36   3.289   1.808   3.289
  269   3HD1  ILE  36          3HD1      ILE  36   2.215   2.113   1.923
  270    H    THR  37           H        THR  37   3.692  -0.027   6.065
  271    HA   THR  37           HA       THR  37   4.476   2.782   6.016
  272    HB   THR  37           HB       THR  37   5.040   0.927   8.344
  273    HG1  THR  37           HG1      THR  37   3.393   1.797   9.288
  274   1HG2  THR  37          1HG2      THR  37   6.818   2.623   7.825
  275   2HG2  THR  37          2HG2      THR  37   5.618   3.866   8.177
  276   3HG2  THR  37          3HG2      THR  37   6.102   2.727   9.433
  277    H    LEU  38           H        LEU  38   6.157   2.864   4.668
  278    HA   LEU  38           HA       LEU  38   7.866   0.481   4.443
  279   1HB   LEU  38          1HB       LEU  38   7.023   2.574   2.478
  280   2HB   LEU  38          2HB       LEU  38   8.468   1.619   2.197
  281    HG   LEU  38           HG       LEU  38   6.733  -0.368   2.692
  282   1HD1  LEU  38          1HD1      LEU  38   5.087   1.923   2.456
  283   2HD1  LEU  38          2HD1      LEU  38   4.843   0.935   1.014
  284   3HD1  LEU  38          3HD1      LEU  38   4.602   0.234   2.615
  285   1HD2  LEU  38          1HD2      LEU  38   7.819   0.945   0.339
  286   2HD2  LEU  38          2HD2      LEU  38   7.669  -0.773   0.711
  287   3HD2  LEU  38          3HD2      LEU  38   6.306   0.099   0.011
  288    H    GLU  39           H        GLU  39  10.092   1.088   3.458
  289    HA   GLU  39           HA       GLU  39  11.311   3.540   4.048
  290   1HB   GLU  39          1HB       GLU  39  10.957   3.044   6.370
  291   2HB   GLU  39          2HB       GLU  39  11.597   1.419   6.176
  292   1HG   GLU  39          1HG       GLU  39  13.301   3.807   5.601
  293   2HG   GLU  39          2HG       GLU  39  13.074   3.233   7.253
  294    H    THR  40           H        THR  40  13.625   3.490   3.705
  295    HA   THR  40           HA       THR  40  14.597   0.997   2.485
  296    HB   THR  40           HB       THR  40  15.410   2.109   0.580
  297    HG1  THR  40           HG1      THR  40  15.909   4.167   0.535
  298   1HG2  THR  40          1HG2      THR  40  12.692   3.062   1.329
  299   2HG2  THR  40          2HG2      THR  40  13.460   3.665  -0.139
  300   3HG2  THR  40          3HG2      THR  40  13.184   1.938   0.067
  301    H    ASP  41           H        ASP  41  15.678   4.275   3.327
  302    HA   ASP  41           HA       ASP  41  17.533   3.452   5.274
  303   1HB   ASP  41          1HB       ASP  41  18.716   2.528   3.303
  304   2HB   ASP  41          2HB       ASP  41  18.759   4.138   2.592
  305    H    LYS  42           H        LYS  42  16.703   5.828   2.805
  306    HA   LYS  42           HA       LYS  42  17.922   8.027   4.172
  307   1HB   LYS  42          1HB       LYS  42  16.192   7.689   1.771
  308   2HB   LYS  42          2HB       LYS  42  16.260   9.281   2.514
  309   1HG   LYS  42          1HG       LYS  42  18.705   7.741   1.679
  310   2HG   LYS  42          2HG       LYS  42  17.871   8.895   0.636
  311   1HD   LYS  42          1HD       LYS  42  18.870  10.614   1.637
  312   2HD   LYS  42          2HD       LYS  42  18.355  10.048   3.228
  313   1HE   LYS  42          1HE       LYS  42  20.270   8.498   3.269
  314   2HE   LYS  42          2HE       LYS  42  20.795   9.131   1.709
  315   1HZ   LYS  42          1HZ       LYS  42  20.794  11.379   2.896
  316   2HZ   LYS  42          2HZ       LYS  42  20.771  10.483   4.332
  317   3HZ   LYS  42          3HZ       LYS  42  22.052  10.305   3.243
  318    H    ALA  43           H        ALA  43  14.835   6.448   4.287
  319    HA   ALA  43           HA       ALA  43  14.040   7.581   6.689
  320   1HB   ALA  43          1HB       ALA  43  13.007   9.511   6.265
  321   2HB   ALA  43          2HB       ALA  43  12.171   8.848   4.863
  322   3HB   ALA  43          3HB       ALA  43  13.811   9.476   4.696
  323    H    THR  44           H        THR  44  11.617   7.288   7.088
  324    HA   THR  44           HA       THR  44  10.741   4.854   5.681
  325    HB   THR  44           HB       THR  44   9.783   4.074   7.658
  326    HG1  THR  44           HG1      THR  44   9.495   5.532   9.482
  327   1HG2  THR  44          1HG2      THR  44  12.423   4.992   7.856
  328   2HG2  THR  44          2HG2      THR  44  11.636   5.392   9.382
  329   3HG2  THR  44          3HG2      THR  44  11.639   3.728   8.801
  330    H    MET  45           H        MET  45   8.869   4.876   4.594
  331    HA   MET  45           HA       MET  45   7.195   7.283   4.828
  332   1HB   MET  45          1HB       MET  45   8.237   5.833   2.570
  333   2HB   MET  45          2HB       MET  45   6.480   5.871   2.501
  334   1HG   MET  45          1HG       MET  45   7.311   7.745   1.298
  335   2HG   MET  45          2HG       MET  45   6.580   8.334   2.789
  336   1HE   MET  45          1HE       MET  45   7.650  10.622   2.830
  337   2HE   MET  45          2HE       MET  45   7.763   9.885   4.429
  338   3HE   MET  45          3HE       MET  45   9.132  10.783   3.773
  339    H    ASP  46           H        ASP  46   4.944   6.466   3.563
  340    HA   ASP  46           HA       ASP  46   3.851   4.013   4.367
  341   1HB   ASP  46          1HB       ASP  46   2.323   4.865   6.172
  342   2HB   ASP  46          2HB       ASP  46   4.018   4.781   6.640
  343    H    VAL  47           H        VAL  47   1.394   4.044   4.162
  344    HA   VAL  47           HA       VAL  47   0.566   6.201   2.331
  345    HB   VAL  47           HB       VAL  47  -0.023   3.254   2.022
  346   1HG1  VAL  47          1HG1      VAL  47  -1.626   5.408   1.254
  347   2HG1  VAL  47          2HG1      VAL  47  -0.783   4.914  -0.214
  348   3HG1  VAL  47          3HG1      VAL  47  -1.740   3.742   0.691
  349   1HG2  VAL  47          1HG2      VAL  47   2.248   3.991   1.338
  350   2HG2  VAL  47          2HG2      VAL  47   1.274   3.378   0.001
  351   3HG2  VAL  47          3HG2      VAL  47   1.500   5.115   0.203
  352    HA   PRO  48           HA       PRO  48  -2.889   6.179   5.190
  353   1HB   PRO  48          1HB       PRO  48  -3.886   8.561   4.549
  354   2HB   PRO  48          2HB       PRO  48  -2.328   8.425   5.374
  355   1HG   PRO  48          1HG       PRO  48  -2.914   9.014   2.513
  356   2HG   PRO  48          2HG       PRO  48  -1.611   9.630   3.545
  357   1HD   PRO  48          1HD       PRO  48  -1.425   7.519   1.687
  358   2HD   PRO  48          2HD       PRO  48  -0.229   7.943   2.926
  359    H    ALA  49           H        ALA  49  -3.057   4.876   2.476
  360    HA   ALA  49           HA       ALA  49  -4.619   4.101   1.016
  361   1HB   ALA  49          1HB       ALA  49  -6.793   3.617   1.911
  362   2HB   ALA  49          2HB       ALA  49  -5.591   3.348   3.172
  363   3HB   ALA  49          3HB       ALA  49  -6.577   4.809   3.192
  364    H    GLU  50           H        GLU  50  -4.821   5.326  -0.751
  365    HA   GLU  50           HA       GLU  50  -6.364   7.813  -0.576
  366   1HB   GLU  50          1HB       GLU  50  -3.940   7.500  -1.666
  367   2HB   GLU  50          2HB       GLU  50  -4.914   7.078  -3.067
  368   1HG   GLU  50          1HG       GLU  50  -5.561   9.191  -3.414
  369   2HG   GLU  50          2HG       GLU  50  -5.764   9.519  -1.694
  370    H    VAL  51           H        VAL  51  -8.232   6.297  -0.375
  371    HA   VAL  51           HA       VAL  51  -9.518   6.069  -2.948
  372    HB   VAL  51           HB       VAL  51 -10.128   3.563  -2.116
  373   1HG1  VAL  51          1HG1      VAL  51  -8.433   4.779  -4.129
  374   2HG1  VAL  51          2HG1      VAL  51  -7.927   3.141  -3.719
  375   3HG1  VAL  51          3HG1      VAL  51  -9.574   3.442  -4.270
  376   1HG2  VAL  51          1HG2      VAL  51  -8.123   4.069  -0.402
  377   2HG2  VAL  51          2HG2      VAL  51  -8.455   2.458  -1.046
  378   3HG2  VAL  51          3HG2      VAL  51  -7.193   3.455  -1.769
  379    H    ALA  52           H        ALA  52 -11.697   4.594  -2.337
  380    HA   ALA  52           HA       ALA  52 -12.780   5.344   0.236
  381   1HB   ALA  52          1HB       ALA  52 -13.022   7.440  -0.896
  382   2HB   ALA  52          2HB       ALA  52 -13.756   6.643  -2.292
  383   3HB   ALA  52          3HB       ALA  52 -14.611   6.687  -0.750
  384    H    GLY  53           H        GLY  53 -12.580   2.844  -0.504
  385   1HA   GLY  53          1HA       GLY  53 -14.308   1.609  -2.199
  386   2HA   GLY  53          2HA       GLY  53 -15.320   2.003  -0.819
  387    H    VAL  54           H        VAL  54 -13.647  -0.416  -2.174
  388    HA   VAL  54           HA       VAL  54 -12.751  -1.605   0.359
  389    HB   VAL  54           HB       VAL  54 -14.542  -2.998  -1.636
  390   1HG1  VAL  54          1HG1      VAL  54 -12.701  -4.136   0.028
  391   2HG1  VAL  54          2HG1      VAL  54 -14.157  -4.168   1.022
  392   3HG1  VAL  54          3HG1      VAL  54 -14.157  -4.933  -0.567
  393   1HG2  VAL  54          1HG2      VAL  54 -15.120  -1.382   0.725
  394   2HG2  VAL  54          2HG2      VAL  54 -16.185  -1.908  -0.579
  395   3HG2  VAL  54          3HG2      VAL  54 -15.851  -2.986   0.777
  396    H    VAL  55           H        VAL  55 -10.980  -2.936   0.190
  397    HA   VAL  55           HA       VAL  55  -9.458  -2.813  -2.215
  398    HB   VAL  55           HB       VAL  55  -8.978  -4.488   0.252
  399   1HG1  VAL  55          1HG1      VAL  55  -7.823  -5.346  -1.775
  400   2HG1  VAL  55          2HG1      VAL  55  -7.051  -3.769  -1.961
  401   3HG1  VAL  55          3HG1      VAL  55  -6.707  -4.755  -0.541
  402   1HG2  VAL  55          1HG2      VAL  55  -9.004  -1.838   0.245
  403   2HG2  VAL  55          2HG2      VAL  55  -7.811  -2.755   1.164
  404   3HG2  VAL  55          3HG2      VAL  55  -7.380  -2.073  -0.404
  405    H    LYS  56           H        LYS  56  -8.838  -4.458  -3.589
  406    HA   LYS  56           HA       LYS  56 -10.569  -6.845  -3.561
  407   1HB   LYS  56          1HB       LYS  56  -9.395  -6.355  -6.148
  408   2HB   LYS  56          2HB       LYS  56 -11.093  -6.511  -5.716
  409   1HG   LYS  56          1HG       LYS  56  -9.613  -3.943  -5.288
  410   2HG   LYS  56          2HG       LYS  56 -10.313  -4.354  -6.855
  411   1HD   LYS  56          1HD       LYS  56 -11.777  -4.100  -4.229
  412   2HD   LYS  56          2HD       LYS  56 -11.876  -3.000  -5.605
  413   1HE   LYS  56          1HE       LYS  56 -12.952  -5.781  -5.325
  414   2HE   LYS  56          2HE       LYS  56 -13.793  -4.309  -5.809
  415   1HZ   LYS  56          1HZ       LYS  56 -12.038  -4.468  -7.765
  416   2HZ   LYS  56          2HZ       LYS  56 -12.148  -6.116  -7.398
  417   3HZ   LYS  56          3HZ       LYS  56 -13.535  -5.253  -7.832
  418    H    GLU  57           H        GLU  57  -7.443  -5.564  -4.620
  419    HA   GLU  57           HA       GLU  57  -6.368  -8.261  -4.349
  420   1HB   GLU  57          1HB       GLU  57  -5.767  -6.037  -6.214
  421   2HB   GLU  57          2HB       GLU  57  -4.426  -7.066  -5.732
  422   1HG   GLU  57          1HG       GLU  57  -6.983  -8.207  -6.796
  423   2HG   GLU  57          2HG       GLU  57  -5.686  -7.667  -7.862
  424    H    VAL  58           H        VAL  58  -3.876  -8.167  -3.939
  425    HA   VAL  58           HA       VAL  58  -2.911  -6.062  -2.265
  426    HB   VAL  58           HB       VAL  58  -4.395  -7.109  -0.637
  427   1HG1  VAL  58          1HG1      VAL  58  -3.475  -9.515  -1.874
  428   2HG1  VAL  58          2HG1      VAL  58  -3.134  -9.584  -0.145
  429   3HG1  VAL  58          3HG1      VAL  58  -4.781  -9.294  -0.708
  430   1HG2  VAL  58          1HG2      VAL  58  -1.451  -7.582  -0.205
  431   2HG2  VAL  58          2HG2      VAL  58  -2.407  -6.180   0.276
  432   3HG2  VAL  58          3HG2      VAL  58  -2.657  -7.733   1.075
  433    H    LYS  59           H        LYS  59  -0.775  -6.031  -2.413
  434    HA   LYS  59           HA       LYS  59   0.718  -8.516  -2.698
  435   1HB   LYS  59          1HB       LYS  59   0.978  -6.244  -4.670
  436   2HB   LYS  59          2HB       LYS  59   1.936  -7.720  -4.657
  437   1HG   LYS  59          1HG       LYS  59   0.429  -8.366  -6.201
  438   2HG   LYS  59          2HG       LYS  59  -0.519  -8.788  -4.772
  439   1HD   LYS  59          1HD       LYS  59  -1.935  -7.009  -5.016
  440   2HD   LYS  59          2HD       LYS  59  -0.720  -6.014  -5.821
  441   1HE   LYS  59          1HE       LYS  59  -2.357  -8.255  -6.979
  442   2HE   LYS  59          2HE       LYS  59  -2.332  -6.561  -7.466
  443   1HZ   LYS  59          1HZ       LYS  59   0.192  -7.153  -7.882
  444   2HZ   LYS  59          2HZ       LYS  59  -0.452  -8.703  -8.094
  445   3HZ   LYS  59          3HZ       LYS  59  -0.994  -7.423  -9.057
  446    H    VAL  60           H        VAL  60   1.136  -7.681  -0.474
  447    HA   VAL  60           HA       VAL  60   3.690  -6.465  -0.369
  448    HB   VAL  60           HB       VAL  60   2.865  -4.344  -0.621
  449   1HG1  VAL  60          1HG1      VAL  60   0.367  -5.143   0.862
  450   2HG1  VAL  60          2HG1      VAL  60   0.687  -3.547   0.184
  451   3HG1  VAL  60          3HG1      VAL  60   0.538  -4.943  -0.884
  452   1HG2  VAL  60          1HG2      VAL  60   3.823  -4.778   1.790
  453   2HG2  VAL  60          2HG2      VAL  60   3.152  -3.210   1.347
  454   3HG2  VAL  60          3HG2      VAL  60   2.183  -4.352   2.278
  455    H    LYS  61           H        LYS  61   4.634  -6.595   1.658
  456    HA   LYS  61           HA       LYS  61   3.114  -7.489   3.946
  457   1HB   LYS  61          1HB       LYS  61   4.820  -9.500   4.112
  458   2HB   LYS  61          2HB       LYS  61   3.317  -9.658   3.214
  459   1HG   LYS  61          1HG       LYS  61   5.634  -8.675   1.681
  460   2HG   LYS  61          2HG       LYS  61   5.721 -10.346   2.242
  461   1HD   LYS  61          1HD       LYS  61   3.169  -9.495   1.015
  462   2HD   LYS  61          2HD       LYS  61   4.558  -9.627  -0.066
  463   1HE   LYS  61          1HE       LYS  61   4.495 -11.855  -0.018
  464   2HE   LYS  61          2HE       LYS  61   4.373 -11.885   1.740
  465   1HZ   LYS  61          1HZ       LYS  61   1.975 -11.402   1.483
  466   2HZ   LYS  61          2HZ       LYS  61   2.144 -11.559  -0.193
  467   3HZ   LYS  61          3HZ       LYS  61   2.431 -12.888   0.814
  468    H    VAL  62           H        VAL  62   5.003  -8.326   5.631
  469    HA   VAL  62           HA       VAL  62   6.728  -5.980   5.870
  470    HB   VAL  62           HB       VAL  62   6.123  -8.133   7.901
  471   1HG1  VAL  62          1HG1      VAL  62   7.588  -5.509   8.129
  472   2HG1  VAL  62          2HG1      VAL  62   7.062  -6.476   9.507
  473   3HG1  VAL  62          3HG1      VAL  62   8.246  -7.127   8.374
  474   1HG2  VAL  62          1HG2      VAL  62   4.170  -6.734   7.228
  475   2HG2  VAL  62          2HG2      VAL  62   4.618  -6.575   8.927
  476   3HG2  VAL  62          3HG2      VAL  62   5.062  -5.314   7.776
  477    H    GLY  63           H        GLY  63   8.200  -6.753   4.191
  478   1HA   GLY  63          1HA       GLY  63   9.936  -8.958   5.104
  479   2HA   GLY  63          2HA       GLY  63  10.623  -7.412   4.634
  480    H    ASP  64           H        ASP  64   9.147  -6.812   2.380
  481    HA   ASP  64           HA       ASP  64  10.034  -8.940   0.552
  482   1HB   ASP  64          1HB       ASP  64   8.064  -8.373  -0.900
  483   2HB   ASP  64          2HB       ASP  64   7.645  -9.143   0.629
  484    H    LYS  65           H        LYS  65  10.122  -8.075  -1.768
  485    HA   LYS  65           HA       LYS  65  11.627  -5.583  -1.698
  486   1HB   LYS  65          1HB       LYS  65  11.441  -7.884  -3.593
  487   2HB   LYS  65          2HB       LYS  65  11.985  -6.328  -4.204
  488   1HG   LYS  65          1HG       LYS  65  13.418  -6.788  -1.833
  489   2HG   LYS  65          2HG       LYS  65  13.440  -8.303  -2.739
  490   1HD   LYS  65          1HD       LYS  65  14.615  -7.401  -4.482
  491   2HD   LYS  65          2HD       LYS  65  13.968  -5.781  -4.221
  492   1HE   LYS  65          1HE       LYS  65  15.408  -5.430  -2.349
  493   2HE   LYS  65          2HE       LYS  65  15.921  -7.118  -2.358
  494   1HZ   LYS  65          1HZ       LYS  65  16.376  -5.712  -4.839
  495   2HZ   LYS  65          2HZ       LYS  65  17.261  -5.110  -3.530
  496   3HZ   LYS  65          3HZ       LYS  65  17.404  -6.737  -3.969
  497    H    ILE  66           H        ILE  66  10.590  -3.742  -2.079
  498    HA   ILE  66           HA       ILE  66   8.520  -3.732  -4.154
  499    HB   ILE  66           HB       ILE  66   8.000  -3.462  -1.440
  500   1HG1  ILE  66          1HG1      ILE  66   5.717  -2.952  -2.199
  501   2HG1  ILE  66          2HG1      ILE  66   6.343  -2.608  -3.812
  502   1HG2  ILE  66          1HG2      ILE  66   7.972  -0.730  -2.695
  503   2HG2  ILE  66          2HG2      ILE  66   6.970  -1.163  -1.316
  504   3HG2  ILE  66          3HG2      ILE  66   8.726  -1.238  -1.184
  505   1HD1  ILE  66          1HD1      ILE  66   7.292  -5.155  -3.014
  506   2HD1  ILE  66          2HD1      ILE  66   5.551  -5.088  -2.725
  507   3HD1  ILE  66          3HD1      ILE  66   6.194  -4.746  -4.332
  508    H    SER  67           H        SER  67   8.066  -1.602  -5.069
  509    HA   SER  67           HA       SER  67  10.172   0.390  -4.739
  510   1HB   SER  67          1HB       SER  67   9.738   0.244  -7.525
  511   2HB   SER  67          2HB       SER  67  11.215  -0.143  -6.645
  512    HG   SER  67           HG       SER  67  10.878  -2.150  -7.120
  513    H    GLU  68           H        GLU  68   9.595   2.465  -5.389
  514    HA   GLU  68           HA       GLU  68   7.024   3.318  -4.991
  515   1HB   GLU  68          1HB       GLU  68   8.789   4.911  -4.961
  516   2HB   GLU  68          2HB       GLU  68   9.264   4.526  -6.609
  517   1HG   GLU  68          1HG       GLU  68   7.050   5.429  -7.352
  518   2HG   GLU  68          2HG       GLU  68   6.812   6.002  -5.701
  519    H    GLY  69           H        GLY  69   5.371   2.286  -6.036
  520   1HA   GLY  69          1HA       GLY  69   5.181   2.764  -8.925
  521   2HA   GLY  69          2HA       GLY  69   3.833   2.435  -7.849
  522    H    GLY  70           H        GLY  70   4.017   0.173  -6.746
  523   1HA   GLY  70          1HA       GLY  70   5.117  -2.062  -7.205
  524   2HA   GLY  70          2HA       GLY  70   4.740  -1.733  -8.889
  525    H    LEU  71           H        LEU  71   2.141  -0.514  -8.169
  526    HA   LEU  71           HA       LEU  71  -0.024  -1.086  -7.672
  527   1HB   LEU  71          1HB       LEU  71   0.237  -2.087  -9.859
  528   2HB   LEU  71          2HB       LEU  71   0.931  -3.535  -9.153
  529    HG   LEU  71           HG       LEU  71  -1.207  -4.068  -8.091
  530   1HD1  LEU  71          1HD1      LEU  71  -2.121  -1.515  -9.395
  531   2HD1  LEU  71          2HD1      LEU  71  -3.222  -2.746  -8.777
  532   3HD1  LEU  71          3HD1      LEU  71  -2.126  -1.910  -7.675
  533   1HD2  LEU  71          1HD2      LEU  71  -0.571  -4.529 -10.616
  534   2HD2  LEU  71          2HD2      LEU  71  -2.145  -4.979  -9.960
  535   3HD2  LEU  71          3HD2      LEU  71  -1.973  -3.499 -10.904
  536    H    ILE  72           H        ILE  72   0.549  -1.183  -5.362
  537    HA   ILE  72           HA       ILE  72   1.093  -3.638  -4.080
  538    HB   ILE  72           HB       ILE  72   0.390  -0.893  -3.232
  539   1HG1  ILE  72          1HG1      ILE  72   2.260  -2.610  -1.720
  540   2HG1  ILE  72          2HG1      ILE  72   2.668  -2.323  -3.410
  541   1HG2  ILE  72          1HG2      ILE  72  -0.399  -3.275  -1.625
  542   2HG2  ILE  72          2HG2      ILE  72   0.327  -1.902  -0.785
  543   3HG2  ILE  72          3HG2      ILE  72  -1.148  -1.681  -1.727
  544   1HD1  ILE  72          1HD1      ILE  72   1.951   0.165  -2.350
  545   2HD1  ILE  72          2HD1      ILE  72   2.987  -0.608  -1.151
  546   3HD1  ILE  72          3HD1      ILE  72   3.558  -0.398  -2.805
  547    H    VAL  73           H        VAL  73  -1.891  -1.749  -3.564
  548    HA   VAL  73           HA       VAL  73  -3.415  -4.256  -3.838
  549    HB   VAL  73           HB       VAL  73  -4.815  -3.671  -1.961
  550   1HG1  VAL  73          1HG1      VAL  73  -2.055  -4.288  -1.762
  551   2HG1  VAL  73          2HG1      VAL  73  -2.472  -3.227  -0.416
  552   3HG1  VAL  73          3HG1      VAL  73  -3.362  -4.730  -0.664
  553   1HG2  VAL  73          1HG2      VAL  73  -4.751  -1.235  -2.207
  554   2HG2  VAL  73          2HG2      VAL  73  -4.376  -1.725  -0.555
  555   3HG2  VAL  73          3HG2      VAL  73  -3.081  -1.221  -1.640
  556    H    VAL  74           H        VAL  74  -5.536  -4.084  -4.599
  557    HA   VAL  74           HA       VAL  74  -6.117  -1.569  -6.015
  558    HB   VAL  74           HB       VAL  74  -7.304  -4.328  -6.416
  559   1HG1  VAL  74          1HG1      VAL  74  -8.664  -2.177  -6.990
  560   2HG1  VAL  74          2HG1      VAL  74  -7.565  -2.081  -8.366
  561   3HG1  VAL  74          3HG1      VAL  74  -8.584  -3.503  -8.148
  562   1HG2  VAL  74          1HG2      VAL  74  -5.134  -2.827  -7.848
  563   2HG2  VAL  74          2HG2      VAL  74  -5.092  -4.458  -7.180
  564   3HG2  VAL  74          3HG2      VAL  74  -6.042  -4.122  -8.627
  565    H    VAL  75           H        VAL  75  -8.055  -0.490  -5.719
  566    HA   VAL  75           HA       VAL  75  -9.788  -1.530  -3.577
  567    HB   VAL  75           HB       VAL  75  -9.393   1.414  -3.956
  568   1HG1  VAL  75          1HG1      VAL  75 -10.825  -0.312  -2.157
  569   2HG1  VAL  75          2HG1      VAL  75  -9.706   0.718  -1.266
  570   3HG1  VAL  75          3HG1      VAL  75 -10.911   1.439  -2.334
  571   1HG2  VAL  75          1HG2      VAL  75  -7.390  -0.459  -3.038
  572   2HG2  VAL  75          2HG2      VAL  75  -7.257   1.274  -3.338
  573   3HG2  VAL  75          3HG2      VAL  75  -7.826   0.692  -1.773
  574    H    GLU  76           H        GLU  76 -11.974  -0.911  -3.611
  575    HA   GLU  76           HA       GLU  76 -12.972  -0.304  -6.304
  576   1HB   GLU  76          1HB       GLU  76 -13.757  -2.415  -5.375
  577   2HB   GLU  76          2HB       GLU  76 -14.322  -1.601  -3.921
  578   1HG   GLU  76          1HG       GLU  76 -16.256  -1.058  -4.866
  579   2HG   GLU  76          2HG       GLU  76 -15.468  -0.456  -6.323
  580    H    ALA  77           H        ALA  77 -12.000   1.849  -4.960
  581    HA   ALA  77           HA       ALA  77 -13.396   3.293  -3.220
  582   1HB   ALA  77          1HB       ALA  77 -11.379   4.122  -4.182
  583   2HB   ALA  77          2HB       ALA  77 -12.159   4.319  -5.751
  584   3HB   ALA  77          3HB       ALA  77 -12.646   5.329  -4.390
  585    H    GLU  78           H        GLU  78 -15.008   4.902  -3.247
  586    HA   GLU  78           HA       GLU  78 -17.165   5.533  -3.610
  587   1HB   GLU  78          1HB       GLU  78 -15.570   6.310  -5.734
  588   2HB   GLU  78          2HB       GLU  78 -16.974   5.592  -6.517
  589   1HG   GLU  78          1HG       GLU  78 -17.309   7.596  -4.327
  590   2HG   GLU  78          2HG       GLU  78 -16.973   8.112  -5.979
  591    H    GLY  79           H        GLY  79 -17.043   2.841  -3.261
  592   1HA   GLY  79          1HA       GLY  79 -18.107   0.850  -3.695
  593   2HA   GLY  79          2HA       GLY  79 -18.265   1.362  -5.369
  594    H    THR  80           H        THR  80 -20.262   1.701  -6.080
  595    HA   THR  80           HA       THR  80 -22.265   3.076  -4.671
  596    HB   THR  80           HB       THR  80 -23.796   2.199  -6.441
  597    HG1  THR  80           HG1      THR  80 -23.202   0.364  -7.252
  598   1HG2  THR  80          1HG2      THR  80 -21.698   3.976  -6.771
  599   2HG2  THR  80          2HG2      THR  80 -21.596   2.899  -8.165
  600   3HG2  THR  80          3HG2      THR  80 -23.092   3.769  -7.831
  601    H    ALA  81           H        ALA  81 -24.265   2.308  -3.817
  602    HA   ALA  81           HA       ALA  81 -25.507   1.007  -2.422
  603   1HB   ALA  81          1HB       ALA  81 -25.115  -0.440  -4.721
  604   2HB   ALA  81          2HB       ALA  81 -24.632  -1.574  -3.460
  605   3HB   ALA  81          3HB       ALA  81 -26.241  -0.850  -3.427

  No H/Q in entry =         605
  Start of MODEL   14
    1    H1   ALA   1           H1       ALA   1 -14.745   4.752  -9.210
    2    H2   ALA   1           H2       ALA   1 -13.894   5.284 -10.600
    3    H3   ALA   1           H3       ALA   1 -15.511   4.727 -10.746
    4    HA   ALA   1           HA       ALA   1 -14.962   2.572 -10.446
    5   1HB   ALA   1          1HB       ALA   1 -13.953   2.383 -12.411
    6   2HB   ALA   1          2HB       ALA   1 -12.413   2.865 -11.699
    7   3HB   ALA   1          3HB       ALA   1 -13.514   4.089 -12.331
    8    H    LEU   2           H        LEU   2 -12.670   1.165 -10.371
    9    HA   LEU   2           HA       LEU   2 -11.948   1.334  -7.596
   10   1HB   LEU   2          1HB       LEU   2 -10.461  -0.461  -9.433
   11   2HB   LEU   2          2HB       LEU   2 -11.090  -0.773  -7.827
   12    HG   LEU   2           HG       LEU   2 -12.622  -0.787 -10.423
   13   1HD1  LEU   2          1HD1      LEU   2 -11.316  -2.784  -8.832
   14   2HD1  LEU   2          2HD1      LEU   2 -13.051  -3.096  -8.895
   15   3HD1  LEU   2          3HD1      LEU   2 -12.127  -2.948 -10.390
   16   1HD2  LEU   2          1HD2      LEU   2 -13.759   0.245  -8.294
   17   2HD2  LEU   2          2HD2      LEU   2 -14.626  -0.904  -9.310
   18   3HD2  LEU   2          3HD2      LEU   2 -13.887  -1.444  -7.805
   19    H    VAL   3           H        VAL   3  -9.550   1.005  -7.034
   20    HA   VAL   3           HA       VAL   3  -7.881   2.816  -8.645
   21    HB   VAL   3           HB       VAL   3  -8.427   2.887  -5.695
   22   1HG1  VAL   3          1HG1      VAL   3  -5.998   2.656  -5.839
   23   2HG1  VAL   3          2HG1      VAL   3  -5.935   4.009  -6.972
   24   3HG1  VAL   3          3HG1      VAL   3  -6.458   4.276  -5.309
   25   1HG2  VAL   3          1HG2      VAL   3  -8.393   4.846  -7.951
   26   2HG2  VAL   3          2HG2      VAL   3  -9.687   4.474  -6.813
   27   3HG2  VAL   3          3HG2      VAL   3  -8.282   5.395  -6.279
   28    H    GLU   4           H        GLU   4  -5.545   2.552  -8.225
   29    HA   GLU   4           HA       GLU   4  -4.865  -0.192  -7.402
   30   1HB   GLU   4          1HB       GLU   4  -3.753   1.389  -9.727
   31   2HB   GLU   4          2HB       GLU   4  -3.079  -0.130  -9.154
   32   1HG   GLU   4          1HG       GLU   4  -5.184  -1.258  -9.665
   33   2HG   GLU   4          2HG       GLU   4  -5.857   0.266 -10.241
   34    H    LEU   5           H        LEU   5  -4.221   0.472  -5.343
   35    HA   LEU   5           HA       LEU   5  -2.668   2.640  -4.658
   36   1HB   LEU   5          1HB       LEU   5  -3.493   0.204  -3.423
   37   2HB   LEU   5          2HB       LEU   5  -1.794   0.452  -3.067
   38    HG   LEU   5           HG       LEU   5  -3.117   1.404  -1.296
   39   1HD1  LEU   5          1HD1      LEU   5  -1.889   3.483  -3.096
   40   2HD1  LEU   5          2HD1      LEU   5  -2.387   3.781  -1.431
   41   3HD1  LEU   5          3HD1      LEU   5  -1.112   2.611  -1.774
   42   1HD2  LEU   5          1HD2      LEU   5  -4.502   2.926  -3.496
   43   2HD2  LEU   5          2HD2      LEU   5  -5.212   1.753  -2.388
   44   3HD2  LEU   5          3HD2      LEU   5  -4.653   3.313  -1.782
   45    H    LYS   6           H        LYS   6  -0.439   2.941  -4.268
   46    HA   LYS   6           HA       LYS   6   1.383   1.025  -5.521
   47   1HB   LYS   6          1HB       LYS   6   1.205   3.959  -6.211
   48   2HB   LYS   6          2HB       LYS   6   2.573   2.940  -6.635
   49   1HG   LYS   6          1HG       LYS   6   0.357   1.543  -7.555
   50   2HG   LYS   6          2HG       LYS   6   0.017   3.232  -7.939
   51   1HD   LYS   6          1HD       LYS   6   2.124   3.431  -9.107
   52   2HD   LYS   6          2HD       LYS   6   2.577   1.792  -8.634
   53   1HE   LYS   6          1HE       LYS   6  -0.004   1.989 -10.010
   54   2HE   LYS   6          2HE       LYS   6   1.380   2.473 -10.989
   55   1HZ   LYS   6          1HZ       LYS   6   1.296  -0.080  -9.488
   56   2HZ   LYS   6          2HZ       LYS   6   0.760   0.058 -11.085
   57   3HZ   LYS   6          3HZ       LYS   6   2.378   0.373 -10.708
   58    H    VAL   7           H        VAL   7   3.516   1.139  -4.809
   59    HA   VAL   7           HA       VAL   7   3.984   1.561  -2.143
   60    HB   VAL   7           HB       VAL   7   5.977   1.761  -4.402
   61   1HG1  VAL   7          1HG1      VAL   7   6.718   2.687  -2.157
   62   2HG1  VAL   7          2HG1      VAL   7   6.591   1.035  -1.553
   63   3HG1  VAL   7          3HG1      VAL   7   7.718   1.413  -2.854
   64   1HG2  VAL   7          1HG2      VAL   7   4.634  -0.338  -4.271
   65   2HG2  VAL   7          2HG2      VAL   7   6.371  -0.571  -4.087
   66   3HG2  VAL   7          3HG2      VAL   7   5.321  -0.612  -2.672
   67    HA   PRO   8           HA       PRO   8   4.196   5.968  -1.702
   68   1HB   PRO   8          1HB       PRO   8   5.465   6.131   0.675
   69   2HB   PRO   8          2HB       PRO   8   3.782   5.605   0.531
   70   1HG   PRO   8          1HG       PRO   8   6.262   3.952   0.856
   71   2HG   PRO   8          2HG       PRO   8   4.683   3.767   1.642
   72   1HD   PRO   8          1HD       PRO   8   5.464   2.266  -0.486
   73   2HD   PRO   8          2HD       PRO   8   3.768   2.680  -0.169
   74    H    ASP   9           H        ASP   9   6.071   7.480  -0.560
   75    HA   ASP   9           HA       ASP   9   8.331   7.214  -2.389
   76   1HB   ASP   9          1HB       ASP   9   6.862   9.404  -1.159
   77   2HB   ASP   9          2HB       ASP   9   8.605   9.606  -1.005
   78    H    ILE  10           H        ILE  10   9.292   5.465  -1.130
   79    HA   ILE  10           HA       ILE  10  10.246   6.071   1.529
   80    HB   ILE  10           HB       ILE  10  11.572   3.855   1.116
   81   1HG1  ILE  10          1HG1      ILE  10  10.594   2.357  -0.497
   82   2HG1  ILE  10          2HG1      ILE  10   9.368   3.542  -0.931
   83   1HG2  ILE  10          1HG2      ILE  10   9.489   4.360   2.542
   84   2HG2  ILE  10          2HG2      ILE  10   8.598   3.554   1.249
   85   3HG2  ILE  10          3HG2      ILE  10   9.852   2.685   2.132
   86   1HD1  ILE  10          1HD1      ILE  10  12.320   3.883  -1.397
   87   2HD1  ILE  10          2HD1      ILE  10  11.161   3.322  -2.602
   88   3HD1  ILE  10          3HD1      ILE  10  11.029   4.953  -1.944
   89    H    GLY  11           H        GLY  11  11.253   8.053   0.232
   90   1HA   GLY  11          1HA       GLY  11  14.102   7.368  -0.063
   91   2HA   GLY  11          2HA       GLY  11  13.481   8.940   0.418
   92    H    GLY  12           H        GLY  12  13.995   6.752  -2.271
   93   1HA   GLY  12          1HA       GLY  12  14.434   8.924  -4.067
   94   2HA   GLY  12          2HA       GLY  12  12.879   8.161  -4.364
   95    H    HIS  13           H        HIS  13  13.660   5.497  -3.718
   96    HA   HIS  13           HA       HIS  13  15.036   4.846  -6.189
   97   1HB   HIS  13          1HB       HIS  13  16.440   3.136  -4.779
   98   2HB   HIS  13          2HB       HIS  13  16.988   4.800  -4.948
   99    HD1  HIS  13           HD1      HIS  13  16.396   6.397  -2.847
  100    HD2  HIS  13           HD2      HIS  13  16.111   2.302  -2.207
  101    HE1  HIS  13           HE1      HIS  13  16.407   6.106  -0.351
  102    HE2  HIS  13           HE2      HIS  13  16.331   3.614   0.011
  103    H    GLU  14           H        GLU  14  15.254   2.266  -6.201
  104    HA   GLU  14           HA       GLU  14  12.588   1.258  -5.455
  105   1HB   GLU  14          1HB       GLU  14  14.358   0.066  -7.574
  106   2HB   GLU  14          2HB       GLU  14  12.627  -0.144  -7.350
  107   1HG   GLU  14          1HG       GLU  14  12.181   1.572  -8.671
  108   2HG   GLU  14          2HG       GLU  14  13.251   2.629  -7.751
  109    H    ASN  15           H        ASN  15  12.906  -1.378  -5.776
  110    HA   ASN  15           HA       ASN  15  13.368  -3.209  -4.498
  111   1HB   ASN  15          1HB       ASN  15  15.704  -3.876  -4.504
  112   2HB   ASN  15          2HB       ASN  15  15.287  -3.151  -6.052
  113   1HD2  ASN  15          2HD2      ASN  15  16.026  -1.037  -6.512
  114   2HD2  ASN  15          1HD2      ASN  15  17.411  -0.390  -5.708
  115    H    VAL  16           H        VAL  16  12.323  -2.023  -2.666
  116    HA   VAL  16           HA       VAL  16  14.259  -1.676  -0.470
  117    HB   VAL  16           HB       VAL  16  12.769  -0.072   0.581
  118   1HG1  VAL  16          1HG1      VAL  16  14.050   0.353  -1.971
  119   2HG1  VAL  16          2HG1      VAL  16  12.711   1.475  -1.725
  120   3HG1  VAL  16          3HG1      VAL  16  14.015   1.385  -0.541
  121   1HG2  VAL  16          1HG2      VAL  16  10.843  -1.169  -1.175
  122   2HG2  VAL  16          2HG2      VAL  16  10.608   0.040   0.088
  123   3HG2  VAL  16          3HG2      VAL  16  10.989   0.547  -1.558
  124    H    ASP  17           H        ASP  17  12.580  -1.644   1.679
  125    HA   ASP  17           HA       ASP  17  11.092  -4.175   1.467
  126   1HB   ASP  17          1HB       ASP  17  13.478  -3.807   2.863
  127   2HB   ASP  17          2HB       ASP  17  12.228  -3.755   4.104
  128    H    ILE  18           H        ILE  18   9.049  -4.036   2.115
  129    HA   ILE  18           HA       ILE  18   7.904  -1.678   3.114
  130    HB   ILE  18           HB       ILE  18   6.892  -4.522   3.017
  131   1HG1  ILE  18          1HG1      ILE  18   5.686  -2.285   1.488
  132   2HG1  ILE  18          2HG1      ILE  18   7.289  -2.820   0.991
  133   1HG2  ILE  18          1HG2      ILE  18   5.401  -2.048   3.880
  134   2HG2  ILE  18          2HG2      ILE  18   4.640  -3.585   3.469
  135   3HG2  ILE  18          3HG2      ILE  18   5.732  -3.485   4.848
  136   1HD1  ILE  18          1HD1      ILE  18   5.490  -5.043   1.410
  137   2HD1  ILE  18          2HD1      ILE  18   4.875  -3.903   0.214
  138   3HD1  ILE  18          3HD1      ILE  18   6.470  -4.628   0.005
  139    H    ILE  19           H        ILE  19   6.703  -1.513   5.223
  140    HA   ILE  19           HA       ILE  19   8.169  -2.960   7.334
  141    HB   ILE  19           HB       ILE  19   9.002  -1.147   8.309
  142   1HG1  ILE  19          1HG1      ILE  19   6.441   0.417   7.949
  143   2HG1  ILE  19          2HG1      ILE  19   6.754  -0.657   9.304
  144   1HG2  ILE  19          1HG2      ILE  19   8.983  -0.539   5.724
  145   2HG2  ILE  19          2HG2      ILE  19   8.024   0.815   6.321
  146   3HG2  ILE  19          3HG2      ILE  19   9.645   0.537   6.949
  147   1HD1  ILE  19          1HD1      ILE  19   8.733   0.743   9.854
  148   2HD1  ILE  19          2HD1      ILE  19   8.205   1.874   8.608
  149   3HD1  ILE  19          3HD1      ILE  19   7.178   1.562  10.007
  150    H    ALA  20           H        ALA  20   5.145  -2.108   6.099
  151    HA   ALA  20           HA       ALA  20   3.867  -3.323   8.408
  152   1HB   ALA  20          1HB       ALA  20   3.988  -0.746   8.637
  153   2HB   ALA  20          2HB       ALA  20   2.707  -0.751   7.423
  154   3HB   ALA  20          3HB       ALA  20   2.463  -1.572   8.966
  155    H    VAL  21           H        VAL  21   1.718  -4.064   7.992
  156    HA   VAL  21           HA       VAL  21   0.765  -3.920   5.244
  157    HB   VAL  21           HB       VAL  21   2.223  -5.895   5.262
  158   1HG1  VAL  21          1HG1      VAL  21   1.323  -6.252   7.838
  159   2HG1  VAL  21          2HG1      VAL  21   0.516  -7.544   6.948
  160   3HG1  VAL  21          3HG1      VAL  21   2.274  -7.406   6.904
  161   1HG2  VAL  21          1HG2      VAL  21   0.128  -5.815   3.902
  162   2HG2  VAL  21          2HG2      VAL  21   0.676  -7.445   4.299
  163   3HG2  VAL  21          3HG2      VAL  21  -0.673  -6.727   5.182
  164    H    GLU  22           H        GLU  22  -1.290  -3.335   5.407
  165    HA   GLU  22           HA       GLU  22  -2.902  -4.470   7.598
  166   1HB   GLU  22          1HB       GLU  22  -3.252  -1.775   6.275
  167   2HB   GLU  22          2HB       GLU  22  -4.228  -2.419   7.590
  168   1HG   GLU  22          1HG       GLU  22  -1.452  -2.480   8.303
  169   2HG   GLU  22          2HG       GLU  22  -1.912  -0.863   7.773
  170    H    VAL  23           H        VAL  23  -2.738  -3.678   4.197
  171    HA   VAL  23           HA       VAL  23  -5.432  -4.156   3.531
  172    HB   VAL  23           HB       VAL  23  -4.534  -4.598   1.214
  173   1HG1  VAL  23          1HG1      VAL  23  -4.513  -2.187   2.770
  174   2HG1  VAL  23          2HG1      VAL  23  -3.250  -2.126   1.541
  175   3HG1  VAL  23          3HG1      VAL  23  -4.924  -2.416   1.070
  176   1HG2  VAL  23          1HG2      VAL  23  -2.155  -5.057   2.609
  177   2HG2  VAL  23          2HG2      VAL  23  -2.375  -4.998   0.860
  178   3HG2  VAL  23          3HG2      VAL  23  -1.907  -3.543   1.740
  179    H    ASN  24           H        ASN  24  -6.569  -5.969   3.308
  180    HA   ASN  24           HA       ASN  24  -5.173  -8.519   2.940
  181   1HB   ASN  24          1HB       ASN  24  -7.043  -7.801   5.172
  182   2HB   ASN  24          2HB       ASN  24  -6.902  -9.468   4.625
  183   1HD2  ASN  24          2HD2      ASN  24  -5.714 -10.540   6.026
  184   2HD2  ASN  24          1HD2      ASN  24  -4.224 -10.003   6.720
  185    H    VAL  25           H        VAL  25  -7.172  -6.542   1.543
  186    HA   VAL  25           HA       VAL  25  -8.820  -6.717  -0.011
  187    HB   VAL  25           HB       VAL  25  -8.243  -9.671   0.216
  188   1HG1  VAL  25          1HG1      VAL  25 -10.465  -9.193  -0.750
  189   2HG1  VAL  25          2HG1      VAL  25  -9.692  -8.187  -1.974
  190   3HG1  VAL  25          3HG1      VAL  25  -9.360  -9.917  -1.918
  191   1HG2  VAL  25          1HG2      VAL  25  -6.397  -8.040  -0.508
  192   2HG2  VAL  25          2HG2      VAL  25  -6.721  -9.438  -1.534
  193   3HG2  VAL  25          3HG2      VAL  25  -7.341  -7.849  -1.985
  194    H    GLY  26           H        GLY  26 -10.849  -6.259   0.515
  195   1HA   GLY  26          1HA       GLY  26 -12.356  -8.207   2.129
  196   2HA   GLY  26          2HA       GLY  26 -13.067  -7.041   1.023
  197    H    ASP  27           H        ASP  27 -10.843  -5.212   2.438
  198    HA   ASP  27           HA       ASP  27 -12.404  -4.665   4.861
  199   1HB   ASP  27          1HB       ASP  27  -9.664  -3.636   4.095
  200   2HB   ASP  27          2HB       ASP  27 -10.465  -3.414   5.647
  201    H    THR  28           H        THR  28 -13.133  -2.579   5.343
  202    HA   THR  28           HA       THR  28 -13.822  -1.005   3.023
  203    HB   THR  28           HB       THR  28 -14.425  -0.408   5.923
  204    HG1  THR  28           HG1      THR  28 -16.072  -1.753   5.805
  205   1HG2  THR  28          1HG2      THR  28 -15.152   0.875   3.448
  206   2HG2  THR  28          2HG2      THR  28 -16.572   0.317   4.332
  207   3HG2  THR  28          3HG2      THR  28 -15.415   1.395   5.112
  208    H    ILE  29           H        ILE  29 -12.272   0.262   2.217
  209    HA   ILE  29           HA       ILE  29 -10.422   1.642   4.002
  210    HB   ILE  29           HB       ILE  29  -9.320   2.365   1.867
  211   1HG1  ILE  29          1HG1      ILE  29 -10.479   0.334   0.197
  212   2HG1  ILE  29          2HG1      ILE  29 -11.744   1.420   0.759
  213   1HG2  ILE  29          1HG2      ILE  29  -9.107   0.040   3.251
  214   2HG2  ILE  29          2HG2      ILE  29  -9.399  -0.556   1.617
  215   3HG2  ILE  29          3HG2      ILE  29  -8.040   0.522   1.932
  216   1HD1  ILE  29          1HD1      ILE  29 -10.096   3.284   0.012
  217   2HD1  ILE  29          2HD1      ILE  29  -9.382   1.996  -0.957
  218   3HD1  ILE  29          3HD1      ILE  29 -11.075   2.435  -1.183
  219    H    ALA  30           H        ALA  30 -10.013   3.908   3.819
  220    HA   ALA  30           HA       ALA  30 -12.288   5.462   2.771
  221   1HB   ALA  30          1HB       ALA  30 -10.739   6.272   5.213
  222   2HB   ALA  30          2HB       ALA  30 -12.311   6.850   4.659
  223   3HB   ALA  30          3HB       ALA  30 -12.151   5.220   5.312
  224    H    VAL  31           H        VAL  31 -11.505   7.962   2.931
  225    HA   VAL  31           HA       VAL  31  -9.217   8.074   1.132
  226    HB   VAL  31           HB       VAL  31 -10.969  10.372   1.995
  227   1HG1  VAL  31          1HG1      VAL  31  -8.736  10.034   0.148
  228   2HG1  VAL  31          2HG1      VAL  31 -10.145  10.803  -0.585
  229   3HG1  VAL  31          3HG1      VAL  31  -9.410  11.502   0.859
  230   1HG2  VAL  31          1HG2      VAL  31 -12.164   8.348   0.945
  231   2HG2  VAL  31          2HG2      VAL  31 -12.457   9.943   0.253
  232   3HG2  VAL  31          3HG2      VAL  31 -11.350   8.825  -0.545
  233    H    ASP  32           H        ASP  32  -8.441   7.403   3.686
  234    HA   ASP  32           HA       ASP  32  -6.298   8.949   4.253
  235   1HB   ASP  32          1HB       ASP  32  -7.160  10.226   6.336
  236   2HB   ASP  32          2HB       ASP  32  -7.471  10.919   4.748
  237    H    ASP  33           H        ASP  33  -6.118   6.526   4.503
  238    HA   ASP  33           HA       ASP  33  -6.132   5.914   7.350
  239   1HB   ASP  33          1HB       ASP  33  -7.098   3.604   6.801
  240   2HB   ASP  33          2HB       ASP  33  -8.226   4.957   6.835
  241    H    THR  34           H        THR  34  -4.168   5.201   7.826
  242    HA   THR  34           HA       THR  34  -2.206   4.593   5.958
  243    HB   THR  34           HB       THR  34  -1.272   3.286   8.089
  244    HG1  THR  34           HG1      THR  34  -2.086   4.179   9.947
  245   1HG2  THR  34          1HG2      THR  34  -0.303   5.295   7.015
  246   2HG2  THR  34          2HG2      THR  34  -1.389   6.280   7.998
  247   3HG2  THR  34          3HG2      THR  34  -0.166   5.274   8.774
  248    H    LEU  35           H        LEU  35  -2.106   3.001   4.595
  249    HA   LEU  35           HA       LEU  35  -3.435   0.472   5.142
  250   1HB   LEU  35          1HB       LEU  35  -2.007   1.542   2.705
  251   2HB   LEU  35          2HB       LEU  35  -2.685  -0.073   2.798
  252    HG   LEU  35           HG       LEU  35  -4.259   2.494   3.029
  253   1HD1  LEU  35          1HD1      LEU  35  -3.769   0.594   0.765
  254   2HD1  LEU  35          2HD1      LEU  35  -5.229   1.580   0.839
  255   3HD1  LEU  35          3HD1      LEU  35  -3.645   2.353   0.787
  256   1HD2  LEU  35          1HD2      LEU  35  -5.205   0.626   4.322
  257   2HD2  LEU  35          2HD2      LEU  35  -6.220   1.074   2.950
  258   3HD2  LEU  35          3HD2      LEU  35  -5.204  -0.365   2.863
  259    H    ILE  36           H        ILE  36  -0.213   1.760   4.494
  260    HA   ILE  36           HA       ILE  36   0.959  -0.384   6.046
  261    HB   ILE  36           HB       ILE  36   2.670  -0.926   4.302
  262   1HG1  ILE  36          1HG1      ILE  36   2.281  -0.503   1.991
  263   2HG1  ILE  36          2HG1      ILE  36   0.700   0.201   2.307
  264   1HG2  ILE  36          1HG2      ILE  36   0.337  -2.094   4.837
  265   2HG2  ILE  36          2HG2      ILE  36   0.117  -1.778   3.117
  266   3HG2  ILE  36          3HG2      ILE  36   1.496  -2.730   3.672
  267   1HD1  ILE  36          1HD1      ILE  36   3.236   1.445   3.316
  268   2HD1  ILE  36          2HD1      ILE  36   2.597   1.772   1.705
  269   3HD1  ILE  36          3HD1      ILE  36   1.643   2.182   3.132
  270    H    THR  37           H        THR  37   3.505  -0.093   5.784
  271    HA   THR  37           HA       THR  37   4.249   2.709   5.637
  272    HB   THR  37           HB       THR  37   4.631   1.004   8.109
  273    HG1  THR  37           HG1      THR  37   3.336   2.448   9.069
  274   1HG2  THR  37          1HG2      THR  37   6.665   2.349   7.525
  275   2HG2  THR  37          2HG2      THR  37   5.669   3.792   7.709
  276   3HG2  THR  37          3HG2      THR  37   5.931   2.720   9.085
  277    H    LEU  38           H        LEU  38   6.021   2.785   4.411
  278    HA   LEU  38           HA       LEU  38   7.706   0.377   4.304
  279   1HB   LEU  38          1HB       LEU  38   7.013   2.440   2.239
  280   2HB   LEU  38          2HB       LEU  38   8.407   1.392   2.050
  281    HG   LEU  38           HG       LEU  38   6.512  -0.457   2.559
  282   1HD1  LEU  38          1HD1      LEU  38   5.057   1.924   2.093
  283   2HD1  LEU  38          2HD1      LEU  38   4.823   0.866   0.702
  284   3HD1  LEU  38          3HD1      LEU  38   4.444   0.287   2.325
  285   1HD2  LEU  38          1HD2      LEU  38   7.657   0.731   0.106
  286   2HD2  LEU  38          2HD2      LEU  38   7.724  -0.927   0.705
  287   3HD2  LEU  38          3HD2      LEU  38   6.268  -0.337  -0.098
  288    H    GLU  39           H        GLU  39   9.996   0.790   3.661
  289    HA   GLU  39           HA       GLU  39  11.193   3.309   4.189
  290   1HB   GLU  39          1HB       GLU  39  10.679   2.804   6.490
  291   2HB   GLU  39          2HB       GLU  39  11.368   1.194   6.336
  292   1HG   GLU  39          1HG       GLU  39  13.579   2.161   6.005
  293   2HG   GLU  39          2HG       GLU  39  12.895   3.780   6.131
  294    H    THR  40           H        THR  40  13.570   3.185   4.130
  295    HA   THR  40           HA       THR  40  14.488   0.774   2.707
  296    HB   THR  40           HB       THR  40  15.717   2.079   1.206
  297    HG1  THR  40           HG1      THR  40  16.790   3.563   2.295
  298   1HG2  THR  40          1HG2      THR  40  13.211   2.361   0.952
  299   2HG2  THR  40          2HG2      THR  40  13.429   3.951   1.682
  300   3HG2  THR  40          3HG2      THR  40  14.238   3.559   0.164
  301    H    ASP  41           H        ASP  41  15.753   3.627   4.396
  302    HA   ASP  41           HA       ASP  41  17.082   2.235   6.418
  303   1HB   ASP  41          1HB       ASP  41  18.467   2.205   3.894
  304   2HB   ASP  41          2HB       ASP  41  19.399   3.120   5.074
  305    H    LYS  42           H        LYS  42  17.060   5.038   4.296
  306    HA   LYS  42           HA       LYS  42  17.847   6.714   6.586
  307   1HB   LYS  42          1HB       LYS  42  18.754   8.307   5.077
  308   2HB   LYS  42          2HB       LYS  42  19.341   6.735   4.555
  309   1HG   LYS  42          1HG       LYS  42  18.742   7.632   2.550
  310   2HG   LYS  42          2HG       LYS  42  17.234   6.828   2.989
  311   1HD   LYS  42          1HD       LYS  42  16.278   8.820   2.618
  312   2HD   LYS  42          2HD       LYS  42  16.957   9.276   4.182
  313   1HE   LYS  42          1HE       LYS  42  18.823   9.527   1.939
  314   2HE   LYS  42          2HE       LYS  42  17.411  10.576   1.821
  315   1HZ   LYS  42          1HZ       LYS  42  18.286  10.756   4.435
  316   2HZ   LYS  42          2HZ       LYS  42  19.685  10.833   3.488
  317   3HZ   LYS  42          3HZ       LYS  42  18.427  11.932   3.227
  318    H    ALA  43           H        ALA  43  15.251   5.886   4.568
  319    HA   ALA  43           HA       ALA  43  13.710   8.131   5.633
  320   1HB   ALA  43          1HB       ALA  43  14.242   7.598   2.771
  321   2HB   ALA  43          2HB       ALA  43  13.952   9.123   3.609
  322   3HB   ALA  43          3HB       ALA  43  12.599   8.066   3.209
  323    H    THR  44           H        THR  44  11.659   7.632   6.189
  324    HA   THR  44           HA       THR  44  10.686   4.933   5.511
  325    HB   THR  44           HB       THR  44   9.874   4.615   7.676
  326    HG1  THR  44           HG1      THR  44   9.650   6.343   9.158
  327   1HG2  THR  44          1HG2      THR  44  12.513   5.133   7.477
  328   2HG2  THR  44          2HG2      THR  44  12.039   6.300   8.710
  329   3HG2  THR  44          3HG2      THR  44  11.713   4.583   8.950
  330    H    MET  45           H        MET  45   8.763   4.850   4.520
  331    HA   MET  45           HA       MET  45   7.069   7.260   4.619
  332   1HB   MET  45          1HB       MET  45   8.208   5.898   2.376
  333   2HB   MET  45          2HB       MET  45   6.458   5.767   2.290
  334   1HG   MET  45          1HG       MET  45   8.118   8.268   2.399
  335   2HG   MET  45          2HG       MET  45   7.089   7.705   1.084
  336   1HE   MET  45          1HE       MET  45   6.300  10.269   1.123
  337   2HE   MET  45          2HE       MET  45   5.024   9.150   0.642
  338   3HE   MET  45          3HE       MET  45   4.666  10.470   1.755
  339    H    ASP  46           H        ASP  46   4.877   6.303   3.286
  340    HA   ASP  46           HA       ASP  46   3.857   3.835   4.101
  341   1HB   ASP  46          1HB       ASP  46   2.261   4.670   5.880
  342   2HB   ASP  46          2HB       ASP  46   3.949   4.566   6.374
  343    H    VAL  47           H        VAL  47   1.331   3.892   4.009
  344    HA   VAL  47           HA       VAL  47   0.521   5.927   2.036
  345    HB   VAL  47           HB       VAL  47  -0.195   2.993   1.975
  346   1HG1  VAL  47          1HG1      VAL  47  -1.643   5.202   1.009
  347   2HG1  VAL  47          2HG1      VAL  47  -0.887   4.451  -0.397
  348   3HG1  VAL  47          3HG1      VAL  47  -1.920   3.495   0.665
  349   1HG2  VAL  47          1HG2      VAL  47   2.135   3.823   1.207
  350   2HG2  VAL  47          2HG2      VAL  47   1.215   2.754   0.148
  351   3HG2  VAL  47          3HG2      VAL  47   1.259   4.487  -0.174
  352    HA   PRO  48           HA       PRO  48  -2.828   6.174   5.055
  353   1HB   PRO  48          1HB       PRO  48  -3.454   8.720   4.667
  354   2HB   PRO  48          2HB       PRO  48  -1.917   8.289   5.429
  355   1HG   PRO  48          1HG       PRO  48  -2.463   9.171   2.630
  356   2HG   PRO  48          2HG       PRO  48  -1.096   9.569   3.685
  357   1HD   PRO  48          1HD       PRO  48  -1.123   7.597   1.687
  358   2HD   PRO  48          2HD       PRO  48   0.082   7.757   2.978
  359    H    ALA  49           H        ALA  49  -3.142   5.171   2.228
  360    HA   ALA  49           HA       ALA  49  -4.797   4.746   0.722
  361   1HB   ALA  49          1HB       ALA  49  -7.158   5.466   2.012
  362   2HB   ALA  49          2HB       ALA  49  -6.059   4.989   3.306
  363   3HB   ALA  49          3HB       ALA  49  -6.405   3.872   1.985
  364    H    GLU  50           H        GLU  50  -6.584   5.725  -0.572
  365    HA   GLU  50           HA       GLU  50  -7.027   8.548  -0.369
  366   1HB   GLU  50          1HB       GLU  50  -4.764   8.456  -1.396
  367   2HB   GLU  50          2HB       GLU  50  -5.443   7.537  -2.732
  368   1HG   GLU  50          1HG       GLU  50  -6.668   9.360  -3.519
  369   2HG   GLU  50          2HG       GLU  50  -6.505  10.239  -1.999
  370    H    VAL  51           H        VAL  51  -8.811   6.517  -0.302
  371    HA   VAL  51           HA       VAL  51 -10.624   7.221  -2.346
  372    HB   VAL  51           HB       VAL  51 -10.764   4.690  -3.145
  373   1HG1  VAL  51          1HG1      VAL  51 -10.183   7.006  -4.331
  374   2HG1  VAL  51          2HG1      VAL  51  -8.620   6.209  -4.508
  375   3HG1  VAL  51          3HG1      VAL  51 -10.071   5.458  -5.167
  376   1HG2  VAL  51          1HG2      VAL  51  -7.898   5.061  -2.309
  377   2HG2  VAL  51          2HG2      VAL  51  -8.981   3.711  -1.972
  378   3HG2  VAL  51          3HG2      VAL  51  -8.356   3.953  -3.601
  379    H    ALA  52           H        ALA  52 -12.684   5.996  -2.170
  380    HA   ALA  52           HA       ALA  52 -12.983   4.835   0.529
  381   1HB   ALA  52          1HB       ALA  52 -14.900   6.567  -1.005
  382   2HB   ALA  52          2HB       ALA  52 -15.252   5.783   0.536
  383   3HB   ALA  52          3HB       ALA  52 -13.991   7.013   0.441
  384    H    GLY  53           H        GLY  53 -12.778   2.687  -0.278
  385   1HA   GLY  53          1HA       GLY  53 -14.018   1.479  -2.371
  386   2HA   GLY  53          2HA       GLY  53 -15.300   1.630  -1.187
  387    H    VAL  54           H        VAL  54 -13.740  -0.688  -2.380
  388    HA   VAL  54           HA       VAL  54 -12.826  -1.918   0.136
  389    HB   VAL  54           HB       VAL  54 -14.578  -3.214  -1.959
  390   1HG1  VAL  54          1HG1      VAL  54 -12.855  -4.318   0.100
  391   2HG1  VAL  54          2HG1      VAL  54 -14.533  -4.823   0.297
  392   3HG1  VAL  54          3HG1      VAL  54 -13.694  -5.127  -1.223
  393   1HG2  VAL  54          1HG2      VAL  54 -15.306  -1.553   0.145
  394   2HG2  VAL  54          2HG2      VAL  54 -16.358  -2.653  -0.745
  395   3HG2  VAL  54          3HG2      VAL  54 -15.592  -3.183   0.753
  396    H    VAL  55           H        VAL  55 -11.063  -3.271  -0.019
  397    HA   VAL  55           HA       VAL  55  -9.499  -3.070  -2.416
  398    HB   VAL  55           HB       VAL  55  -8.923  -4.715   0.046
  399   1HG1  VAL  55          1HG1      VAL  55  -7.729  -5.341  -2.090
  400   2HG1  VAL  55          2HG1      VAL  55  -7.002  -3.733  -2.062
  401   3HG1  VAL  55          3HG1      VAL  55  -6.681  -4.867  -0.750
  402   1HG2  VAL  55          1HG2      VAL  55  -9.192  -2.141   0.242
  403   2HG2  VAL  55          2HG2      VAL  55  -7.770  -2.913   0.946
  404   3HG2  VAL  55          3HG2      VAL  55  -7.646  -2.087  -0.607
  405    H    LYS  56           H        LYS  56  -9.027  -4.572  -3.893
  406    HA   LYS  56           HA       LYS  56 -10.574  -7.073  -3.795
  407   1HB   LYS  56          1HB       LYS  56  -9.356  -6.540  -6.364
  408   2HB   LYS  56          2HB       LYS  56 -11.048  -6.813  -5.972
  409   1HG   LYS  56          1HG       LYS  56 -10.477  -4.184  -5.148
  410   2HG   LYS  56          2HG       LYS  56  -9.720  -4.393  -6.724
  411   1HD   LYS  56          1HD       LYS  56 -11.693  -4.426  -7.773
  412   2HD   LYS  56          2HD       LYS  56 -12.385  -5.546  -6.598
  413   1HE   LYS  56          1HE       LYS  56 -11.957  -2.742  -5.731
  414   2HE   LYS  56          2HE       LYS  56 -13.257  -3.045  -6.882
  415   1HZ   LYS  56          1HZ       LYS  56 -13.392  -4.979  -4.860
  416   2HZ   LYS  56          2HZ       LYS  56 -13.267  -3.463  -4.120
  417   3HZ   LYS  56          3HZ       LYS  56 -14.512  -3.763  -5.226
  418    H    GLU  57           H        GLU  57  -7.489  -5.668  -4.780
  419    HA   GLU  57           HA       GLU  57  -6.295  -8.311  -4.501
  420   1HB   GLU  57          1HB       GLU  57  -5.744  -6.035  -6.324
  421   2HB   GLU  57          2HB       GLU  57  -4.379  -7.026  -5.829
  422   1HG   GLU  57          1HG       GLU  57  -5.725  -9.024  -6.595
  423   2HG   GLU  57          2HG       GLU  57  -6.832  -7.869  -7.337
  424    H    VAL  58           H        VAL  58  -3.963  -8.288  -3.821
  425    HA   VAL  58           HA       VAL  58  -3.122  -6.082  -2.141
  426    HB   VAL  58           HB       VAL  58  -4.567  -7.252  -0.585
  427   1HG1  VAL  58          1HG1      VAL  58  -3.572  -9.563  -1.928
  428   2HG1  VAL  58          2HG1      VAL  58  -3.256  -9.720  -0.198
  429   3HG1  VAL  58          3HG1      VAL  58  -4.900  -9.436  -0.774
  430   1HG2  VAL  58          1HG2      VAL  58  -1.799  -6.821  -0.205
  431   2HG2  VAL  58          2HG2      VAL  58  -3.083  -6.806   1.005
  432   3HG2  VAL  58          3HG2      VAL  58  -2.222  -8.303   0.651
  433    H    LYS  59           H        LYS  59  -1.082  -5.856  -2.705
  434    HA   LYS  59           HA       LYS  59   0.597  -8.258  -2.981
  435   1HB   LYS  59          1HB       LYS  59   1.093  -5.813  -4.637
  436   2HB   LYS  59          2HB       LYS  59   1.581  -7.476  -4.941
  437   1HG   LYS  59          1HG       LYS  59  -1.142  -7.675  -4.978
  438   2HG   LYS  59          2HG       LYS  59  -0.878  -6.073  -5.669
  439   1HD   LYS  59          1HD       LYS  59   0.993  -7.472  -7.007
  440   2HD   LYS  59          2HD       LYS  59  -0.207  -8.738  -6.741
  441   1HE   LYS  59          1HE       LYS  59  -1.774  -6.651  -7.535
  442   2HE   LYS  59          2HE       LYS  59  -0.307  -6.371  -8.474
  443   1HZ   LYS  59          1HZ       LYS  59  -0.486  -8.781  -9.140
  444   2HZ   LYS  59          2HZ       LYS  59  -2.047  -8.766  -8.486
  445   3HZ   LYS  59          3HZ       LYS  59  -1.663  -7.748  -9.780
  446    H    VAL  60           H        VAL  60   1.031  -7.707  -0.701
  447    HA   VAL  60           HA       VAL  60   3.499  -6.385  -0.422
  448    HB   VAL  60           HB       VAL  60   2.576  -4.277  -0.505
  449   1HG1  VAL  60          1HG1      VAL  60   0.141  -5.327   0.923
  450   2HG1  VAL  60          2HG1      VAL  60   0.379  -3.654   0.422
  451   3HG1  VAL  60          3HG1      VAL  60   0.274  -4.931  -0.792
  452   1HG2  VAL  60          1HG2      VAL  60   3.613  -4.856   1.823
  453   2HG2  VAL  60          2HG2      VAL  60   2.811  -3.309   1.570
  454   3HG2  VAL  60          3HG2      VAL  60   1.965  -4.616   2.397
  455    H    LYS  61           H        LYS  61   4.387  -6.619   1.647
  456    HA   LYS  61           HA       LYS  61   2.971  -7.559   3.900
  457   1HB   LYS  61          1HB       LYS  61   3.568  -9.864   3.964
  458   2HB   LYS  61          2HB       LYS  61   2.830  -9.574   2.394
  459   1HG   LYS  61          1HG       LYS  61   4.635 -10.852   1.809
  460   2HG   LYS  61          2HG       LYS  61   5.296  -9.227   1.617
  461   1HD   LYS  61          1HD       LYS  61   6.891  -9.699   3.092
  462   2HD   LYS  61          2HD       LYS  61   5.664 -10.015   4.321
  463   1HE   LYS  61          1HE       LYS  61   6.991 -11.976   4.156
  464   2HE   LYS  61          2HE       LYS  61   5.456 -12.331   3.364
  465   1HZ   LYS  61          1HZ       LYS  61   7.054 -11.344   1.374
  466   2HZ   LYS  61          2HZ       LYS  61   8.091 -12.331   2.276
  467   3HZ   LYS  61          3HZ       LYS  61   6.662 -12.970   1.631
  468    H    VAL  62           H        VAL  62   4.162  -7.090   5.633
  469    HA   VAL  62           HA       VAL  62   6.573  -5.808   5.587
  470    HB   VAL  62           HB       VAL  62   5.753  -7.619   7.854
  471   1HG1  VAL  62          1HG1      VAL  62   8.009  -6.508   7.892
  472   2HG1  VAL  62          2HG1      VAL  62   7.163  -4.961   7.940
  473   3HG1  VAL  62          3HG1      VAL  62   6.955  -6.121   9.251
  474   1HG2  VAL  62          1HG2      VAL  62   4.339  -5.389   6.721
  475   2HG2  VAL  62          2HG2      VAL  62   3.875  -6.446   8.055
  476   3HG2  VAL  62          3HG2      VAL  62   4.858  -5.014   8.365
  477    H    GLY  63           H        GLY  63   8.297  -6.574   4.494
  478   1HA   GLY  63          1HA       GLY  63   9.302  -9.241   5.279
  479   2HA   GLY  63          2HA       GLY  63  10.352  -7.864   4.985
  480    H    ASP  64           H        ASP  64   8.640  -7.062   2.646
  481    HA   ASP  64           HA       ASP  64   9.625  -9.103   0.761
  482   1HB   ASP  64          1HB       ASP  64   7.743  -8.321  -0.745
  483   2HB   ASP  64          2HB       ASP  64   7.244  -9.208   0.693
  484    H    LYS  65           H        LYS  65   9.704  -8.066  -1.558
  485    HA   LYS  65           HA       LYS  65  11.370  -5.674  -1.300
  486   1HB   LYS  65          1HB       LYS  65  11.410  -8.034  -2.986
  487   2HB   LYS  65          2HB       LYS  65  11.495  -6.562  -3.944
  488   1HG   LYS  65          1HG       LYS  65  13.275  -6.139  -1.852
  489   2HG   LYS  65          2HG       LYS  65  13.517  -7.823  -2.323
  490   1HD   LYS  65          1HD       LYS  65  13.408  -6.688  -4.753
  491   2HD   LYS  65          2HD       LYS  65  14.049  -5.332  -3.823
  492   1HE   LYS  65          1HE       LYS  65  15.217  -8.095  -4.097
  493   2HE   LYS  65          2HE       LYS  65  15.902  -6.576  -4.674
  494   1HZ   LYS  65          1HZ       LYS  65  16.110  -5.865  -2.353
  495   2HZ   LYS  65          2HZ       LYS  65  15.527  -7.365  -1.835
  496   3HZ   LYS  65          3HZ       LYS  65  17.000  -7.269  -2.663
  497    H    ILE  66           H        ILE  66  11.070  -3.840  -2.588
  498    HA   ILE  66           HA       ILE  66   8.635  -3.703  -4.194
  499    HB   ILE  66           HB       ILE  66   8.864  -2.571  -1.570
  500   1HG1  ILE  66          1HG1      ILE  66   6.480  -2.034  -1.973
  501   2HG1  ILE  66          2HG1      ILE  66   6.700  -2.444  -3.672
  502   1HG2  ILE  66          1HG2      ILE  66   9.783  -0.577  -2.773
  503   2HG2  ILE  66          2HG2      ILE  66   8.244  -0.461  -3.625
  504   3HG2  ILE  66          3HG2      ILE  66   8.296  -0.279  -1.872
  505   1HD1  ILE  66          1HD1      ILE  66   7.511  -4.498  -1.722
  506   2HD1  ILE  66          2HD1      ILE  66   5.784  -4.161  -1.841
  507   3HD1  ILE  66          3HD1      ILE  66   6.686  -4.659  -3.272
  508    H    SER  67           H        SER  67   8.515  -1.561  -5.391
  509    HA   SER  67           HA       SER  67  11.119  -0.344  -5.893
  510   1HB   SER  67          1HB       SER  67  10.895  -0.655  -8.340
  511   2HB   SER  67          2HB       SER  67  11.045  -2.192  -7.488
  512    HG   SER  67           HG       SER  67   8.931  -2.604  -7.834
  513    H    GLU  68           H        GLU  68   9.190   0.938  -4.583
  514    HA   GLU  68           HA       GLU  68   7.662   2.652  -4.582
  515   1HB   GLU  68          1HB       GLU  68   9.660   3.538  -6.666
  516   2HB   GLU  68          2HB       GLU  68   8.456   4.601  -5.948
  517   1HG   GLU  68          1HG       GLU  68   9.433   4.204  -3.740
  518   2HG   GLU  68          2HG       GLU  68  10.648   3.158  -4.473
  519    H    GLY  69           H        GLY  69   6.451   0.683  -5.941
  520   1HA   GLY  69          1HA       GLY  69   5.515   1.807  -8.482
  521   2HA   GLY  69          2HA       GLY  69   4.336   1.563  -7.202
  522    H    GLY  70           H        GLY  70   4.299  -0.709  -6.273
  523   1HA   GLY  70          1HA       GLY  70   4.942  -3.056  -6.788
  524   2HA   GLY  70          2HA       GLY  70   4.709  -2.639  -8.479
  525    H    LEU  71           H        LEU  71   2.300  -1.066  -7.981
  526    HA   LEU  71           HA       LEU  71   0.043  -1.292  -7.652
  527   1HB   LEU  71          1HB       LEU  71   0.352  -2.476  -9.754
  528   2HB   LEU  71          2HB       LEU  71   0.719  -3.958  -8.894
  529    HG   LEU  71           HG       LEU  71  -1.513  -4.277  -8.238
  530   1HD1  LEU  71          1HD1      LEU  71  -1.692  -1.359  -8.553
  531   2HD1  LEU  71          2HD1      LEU  71  -3.131  -2.261  -9.027
  532   3HD1  LEU  71          3HD1      LEU  71  -2.483  -2.430  -7.396
  533   1HD2  LEU  71          1HD2      LEU  71  -0.863  -4.153 -10.862
  534   2HD2  LEU  71          2HD2      LEU  71  -2.414  -4.725 -10.246
  535   3HD2  LEU  71          3HD2      LEU  71  -2.248  -3.062 -10.810
  536    H    ILE  72           H        ILE  72   0.994  -1.515  -5.264
  537    HA   ILE  72           HA       ILE  72   0.956  -3.814  -3.808
  538    HB   ILE  72           HB       ILE  72   0.272  -0.990  -3.136
  539   1HG1  ILE  72          1HG1      ILE  72   2.208  -2.576  -1.577
  540   2HG1  ILE  72          2HG1      ILE  72   2.586  -2.392  -3.287
  541   1HG2  ILE  72          1HG2      ILE  72  -0.539  -3.321  -1.514
  542   2HG2  ILE  72          2HG2      ILE  72   0.331  -2.048  -0.653
  543   3HG2  ILE  72          3HG2      ILE  72  -1.157  -1.668  -1.519
  544   1HD1  ILE  72          1HD1      ILE  72   1.780   0.081  -1.962
  545   2HD1  ILE  72          2HD1      ILE  72   3.266  -0.638  -1.340
  546   3HD1  ILE  72          3HD1      ILE  72   3.126  -0.243  -3.053
  547    H    VAL  73           H        VAL  73  -1.874  -1.717  -3.382
  548    HA   VAL  73           HA       VAL  73  -3.554  -4.125  -3.650
  549    HB   VAL  73           HB       VAL  73  -5.065  -3.188  -1.969
  550   1HG1  VAL  73          1HG1      VAL  73  -2.383  -4.105  -1.497
  551   2HG1  VAL  73          2HG1      VAL  73  -2.900  -3.026  -0.201
  552   3HG1  VAL  73          3HG1      VAL  73  -3.859  -4.451  -0.598
  553   1HG2  VAL  73          1HG2      VAL  73  -3.016  -0.983  -1.792
  554   2HG2  VAL  73          2HG2      VAL  73  -4.707  -0.835  -2.269
  555   3HG2  VAL  73          3HG2      VAL  73  -4.293  -1.251  -0.605
  556    H    VAL  74           H        VAL  74  -5.852  -3.664  -4.109
  557    HA   VAL  74           HA       VAL  74  -6.252  -1.259  -5.762
  558    HB   VAL  74           HB       VAL  74  -7.107  -4.065  -6.520
  559   1HG1  VAL  74          1HG1      VAL  74  -8.470  -1.885  -7.162
  560   2HG1  VAL  74          2HG1      VAL  74  -7.232  -1.783  -8.413
  561   3HG1  VAL  74          3HG1      VAL  74  -8.250  -3.217  -8.296
  562   1HG2  VAL  74          1HG2      VAL  74  -4.741  -2.437  -7.205
  563   2HG2  VAL  74          2HG2      VAL  74  -4.940  -4.190  -7.157
  564   3HG2  VAL  74          3HG2      VAL  74  -5.528  -3.271  -8.545
  565    H    VAL  75           H        VAL  75  -7.923  -0.162  -4.935
  566    HA   VAL  75           HA       VAL  75 -10.001  -1.649  -3.503
  567    HB   VAL  75           HB       VAL  75 -10.537   0.491  -2.406
  568   1HG1  VAL  75          1HG1      VAL  75  -7.987  -0.941  -2.149
  569   2HG1  VAL  75          2HG1      VAL  75  -8.044   0.639  -1.366
  570   3HG1  VAL  75          3HG1      VAL  75  -9.224  -0.600  -0.940
  571   1HG2  VAL  75          1HG2      VAL  75  -8.754   1.500  -4.423
  572   2HG2  VAL  75          2HG2      VAL  75  -9.860   2.375  -3.367
  573   3HG2  VAL  75          3HG2      VAL  75  -8.228   1.992  -2.815
  574    H    GLU  76           H        GLU  76 -12.188  -0.925  -3.632
  575    HA   GLU  76           HA       GLU  76 -13.058  -0.544  -6.297
  576   1HB   GLU  76          1HB       GLU  76 -14.202  -1.558  -4.054
  577   2HB   GLU  76          2HB       GLU  76 -14.973   0.023  -4.119
  578   1HG   GLU  76          1HG       GLU  76 -15.594  -0.498  -6.498
  579   2HG   GLU  76          2HG       GLU  76 -15.040  -2.145  -6.196
  580    H    ALA  77           H        ALA  77 -12.664   1.608  -3.549
  581    HA   ALA  77           HA       ALA  77 -12.765   3.858  -3.321
  582   1HB   ALA  77          1HB       ALA  77 -11.090   3.804  -5.049
  583   2HB   ALA  77          2HB       ALA  77 -12.337   3.776  -6.293
  584   3HB   ALA  77          3HB       ALA  77 -12.145   5.199  -5.270
  585    H    GLU  78           H        GLU  78 -14.259   5.445  -3.174
  586    HA   GLU  78           HA       GLU  78 -16.434   6.178  -3.049
  587   1HB   GLU  78          1HB       GLU  78 -17.172   7.163  -5.173
  588   2HB   GLU  78          2HB       GLU  78 -15.475   7.489  -4.848
  589   1HG   GLU  78          1HG       GLU  78 -14.850   5.678  -6.384
  590   2HG   GLU  78          2HG       GLU  78 -16.557   5.405  -6.733
  591    H    GLY  79           H        GLY  79 -16.481   3.409  -2.881
  592   1HA   GLY  79          1HA       GLY  79 -17.702   1.622  -4.209
  593   2HA   GLY  79          2HA       GLY  79 -18.986   2.816  -4.327
  594    H    THR  80           H        THR  80 -20.586   2.546  -2.935
  595    HA   THR  80           HA       THR  80 -21.733   2.102  -1.014
  596    HB   THR  80           HB       THR  80 -21.400  -0.109  -0.083
  597    HG1  THR  80           HG1      THR  80 -19.569  -1.202  -0.286
  598   1HG2  THR  80          1HG2      THR  80 -20.902  -0.083  -3.047
  599   2HG2  THR  80          2HG2      THR  80 -21.320  -1.519  -2.113
  600   3HG2  THR  80          3HG2      THR  80 -22.458  -0.177  -2.224
  601    H    ALA  81           H        ALA  81 -19.515   3.914  -0.749
  602    HA   ALA  81           HA       ALA  81 -19.257   3.844   2.124
  603   1HB   ALA  81          1HB       ALA  81 -16.820   3.583   0.371
  604   2HB   ALA  81          2HB       ALA  81 -16.771   4.030   2.076
  605   3HB   ALA  81          3HB       ALA  81 -17.386   2.448   1.597

  No H/Q in entry =         605
  Start of MODEL   15
    1    H1   ALA   1           H1       ALA   1 -12.912   5.444 -10.570
    2    H2   ALA   1           H2       ALA   1 -12.536   4.327 -11.816
    3    H3   ALA   1           H3       ALA   1 -13.970   5.267 -11.911
    4    HA   ALA   1           HA       ALA   1 -14.926   4.168 -10.116
    5   1HB   ALA   1          1HB       ALA   1 -13.747   2.521 -12.294
    6   2HB   ALA   1          2HB       ALA   1 -14.601   1.705 -10.984
    7   3HB   ALA   1          3HB       ALA   1 -15.433   2.916 -11.962
    8    H    LEU   2           H        LEU   2 -12.332   1.865 -10.722
    9    HA   LEU   2           HA       LEU   2 -11.958   1.587  -7.841
   10   1HB   LEU   2          1HB       LEU   2 -10.811  -0.057 -10.098
   11   2HB   LEU   2          2HB       LEU   2 -10.721  -0.441  -8.390
   12    HG   LEU   2           HG       LEU   2 -13.452  -0.156  -8.911
   13   1HD1  LEU   2          1HD1      LEU   2 -12.388  -0.467 -11.363
   14   2HD1  LEU   2          2HD1      LEU   2 -12.583  -2.156 -10.891
   15   3HD1  LEU   2          3HD1      LEU   2 -13.978  -1.076 -10.899
   16   1HD2  LEU   2          1HD2      LEU   2 -12.099  -1.778  -7.451
   17   2HD2  LEU   2          2HD2      LEU   2 -13.580  -2.374  -8.202
   18   3HD2  LEU   2          3HD2      LEU   2 -12.012  -2.786  -8.897
   19    H    VAL   3           H        VAL   3  -9.557   0.969  -7.282
   20    HA   VAL   3           HA       VAL   3  -7.680   2.753  -8.640
   21    HB   VAL   3           HB       VAL   3  -8.598   3.011  -5.807
   22   1HG1  VAL   3          1HG1      VAL   3  -6.209   2.516  -5.554
   23   2HG1  VAL   3          2HG1      VAL   3  -5.824   3.805  -6.697
   24   3HG1  VAL   3          3HG1      VAL   3  -6.570   4.196  -5.146
   25   1HG2  VAL   3          1HG2      VAL   3  -8.150   4.747  -8.159
   26   2HG2  VAL   3          2HG2      VAL   3  -9.467   4.737  -6.986
   27   3HG2  VAL   3          3HG2      VAL   3  -7.917   5.465  -6.566
   28    H    GLU   4           H        GLU   4  -5.430   2.376  -7.978
   29    HA   GLU   4           HA       GLU   4  -4.956  -0.274  -6.818
   30   1HB   GLU   4          1HB       GLU   4  -3.348   0.590  -9.188
   31   2HB   GLU   4          2HB       GLU   4  -3.652  -1.030  -8.581
   32   1HG   GLU   4          1HG       GLU   4  -4.901  -0.983 -10.510
   33   2HG   GLU   4          2HG       GLU   4  -6.098  -0.578  -9.280
   34    H    LEU   5           H        LEU   5  -3.545  -0.129  -5.207
   35    HA   LEU   5           HA       LEU   5  -2.036   2.263  -4.753
   36   1HB   LEU   5          1HB       LEU   5  -2.869   0.040  -3.226
   37   2HB   LEU   5          2HB       LEU   5  -1.117   0.048  -3.164
   38    HG   LEU   5           HG       LEU   5  -1.134   2.337  -2.309
   39   1HD1  LEU   5          1HD1      LEU   5  -3.732   2.395  -3.366
   40   2HD1  LEU   5          2HD1      LEU   5  -3.907   2.556  -1.618
   41   3HD1  LEU   5          3HD1      LEU   5  -2.885   3.684  -2.510
   42   1HD2  LEU   5          1HD2      LEU   5  -2.907   0.412  -0.815
   43   2HD2  LEU   5          2HD2      LEU   5  -1.156   0.574  -0.679
   44   3HD2  LEU   5          3HD2      LEU   5  -2.209   1.873  -0.118
   45    H    LYS   6           H        LYS   6   0.295   2.400  -4.610
   46    HA   LYS   6           HA       LYS   6   1.809   0.287  -5.918
   47   1HB   LYS   6          1HB       LYS   6   1.554   3.076  -7.038
   48   2HB   LYS   6          2HB       LYS   6   2.807   1.948  -7.518
   49   1HG   LYS   6          1HG       LYS   6   1.372   1.411  -9.143
   50   2HG   LYS   6          2HG       LYS   6   0.608   0.429  -7.893
   51   1HD   LYS   6          1HD       LYS   6  -1.223   1.588  -8.576
   52   2HD   LYS   6          2HD       LYS   6  -0.612   2.743  -7.390
   53   1HE   LYS   6          1HE       LYS   6  -0.792   4.196  -9.104
   54   2HE   LYS   6          2HE       LYS   6   0.769   3.520  -9.570
   55   1HZ   LYS   6          1HZ       LYS   6  -0.794   1.803 -10.782
   56   2HZ   LYS   6          2HZ       LYS   6  -1.866   3.111 -10.765
   57   3HZ   LYS   6          3HZ       LYS   6  -0.355   3.265 -11.509
   58    H    VAL   7           H        VAL   7   2.293   0.639  -3.399
   59    HA   VAL   7           HA       VAL   7   3.889   1.136  -1.841
   60    HB   VAL   7           HB       VAL   7   5.448   1.737  -4.356
   61   1HG1  VAL   7          1HG1      VAL   7   6.324   2.892  -2.251
   62   2HG1  VAL   7          2HG1      VAL   7   6.687   1.267  -1.674
   63   3HG1  VAL   7          3HG1      VAL   7   7.446   1.867  -3.144
   64   1HG2  VAL   7          1HG2      VAL   7   4.636  -0.581  -3.987
   65   2HG2  VAL   7          2HG2      VAL   7   6.390  -0.430  -4.083
   66   3HG2  VAL   7          3HG2      VAL   7   5.607  -0.630  -2.516
   67    HA   PRO   8           HA       PRO   8   3.242   5.427  -1.041
   68   1HB   PRO   8          1HB       PRO   8   5.074   5.880   0.938
   69   2HB   PRO   8          2HB       PRO   8   3.526   5.070   1.184
   70   1HG   PRO   8          1HG       PRO   8   6.252   3.900   0.904
   71   2HG   PRO   8          2HG       PRO   8   4.908   3.386   1.936
   72   1HD   PRO   8          1HD       PRO   8   5.589   2.150  -0.390
   73   2HD   PRO   8          2HD       PRO   8   3.946   2.144   0.271
   74    H    ASP   9           H        ASP   9   6.637   5.588  -0.157
   75    HA   ASP   9           HA       ASP   9   7.901   6.271  -2.464
   76   1HB   ASP   9          1HB       ASP   9   5.981   8.344  -1.685
   77   2HB   ASP   9          2HB       ASP   9   7.615   8.962  -1.902
   78    H    ILE  10           H        ILE  10   8.883   5.144  -0.362
   79    HA   ILE  10           HA       ILE  10   9.867   6.326   1.833
   80    HB   ILE  10           HB       ILE  10  11.870   4.944   1.702
   81   1HG1  ILE  10          1HG1      ILE  10  12.415   5.285  -0.672
   82   2HG1  ILE  10          2HG1      ILE  10  12.346   3.573  -0.275
   83   1HG2  ILE  10          1HG2      ILE  10   9.272   3.692   0.857
   84   2HG2  ILE  10          2HG2      ILE  10  10.697   2.732   1.261
   85   3HG2  ILE  10          3HG2      ILE  10   9.981   3.794   2.474
   86   1HD1  ILE  10          1HD1      ILE  10   9.964   3.645  -1.178
   87   2HD1  ILE  10          2HD1      ILE  10  10.411   5.206  -1.866
   88   3HD1  ILE  10          3HD1      ILE  10  11.290   3.752  -2.337
   89    H    GLY  11           H        GLY  11  10.926   7.032  -1.432
   90   1HA   GLY  11          1HA       GLY  11  12.216   9.442  -0.497
   91   2HA   GLY  11          2HA       GLY  11  12.006   8.951  -2.170
   92    H    GLY  12           H        GLY  12  13.239   6.419  -2.028
   93   1HA   GLY  12          1HA       GLY  12  15.505   5.737  -1.043
   94   2HA   GLY  12          2HA       GLY  12  16.039   7.278  -1.700
   95    H    HIS  13           H        HIS  13  13.822   4.909  -3.116
   96    HA   HIS  13           HA       HIS  13  14.734   5.063  -5.700
   97   1HB   HIS  13          1HB       HIS  13  16.017   2.758  -5.681
   98   2HB   HIS  13          2HB       HIS  13  16.867   4.266  -5.363
   99    HD1  HIS  13           HD1      HIS  13  18.595   3.665  -3.687
  100    HD2  HIS  13           HD2      HIS  13  14.890   2.032  -2.757
  101    HE1  HIS  13           HE1      HIS  13  18.887   2.573  -1.441
  102    HE2  HIS  13           HE2      HIS  13  16.650   1.534  -0.928
  103    H    GLU  14           H        GLU  14  14.047   3.202  -7.064
  104    HA   GLU  14           HA       GLU  14  11.538   2.176  -6.063
  105   1HB   GLU  14          1HB       GLU  14  12.763   1.528  -8.741
  106   2HB   GLU  14          2HB       GLU  14  11.063   1.560  -8.302
  107   1HG   GLU  14          1HG       GLU  14  10.872   3.758  -8.670
  108   2HG   GLU  14          2HG       GLU  14  12.455   4.119  -7.984
  109    H    ASN  15           H        ASN  15  12.933   0.998  -4.410
  110    HA   ASN  15           HA       ASN  15  12.714  -1.741  -4.779
  111   1HB   ASN  15          1HB       ASN  15  15.259  -2.241  -4.714
  112   2HB   ASN  15          2HB       ASN  15  14.521  -1.856  -6.265
  113   1HD2  ASN  15          2HD2      ASN  15  15.139  -0.060  -7.344
  114   2HD2  ASN  15          1HD2      ASN  15  16.385   1.010  -6.807
  115    H    VAL  16           H        VAL  16  11.795  -1.344  -2.714
  116    HA   VAL  16           HA       VAL  16  13.782  -1.383  -0.574
  117    HB   VAL  16           HB       VAL  16  12.192   0.251   0.704
  118   1HG1  VAL  16          1HG1      VAL  16  14.633   0.499  -0.505
  119   2HG1  VAL  16          2HG1      VAL  16  13.729   1.843  -1.203
  120   3HG1  VAL  16          3HG1      VAL  16  13.888   1.701   0.548
  121   1HG2  VAL  16          1HG2      VAL  16  11.666   1.012  -2.174
  122   2HG2  VAL  16          2HG2      VAL  16  10.481   0.434  -0.999
  123   3HG2  VAL  16          3HG2      VAL  16  11.259   1.998  -0.767
  124    H    ASP  17           H        ASP  17  13.113  -2.418   1.275
  125    HA   ASP  17           HA       ASP  17  10.940  -4.247   0.953
  126   1HB   ASP  17          1HB       ASP  17  12.541  -3.765   3.465
  127   2HB   ASP  17          2HB       ASP  17  11.672  -5.226   3.007
  128    H    ILE  18           H        ILE  18   9.044  -4.398   2.121
  129    HA   ILE  18           HA       ILE  18   7.871  -1.936   2.949
  130    HB   ILE  18           HB       ILE  18   6.922  -4.801   3.004
  131   1HG1  ILE  18          1HG1      ILE  18   5.483  -2.717   1.507
  132   2HG1  ILE  18          2HG1      ILE  18   7.127  -3.020   0.955
  133   1HG2  ILE  18          1HG2      ILE  18   5.440  -2.344   3.923
  134   2HG2  ILE  18          2HG2      ILE  18   4.674  -3.890   3.563
  135   3HG2  ILE  18          3HG2      ILE  18   5.845  -3.772   4.875
  136   1HD1  ILE  18          1HD1      ILE  18   5.583  -5.449   1.413
  137   2HD1  ILE  18          2HD1      ILE  18   4.914  -4.395   0.166
  138   3HD1  ILE  18          3HD1      ILE  18   6.576  -4.972   0.037
  139    H    ILE  19           H        ILE  19   6.800  -1.708   5.133
  140    HA   ILE  19           HA       ILE  19   8.378  -3.078   7.203
  141    HB   ILE  19           HB       ILE  19   9.188  -1.224   8.214
  142   1HG1  ILE  19          1HG1      ILE  19   7.827   1.090   7.401
  143   2HG1  ILE  19          2HG1      ILE  19   6.565  -0.083   7.729
  144   1HG2  ILE  19          1HG2      ILE  19   9.740  -1.247   5.687
  145   2HG2  ILE  19          2HG2      ILE  19   8.760   0.220   5.634
  146   3HG2  ILE  19          3HG2      ILE  19  10.192   0.150   6.662
  147   1HD1  ILE  19          1HD1      ILE  19   8.007  -0.469   9.911
  148   2HD1  ILE  19          2HD1      ILE  19   8.501   1.189   9.562
  149   3HD1  ILE  19          3HD1      ILE  19   6.795   0.808   9.798
  150    H    ALA  20           H        ALA  20   5.333  -2.409   6.120
  151    HA   ALA  20           HA       ALA  20   4.168  -3.314   8.599
  152   1HB   ALA  20          1HB       ALA  20   4.333  -0.774   8.724
  153   2HB   ALA  20          2HB       ALA  20   3.097  -0.750   7.468
  154   3HB   ALA  20          3HB       ALA  20   2.752  -1.495   9.028
  155    H    VAL  21           H        VAL  21   2.030  -4.110   8.348
  156    HA   VAL  21           HA       VAL  21   0.998  -4.172   5.605
  157    HB   VAL  21           HB       VAL  21   2.337  -6.236   5.991
  158   1HG1  VAL  21          1HG1      VAL  21   1.772  -6.366   8.442
  159   2HG1  VAL  21          2HG1      VAL  21   0.199  -7.005   7.966
  160   3HG1  VAL  21          3HG1      VAL  21   1.671  -7.888   7.557
  161   1HG2  VAL  21          1HG2      VAL  21   0.402  -6.143   4.431
  162   2HG2  VAL  21          2HG2      VAL  21   0.706  -7.751   5.087
  163   3HG2  VAL  21          3HG2      VAL  21  -0.619  -6.775   5.724
  164    H    GLU  22           H        GLU  22  -1.166  -3.995   5.455
  165    HA   GLU  22           HA       GLU  22  -2.892  -4.747   7.647
  166   1HB   GLU  22          1HB       GLU  22  -2.633  -1.859   6.798
  167   2HB   GLU  22          2HB       GLU  22  -3.939  -2.485   7.795
  168   1HG   GLU  22          1HG       GLU  22  -1.017  -2.551   8.515
  169   2HG   GLU  22          2HG       GLU  22  -2.193  -1.381   9.112
  170    H    VAL  23           H        VAL  23  -2.431  -5.332   4.764
  171    HA   VAL  23           HA       VAL  23  -5.120  -4.666   3.757
  172    HB   VAL  23           HB       VAL  23  -4.081  -5.181   1.468
  173   1HG1  VAL  23          1HG1      VAL  23  -4.489  -2.862   2.815
  174   2HG1  VAL  23          2HG1      VAL  23  -2.773  -2.732   2.426
  175   3HG1  VAL  23          3HG1      VAL  23  -3.956  -2.961   1.138
  176   1HG2  VAL  23          1HG2      VAL  23  -1.992  -6.146   2.566
  177   2HG2  VAL  23          2HG2      VAL  23  -1.750  -5.054   1.203
  178   3HG2  VAL  23          3HG2      VAL  23  -1.509  -4.474   2.851
  179    H    ASN  24           H        ASN  24  -6.468  -6.321   3.584
  180    HA   ASN  24           HA       ASN  24  -5.383  -9.001   3.061
  181   1HB   ASN  24          1HB       ASN  24  -6.237  -8.308   5.530
  182   2HB   ASN  24          2HB       ASN  24  -7.751  -8.865   4.822
  183   1HD2  ASN  24          2HD2      ASN  24  -8.162 -10.905   5.204
  184   2HD2  ASN  24          1HD2      ASN  24  -6.999 -12.172   5.381
  185    H    VAL  25           H        VAL  25  -7.085  -6.717   1.705
  186    HA   VAL  25           HA       VAL  25  -8.698  -6.603   0.110
  187    HB   VAL  25           HB       VAL  25  -8.367  -9.604   0.082
  188   1HG1  VAL  25          1HG1      VAL  25 -10.508  -8.844  -0.904
  189   2HG1  VAL  25          2HG1      VAL  25  -9.598  -7.825  -2.020
  190   3HG1  VAL  25          3HG1      VAL  25  -9.426  -9.580  -2.086
  191   1HG2  VAL  25          1HG2      VAL  25  -6.794  -7.395  -0.990
  192   2HG2  VAL  25          2HG2      VAL  25  -6.357  -9.086  -0.745
  193   3HG2  VAL  25          3HG2      VAL  25  -7.227  -8.603  -2.201
  194    H    GLY  26           H        GLY  26 -10.728  -6.059   0.544
  195   1HA   GLY  26          1HA       GLY  26 -12.419  -7.984   2.003
  196   2HA   GLY  26          2HA       GLY  26 -13.014  -6.751   0.901
  197    H    ASP  27           H        ASP  27 -10.723  -5.150   2.540
  198    HA   ASP  27           HA       ASP  27 -12.418  -4.544   4.856
  199   1HB   ASP  27          1HB       ASP  27  -9.501  -4.371   4.312
  200   2HB   ASP  27          2HB       ASP  27 -10.190  -3.154   5.383
  201    H    THR  28           H        THR  28 -13.044  -2.439   5.340
  202    HA   THR  28           HA       THR  28 -13.563  -0.766   3.104
  203    HB   THR  28           HB       THR  28 -13.792   0.142   5.959
  204    HG1  THR  28           HG1      THR  28 -14.802  -1.737   6.169
  205   1HG2  THR  28          1HG2      THR  28 -15.519   0.583   3.536
  206   2HG2  THR  28          2HG2      THR  28 -15.873   1.163   5.163
  207   3HG2  THR  28          3HG2      THR  28 -14.455   1.762   4.301
  208    H    ILE  29           H        ILE  29 -12.501   0.965   2.340
  209    HA   ILE  29           HA       ILE  29 -10.203   1.965   3.893
  210    HB   ILE  29           HB       ILE  29  -9.109   2.453   1.677
  211   1HG1  ILE  29          1HG1      ILE  29 -10.386   0.379   0.183
  212   2HG1  ILE  29          2HG1      ILE  29 -11.618   1.521   0.709
  213   1HG2  ILE  29          1HG2      ILE  29  -8.409   0.596   3.088
  214   2HG2  ILE  29          2HG2      ILE  29  -9.628  -0.441   2.346
  215   3HG2  ILE  29          3HG2      ILE  29  -8.283   0.171   1.381
  216   1HD1  ILE  29          1HD1      ILE  29  -9.110   2.235  -0.791
  217   2HD1  ILE  29          2HD1      ILE  29 -10.720   2.075  -1.492
  218   3HD1  ILE  29          3HD1      ILE  29 -10.394   3.345  -0.313
  219    H    ALA  30           H        ALA  30  -9.828   4.158   3.877
  220    HA   ALA  30           HA       ALA  30 -11.936   5.803   2.634
  221   1HB   ALA  30          1HB       ALA  30 -12.257   6.827   4.581
  222   2HB   ALA  30          2HB       ALA  30 -10.532   7.150   4.762
  223   3HB   ALA  30          3HB       ALA  30 -11.207   5.619   5.322
  224    H    VAL  31           H        VAL  31 -10.942   8.276   2.792
  225    HA   VAL  31           HA       VAL  31  -8.725   8.181   0.904
  226    HB   VAL  31           HB       VAL  31 -10.168  10.664   1.806
  227   1HG1  VAL  31          1HG1      VAL  31  -8.173   9.995  -0.205
  228   2HG1  VAL  31          2HG1      VAL  31  -9.555  10.868  -0.868
  229   3HG1  VAL  31          3HG1      VAL  31  -8.629  11.563   0.462
  230   1HG2  VAL  31          1HG2      VAL  31 -11.336   8.442   0.502
  231   2HG2  VAL  31          2HG2      VAL  31 -12.043  10.030   0.801
  232   3HG2  VAL  31          3HG2      VAL  31 -11.160   9.725  -0.695
  233    H    ASP  32           H        ASP  32  -8.020   7.504   3.549
  234    HA   ASP  32           HA       ASP  32  -5.700   8.873   3.979
  235   1HB   ASP  32          1HB       ASP  32  -6.409  10.238   6.068
  236   2HB   ASP  32          2HB       ASP  32  -6.692  10.932   4.475
  237    H    ASP  33           H        ASP  33  -5.855   6.387   4.236
  238    HA   ASP  33           HA       ASP  33  -5.795   5.846   7.112
  239   1HB   ASP  33          1HB       ASP  33  -6.909   3.616   6.662
  240   2HB   ASP  33          2HB       ASP  33  -7.959   5.024   6.544
  241    H    THR  34           H        THR  34  -3.795   5.190   7.519
  242    HA   THR  34           HA       THR  34  -1.917   4.382   5.657
  243    HB   THR  34           HB       THR  34  -0.964   3.167   7.826
  244    HG1  THR  34           HG1      THR  34  -2.137   3.578   9.498
  245   1HG2  THR  34          1HG2      THR  34  -0.121   5.223   6.568
  246   2HG2  THR  34          2HG2      THR  34  -0.988   6.150   7.794
  247   3HG2  THR  34          3HG2      THR  34   0.304   5.050   8.273
  248    H    LEU  35           H        LEU  35  -1.879   2.708   4.389
  249    HA   LEU  35           HA       LEU  35  -3.262   0.252   5.138
  250   1HB   LEU  35          1HB       LEU  35  -2.013   1.224   2.573
  251   2HB   LEU  35          2HB       LEU  35  -2.570  -0.426   2.772
  252    HG   LEU  35           HG       LEU  35  -4.263   2.070   2.891
  253   1HD1  LEU  35          1HD1      LEU  35  -3.779  -0.052   0.861
  254   2HD1  LEU  35          2HD1      LEU  35  -5.387   0.662   0.982
  255   3HD1  LEU  35          3HD1      LEU  35  -3.990   1.685   0.651
  256   1HD2  LEU  35          1HD2      LEU  35  -4.841  -0.775   3.607
  257   2HD2  LEU  35          2HD2      LEU  35  -5.314   0.708   4.436
  258   3HD2  LEU  35          3HD2      LEU  35  -6.112   0.245   2.933
  259    H    ILE  36           H        ILE  36  -0.085   1.566   4.622
  260    HA   ILE  36           HA       ILE  36   1.137  -0.568   6.090
  261    HB   ILE  36           HB       ILE  36   2.811  -1.138   4.280
  262   1HG1  ILE  36          1HG1      ILE  36   2.413  -0.743   2.035
  263   2HG1  ILE  36          2HG1      ILE  36   0.695  -0.449   2.276
  264   1HG2  ILE  36          1HG2      ILE  36   0.632  -2.388   5.089
  265   2HG2  ILE  36          2HG2      ILE  36   0.179  -2.152   3.402
  266   3HG2  ILE  36          3HG2      ILE  36   1.659  -3.023   3.805
  267   1HD1  ILE  36          1HD1      ILE  36   2.879   1.438   3.123
  268   2HD1  ILE  36          2HD1      ILE  36   1.995   1.543   1.602
  269   3HD1  ILE  36          3HD1      ILE  36   1.141   1.742   3.131
  270    H    THR  37           H        THR  37   3.720  -0.268   5.706
  271    HA   THR  37           HA       THR  37   4.348   2.567   5.500
  272    HB   THR  37           HB       THR  37   4.958   0.883   7.932
  273    HG1  THR  37           HG1      THR  37   2.901   1.880   7.890
  274   1HG2  THR  37          1HG2      THR  37   6.734   2.644   6.998
  275   2HG2  THR  37          2HG2      THR  37   5.678   3.739   7.887
  276   3HG2  THR  37          3HG2      THR  37   6.442   2.386   8.718
  277    H    LEU  38           H        LEU  38   6.052   2.794   4.232
  278    HA   LEU  38           HA       LEU  38   7.811   0.486   3.815
  279   1HB   LEU  38          1HB       LEU  38   6.501   1.989   2.003
  280   2HB   LEU  38          2HB       LEU  38   8.020   2.858   2.071
  281    HG   LEU  38           HG       LEU  38   9.110   0.544   1.689
  282   1HD1  LEU  38          1HD1      LEU  38   6.804  -0.551   2.053
  283   2HD1  LEU  38          2HD1      LEU  38   6.483  -0.065   0.388
  284   3HD1  LEU  38          3HD1      LEU  38   7.828  -1.148   0.747
  285   1HD2  LEU  38          1HD2      LEU  38   7.757   2.361  -0.219
  286   2HD2  LEU  38          2HD2      LEU  38   9.460   1.951  -0.057
  287   3HD2  LEU  38          3HD2      LEU  38   8.364   0.830  -0.847
  288    H    GLU  39           H        GLU  39  10.136   1.053   3.273
  289    HA   GLU  39           HA       GLU  39  11.240   3.463   4.320
  290   1HB   GLU  39          1HB       GLU  39  10.575   2.179   6.399
  291   2HB   GLU  39          2HB       GLU  39  11.797   0.995   5.955
  292   1HG   GLU  39          1HG       GLU  39  12.692   3.799   6.052
  293   2HG   GLU  39          2HG       GLU  39  12.247   3.070   7.593
  294    H    THR  40           H        THR  40  13.657   3.357   4.418
  295    HA   THR  40           HA       THR  40  14.708   1.365   2.521
  296    HB   THR  40           HB       THR  40  15.952   3.000   1.381
  297    HG1  THR  40           HG1      THR  40  16.284   5.063   2.172
  298   1HG2  THR  40          1HG2      THR  40  13.174   3.498   1.722
  299   2HG2  THR  40          2HG2      THR  40  14.023   5.038   1.581
  300   3HG2  THR  40          3HG2      THR  40  14.198   3.816   0.322
  301    H    ASP  41           H        ASP  41  15.820   3.876   4.783
  302    HA   ASP  41           HA       ASP  41  17.206   2.069   6.458
  303   1HB   ASP  41          1HB       ASP  41  18.642   2.146   4.312
  304   2HB   ASP  41          2HB       ASP  41  19.080   3.772   4.831
  305    H    LYS  42           H        LYS  42  17.026   5.366   5.204
  306    HA   LYS  42           HA       LYS  42  17.379   6.354   7.958
  307   1HB   LYS  42          1HB       LYS  42  18.789   7.044   5.617
  308   2HB   LYS  42          2HB       LYS  42  17.756   8.417   5.989
  309   1HG   LYS  42          1HG       LYS  42  19.684   7.127   7.908
  310   2HG   LYS  42          2HG       LYS  42  19.979   8.610   7.000
  311   1HD   LYS  42          1HD       LYS  42  17.473   8.823   8.357
  312   2HD   LYS  42          2HD       LYS  42  18.715   8.323   9.508
  313   1HE   LYS  42          1HE       LYS  42  19.211  10.501   9.642
  314   2HE   LYS  42          2HE       LYS  42  19.997  10.272   8.081
  315   1HZ   LYS  42          1HZ       LYS  42  17.131  10.828   8.065
  316   2HZ   LYS  42          2HZ       LYS  42  18.160  12.108   8.475
  317   3HZ   LYS  42          3HZ       LYS  42  18.334  11.324   6.985
  318    H    ALA  43           H        ALA  43  15.452   6.476   5.049
  319    HA   ALA  43           HA       ALA  43  13.564   8.284   6.412
  320   1HB   ALA  43          1HB       ALA  43  14.736   8.811   4.073
  321   2HB   ALA  43          2HB       ALA  43  13.100   9.343   4.462
  322   3HB   ALA  43          3HB       ALA  43  13.349   7.895   3.487
  323    H    THR  44           H        THR  44  11.562   7.579   6.828
  324    HA   THR  44           HA       THR  44  10.756   4.983   5.688
  325    HB   THR  44           HB       THR  44   9.779   4.366   7.703
  326    HG1  THR  44           HG1      THR  44   9.798   7.097   8.463
  327   1HG2  THR  44          1HG2      THR  44  12.382   5.278   7.893
  328   2HG2  THR  44          2HG2      THR  44  11.570   5.972   9.295
  329   3HG2  THR  44          3HG2      THR  44  11.542   4.228   9.034
  330    H    MET  45           H        MET  45   8.759   4.790   4.772
  331    HA   MET  45           HA       MET  45   7.028   7.173   4.823
  332   1HB   MET  45          1HB       MET  45   8.162   5.705   2.523
  333   2HB   MET  45          2HB       MET  45   6.460   6.121   2.391
  334   1HG   MET  45          1HG       MET  45   8.145   8.318   3.322
  335   2HG   MET  45          2HG       MET  45   8.540   7.740   1.706
  336   1HE   MET  45          1HE       MET  45   7.085  10.096   3.590
  337   2HE   MET  45          2HE       MET  45   7.042  10.982   2.065
  338   3HE   MET  45          3HE       MET  45   5.543  10.634   2.926
  339    H    ASP  46           H        ASP  46   4.839   6.452   3.618
  340    HA   ASP  46           HA       ASP  46   3.930   3.809   4.130
  341   1HB   ASP  46          1HB       ASP  46   2.230   4.490   5.883
  342   2HB   ASP  46          2HB       ASP  46   3.898   4.403   6.438
  343    H    VAL  47           H        VAL  47   1.579   3.575   3.685
  344    HA   VAL  47           HA       VAL  47   0.708   5.692   1.831
  345    HB   VAL  47           HB       VAL  47   0.133   2.729   1.735
  346   1HG1  VAL  47          1HG1      VAL  47  -0.925   4.999   0.062
  347   2HG1  VAL  47          2HG1      VAL  47  -0.953   3.318  -0.471
  348   3HG1  VAL  47          3HG1      VAL  47  -1.841   3.801   0.975
  349   1HG2  VAL  47          1HG2      VAL  47   2.400   3.491   1.003
  350   2HG2  VAL  47          2HG2      VAL  47   1.452   2.705  -0.260
  351   3HG2  VAL  47          3HG2      VAL  47   1.611   4.462  -0.240
  352    HA   PRO  48           HA       PRO  48  -2.738   5.839   4.757
  353   1HB   PRO  48          1HB       PRO  48  -3.343   8.404   4.430
  354   2HB   PRO  48          2HB       PRO  48  -1.861   7.936   5.274
  355   1HG   PRO  48          1HG       PRO  48  -2.219   8.945   2.490
  356   2HG   PRO  48          2HG       PRO  48  -0.918   9.276   3.646
  357   1HD   PRO  48          1HD       PRO  48  -0.835   7.404   1.559
  358   2HD   PRO  48          2HD       PRO  48   0.287   7.489   2.929
  359    H    ALA  49           H        ALA  49  -3.080   4.668   2.181
  360    HA   ALA  49           HA       ALA  49  -4.648   4.254   0.585
  361   1HB   ALA  49          1HB       ALA  49  -6.677   5.671   2.266
  362   2HB   ALA  49          2HB       ALA  49  -5.957   4.158   2.818
  363   3HB   ALA  49          3HB       ALA  49  -6.850   4.206   1.299
  364    H    GLU  50           H        GLU  50  -6.398   5.333  -0.837
  365    HA   GLU  50           HA       GLU  50  -6.223   8.202  -1.029
  366   1HB   GLU  50          1HB       GLU  50  -5.211   8.318  -3.198
  367   2HB   GLU  50          2HB       GLU  50  -4.143   7.395  -2.148
  368   1HG   GLU  50          1HG       GLU  50  -4.593   5.402  -3.217
  369   2HG   GLU  50          2HG       GLU  50  -6.127   5.975  -3.866
  370    H    VAL  51           H        VAL  51  -8.324   6.265  -0.666
  371    HA   VAL  51           HA       VAL  51 -10.212   7.310  -2.493
  372    HB   VAL  51           HB       VAL  51 -10.782   4.869  -3.362
  373   1HG1  VAL  51          1HG1      VAL  51  -9.957   7.134  -4.510
  374   2HG1  VAL  51          2HG1      VAL  51  -8.556   6.121  -4.856
  375   3HG1  VAL  51          3HG1      VAL  51 -10.155   5.631  -5.409
  376   1HG2  VAL  51          1HG2      VAL  51  -7.822   4.796  -2.807
  377   2HG2  VAL  51          2HG2      VAL  51  -9.054   3.621  -2.342
  378   3HG2  VAL  51          3HG2      VAL  51  -8.584   3.781  -4.033
  379    H    ALA  52           H        ALA  52 -12.375   6.104  -2.287
  380    HA   ALA  52           HA       ALA  52 -12.626   5.071   0.466
  381   1HB   ALA  52          1HB       ALA  52 -14.474   6.883  -1.055
  382   2HB   ALA  52          2HB       ALA  52 -14.863   6.131   0.492
  383   3HB   ALA  52          3HB       ALA  52 -13.528   7.278   0.383
  384    H    GLY  53           H        GLY  53 -12.555   2.894  -0.295
  385   1HA   GLY  53          1HA       GLY  53 -13.931   1.683  -2.292
  386   2HA   GLY  53          2HA       GLY  53 -15.165   1.939  -1.074
  387    H    VAL  54           H        VAL  54 -13.560  -0.444  -2.260
  388    HA   VAL  54           HA       VAL  54 -12.694  -1.642   0.282
  389    HB   VAL  54           HB       VAL  54 -14.560  -2.927  -1.722
  390   1HG1  VAL  54          1HG1      VAL  54 -12.772  -4.074   0.256
  391   2HG1  VAL  54          2HG1      VAL  54 -14.453  -4.525   0.540
  392   3HG1  VAL  54          3HG1      VAL  54 -13.702  -4.864  -1.018
  393   1HG2  VAL  54          1HG2      VAL  54 -15.617  -1.280  -0.216
  394   2HG2  VAL  54          2HG2      VAL  54 -16.193  -2.924   0.061
  395   3HG2  VAL  54          3HG2      VAL  54 -15.027  -2.200   1.169
  396    H    VAL  55           H        VAL  55 -10.985  -3.075   0.122
  397    HA   VAL  55           HA       VAL  55  -9.435  -2.933  -2.273
  398    HB   VAL  55           HB       VAL  55  -8.951  -4.636   0.170
  399   1HG1  VAL  55          1HG1      VAL  55  -7.800  -5.348  -1.966
  400   2HG1  VAL  55          2HG1      VAL  55  -6.967  -3.792  -1.941
  401   3HG1  VAL  55          3HG1      VAL  55  -6.725  -4.942  -0.627
  402   1HG2  VAL  55          1HG2      VAL  55  -9.036  -2.021   0.303
  403   2HG2  VAL  55          2HG2      VAL  55  -7.735  -2.912   1.094
  404   3HG2  VAL  55          3HG2      VAL  55  -7.451  -2.134  -0.464
  405    H    LYS  56           H        LYS  56  -8.935  -4.494  -3.725
  406    HA   LYS  56           HA       LYS  56 -10.652  -6.888  -3.703
  407   1HB   LYS  56          1HB       LYS  56  -9.446  -6.461  -6.264
  408   2HB   LYS  56          2HB       LYS  56 -11.155  -6.469  -5.846
  409   1HG   LYS  56          1HG       LYS  56  -9.386  -4.053  -5.557
  410   2HG   LYS  56          2HG       LYS  56 -10.341  -4.403  -6.999
  411   1HD   LYS  56          1HD       LYS  56 -11.498  -4.140  -4.227
  412   2HD   LYS  56          2HD       LYS  56 -11.429  -2.822  -5.399
  413   1HE   LYS  56          1HE       LYS  56 -13.180  -3.613  -6.545
  414   2HE   LYS  56          2HE       LYS  56 -12.572  -5.267  -6.496
  415   1HZ   LYS  56          1HZ       LYS  56 -13.368  -4.763  -3.934
  416   2HZ   LYS  56          2HZ       LYS  56 -14.562  -4.017  -4.871
  417   3HZ   LYS  56          3HZ       LYS  56 -14.223  -5.662  -5.083
  418    H    GLU  57           H        GLU  57  -7.474  -5.640  -4.613
  419    HA   GLU  57           HA       GLU  57  -6.445  -8.358  -4.362
  420   1HB   GLU  57          1HB       GLU  57  -5.811  -6.143  -6.216
  421   2HB   GLU  57          2HB       GLU  57  -4.457  -7.131  -5.685
  422   1HG   GLU  57          1HG       GLU  57  -5.380  -9.082  -6.617
  423   2HG   GLU  57          2HG       GLU  57  -6.958  -8.325  -6.835
  424    H    VAL  58           H        VAL  58  -4.017  -8.361  -3.832
  425    HA   VAL  58           HA       VAL  58  -3.042  -6.263  -2.118
  426    HB   VAL  58           HB       VAL  58  -4.525  -7.359  -0.528
  427   1HG1  VAL  58          1HG1      VAL  58  -4.363  -9.583  -1.850
  428   2HG1  VAL  58          2HG1      VAL  58  -2.995  -9.914  -0.788
  429   3HG1  VAL  58          3HG1      VAL  58  -4.596  -9.633  -0.102
  430   1HG2  VAL  58          1HG2      VAL  58  -1.786  -6.959  -0.190
  431   2HG2  VAL  58          2HG2      VAL  58  -3.008  -7.075   1.076
  432   3HG2  VAL  58          3HG2      VAL  58  -2.122  -8.514   0.572
  433    H    LYS  59           H        LYS  59  -0.962  -6.188  -2.575
  434    HA   LYS  59           HA       LYS  59   0.524  -8.695  -2.938
  435   1HB   LYS  59          1HB       LYS  59   1.160  -6.325  -4.646
  436   2HB   LYS  59          2HB       LYS  59   1.477  -8.030  -4.945
  437   1HG   LYS  59          1HG       LYS  59  -1.224  -8.030  -4.913
  438   2HG   LYS  59          2HG       LYS  59  -0.903  -6.415  -5.544
  439   1HD   LYS  59          1HD       LYS  59   0.763  -7.669  -7.111
  440   2HD   LYS  59          2HD       LYS  59  -0.219  -9.078  -6.705
  441   1HE   LYS  59          1HE       LYS  59  -1.957  -6.907  -7.326
  442   2HE   LYS  59          2HE       LYS  59  -0.752  -7.042  -8.607
  443   1HZ   LYS  59          1HZ       LYS  59  -1.773  -9.591  -7.829
  444   2HZ   LYS  59          2HZ       LYS  59  -3.010  -8.557  -8.343
  445   3HZ   LYS  59          3HZ       LYS  59  -1.703  -8.885  -9.364
  446    H    VAL  60           H        VAL  60   0.792  -7.828  -0.590
  447    HA   VAL  60           HA       VAL  60   3.452  -6.869  -0.364
  448    HB   VAL  60           HB       VAL  60   2.814  -4.682  -0.675
  449   1HG1  VAL  60          1HG1      VAL  60   0.214  -5.342   0.684
  450   2HG1  VAL  60          2HG1      VAL  60   0.683  -3.709   0.209
  451   3HG1  VAL  60          3HG1      VAL  60   0.482  -4.961  -1.018
  452   1HG2  VAL  60          1HG2      VAL  60   3.682  -5.181   1.759
  453   2HG2  VAL  60          2HG2      VAL  60   3.163  -3.563   1.293
  454   3HG2  VAL  60          3HG2      VAL  60   2.079  -4.609   2.210
  455    H    LYS  61           H        LYS  61   4.264  -7.033   1.729
  456    HA   LYS  61           HA       LYS  61   2.462  -8.014   3.816
  457   1HB   LYS  61          1HB       LYS  61   5.014  -9.453   3.073
  458   2HB   LYS  61          2HB       LYS  61   3.851  -9.929   4.305
  459   1HG   LYS  61          1HG       LYS  61   2.314  -9.786   2.032
  460   2HG   LYS  61          2HG       LYS  61   3.850 -10.425   1.440
  461   1HD   LYS  61          1HD       LYS  61   3.614 -11.965   3.581
  462   2HD   LYS  61          2HD       LYS  61   1.901 -11.608   3.351
  463   1HE   LYS  61          1HE       LYS  61   3.790 -12.873   1.373
  464   2HE   LYS  61          2HE       LYS  61   2.424 -13.638   2.184
  465   1HZ   LYS  61          1HZ       LYS  61   0.943 -12.110   1.011
  466   2HZ   LYS  61          2HZ       LYS  61   2.265 -11.428   0.206
  467   3HZ   LYS  61          3HZ       LYS  61   1.849 -13.044  -0.069
  468    H    VAL  62           H        VAL  62   4.274  -8.658   5.743
  469    HA   VAL  62           HA       VAL  62   5.422  -6.044   6.343
  470    HB   VAL  62           HB       VAL  62   3.975  -7.131   8.027
  471   1HG1  VAL  62          1HG1      VAL  62   5.086  -9.450   7.361
  472   2HG1  VAL  62          2HG1      VAL  62   6.113  -9.057   8.741
  473   3HG1  VAL  62          3HG1      VAL  62   4.364  -9.173   8.947
  474   1HG2  VAL  62          1HG2      VAL  62   6.678  -6.148   8.470
  475   2HG2  VAL  62          2HG2      VAL  62   5.175  -5.740   9.297
  476   3HG2  VAL  62          3HG2      VAL  62   6.094  -7.164   9.788
  477    H    GLY  63           H        GLY  63   6.815  -7.409   4.376
  478   1HA   GLY  63          1HA       GLY  63   9.044  -8.818   5.552
  479   2HA   GLY  63          2HA       GLY  63   9.429  -7.180   5.048
  480    H    ASP  64           H        ASP  64   8.815  -6.646   2.744
  481    HA   ASP  64           HA       ASP  64   9.896  -8.704   1.037
  482   1HB   ASP  64          1HB       ASP  64   7.921  -8.444  -0.587
  483   2HB   ASP  64          2HB       ASP  64   7.681  -9.462   0.829
  484    H    LYS  65           H        LYS  65  10.755  -7.908  -0.863
  485    HA   LYS  65           HA       LYS  65  11.465  -5.169  -0.885
  486   1HB   LYS  65          1HB       LYS  65  11.801  -7.380  -2.907
  487   2HB   LYS  65          2HB       LYS  65  12.399  -5.750  -3.182
  488   1HG   LYS  65          1HG       LYS  65  13.322  -6.511  -0.640
  489   2HG   LYS  65          2HG       LYS  65  13.587  -7.891  -1.709
  490   1HD   LYS  65          1HD       LYS  65  15.326  -6.870  -2.646
  491   2HD   LYS  65          2HD       LYS  65  14.317  -5.488  -3.077
  492   1HE   LYS  65          1HE       LYS  65  14.705  -4.486  -0.910
  493   2HE   LYS  65          2HE       LYS  65  15.617  -5.901  -0.387
  494   1HZ   LYS  65          1HZ       LYS  65  17.204  -5.411  -2.213
  495   2HZ   LYS  65          2HZ       LYS  65  16.378  -3.961  -2.499
  496   3HZ   LYS  65          3HZ       LYS  65  17.152  -4.217  -1.017
  497    H    ILE  66           H        ILE  66  10.574  -3.459  -1.863
  498    HA   ILE  66           HA       ILE  66   8.545  -3.896  -3.916
  499    HB   ILE  66           HB       ILE  66   7.817  -3.329  -1.354
  500   1HG1  ILE  66          1HG1      ILE  66   5.628  -2.813  -2.273
  501   2HG1  ILE  66          2HG1      ILE  66   6.353  -2.456  -3.842
  502   1HG2  ILE  66          1HG2      ILE  66   8.801  -1.095  -1.384
  503   2HG2  ILE  66          2HG2      ILE  66   7.785  -0.665  -2.758
  504   3HG2  ILE  66          3HG2      ILE  66   7.049  -1.037  -1.202
  505   1HD1  ILE  66          1HD1      ILE  66   7.225  -5.018  -3.060
  506   2HD1  ILE  66          2HD1      ILE  66   5.476  -4.946  -2.818
  507   3HD1  ILE  66          3HD1      ILE  66   6.165  -4.578  -4.402
  508    H    SER  67           H        SER  67   7.834  -1.538  -4.745
  509    HA   SER  67           HA       SER  67  10.054   0.311  -4.831
  510   1HB   SER  67          1HB       SER  67   9.151  -0.849  -7.458
  511   2HB   SER  67          2HB       SER  67  10.580   0.125  -7.121
  512    HG   SER  67           HG       SER  67  11.006  -2.148  -7.382
  513    H    GLU  68           H        GLU  68   9.161   2.247  -4.669
  514    HA   GLU  68           HA       GLU  68   6.597   3.029  -4.721
  515   1HB   GLU  68          1HB       GLU  68   7.470   5.293  -5.571
  516   2HB   GLU  68          2HB       GLU  68   8.130   4.656  -4.071
  517   1HG   GLU  68          1HG       GLU  68  10.155   4.894  -4.913
  518   2HG   GLU  68          2HG       GLU  68   9.767   3.662  -6.113
  519    H    GLY  69           H        GLY  69   5.306   2.000  -6.270
  520   1HA   GLY  69          1HA       GLY  69   5.770   2.868  -9.051
  521   2HA   GLY  69          2HA       GLY  69   4.179   2.946  -8.321
  522    H    GLY  70           H        GLY  70   3.942   0.498  -7.050
  523   1HA   GLY  70          1HA       GLY  70   4.307  -1.864  -7.546
  524   2HA   GLY  70          2HA       GLY  70   4.414  -1.428  -9.245
  525    H    LEU  71           H        LEU  71   2.514  -2.878  -7.064
  526    HA   LEU  71           HA       LEU  71  -0.059  -1.853  -7.842
  527   1HB   LEU  71          1HB       LEU  71   0.514  -3.206  -9.810
  528   2HB   LEU  71          2HB       LEU  71   0.810  -4.592  -8.778
  529    HG   LEU  71           HG       LEU  71  -1.471  -4.897  -8.318
  530   1HD1  LEU  71          1HD1      LEU  71  -1.895  -2.111  -9.382
  531   2HD1  LEU  71          2HD1      LEU  71  -3.201  -3.236  -9.007
  532   3HD1  LEU  71          3HD1      LEU  71  -2.125  -2.675  -7.726
  533   1HD2  LEU  71          1HD2      LEU  71  -0.640  -4.525 -11.051
  534   2HD2  LEU  71          2HD2      LEU  71  -1.692  -5.755 -10.354
  535   3HD2  LEU  71          3HD2      LEU  71  -2.365  -4.209 -10.867
  536    H    ILE  72           H        ILE  72   1.130  -2.022  -5.418
  537    HA   ILE  72           HA       ILE  72   0.973  -4.169  -3.819
  538    HB   ILE  72           HB       ILE  72   0.497  -1.276  -3.371
  539   1HG1  ILE  72          1HG1      ILE  72   2.297  -3.238  -1.954
  540   2HG1  ILE  72          2HG1      ILE  72   2.722  -2.466  -3.479
  541   1HG2  ILE  72          1HG2      ILE  72  -0.525  -3.377  -1.534
  542   2HG2  ILE  72          2HG2      ILE  72   0.408  -2.069  -0.800
  543   3HG2  ILE  72          3HG2      ILE  72  -1.038  -1.702  -1.738
  544   1HD1  ILE  72          1HD1      ILE  72   1.862  -0.513  -1.562
  545   2HD1  ILE  72          2HD1      ILE  72   3.170  -1.504  -0.915
  546   3HD1  ILE  72          3HD1      ILE  72   3.386  -0.641  -2.437
  547    H    VAL  73           H        VAL  73  -1.814  -1.970  -3.500
  548    HA   VAL  73           HA       VAL  73  -3.566  -4.328  -3.716
  549    HB   VAL  73           HB       VAL  73  -4.892  -3.594  -1.830
  550   1HG1  VAL  73          1HG1      VAL  73  -2.152  -4.438  -1.650
  551   2HG1  VAL  73          2HG1      VAL  73  -2.595  -3.482  -0.235
  552   3HG1  VAL  73          3HG1      VAL  73  -3.536  -4.910  -0.664
  553   1HG2  VAL  73          1HG2      VAL  73  -2.947  -1.303  -1.728
  554   2HG2  VAL  73          2HG2      VAL  73  -4.700  -1.237  -1.902
  555   3HG2  VAL  73          3HG2      VAL  73  -3.983  -1.742  -0.372
  556    H    VAL  74           H        VAL  74  -5.577  -4.029  -4.549
  557    HA   VAL  74           HA       VAL  74  -6.107  -1.406  -5.789
  558    HB   VAL  74           HB       VAL  74  -7.145  -4.142  -6.560
  559   1HG1  VAL  74          1HG1      VAL  74  -8.512  -1.956  -7.029
  560   2HG1  VAL  74          2HG1      VAL  74  -7.330  -1.744  -8.320
  561   3HG1  VAL  74          3HG1      VAL  74  -8.337  -3.191  -8.276
  562   1HG2  VAL  74          1HG2      VAL  74  -4.827  -2.521  -7.479
  563   2HG2  VAL  74          2HG2      VAL  74  -4.976  -4.266  -7.275
  564   3HG2  VAL  74          3HG2      VAL  74  -5.711  -3.476  -8.670
  565    H    VAL  75           H        VAL  75  -8.075  -0.399  -5.450
  566    HA   VAL  75           HA       VAL  75  -9.943  -1.772  -3.645
  567    HB   VAL  75           HB       VAL  75 -10.431   0.721  -2.906
  568   1HG1  VAL  75          1HG1      VAL  75  -8.325  -1.164  -1.912
  569   2HG1  VAL  75          2HG1      VAL  75  -8.662   0.355  -1.080
  570   3HG1  VAL  75          3HG1      VAL  75  -9.933  -0.853  -1.260
  571   1HG2  VAL  75          1HG2      VAL  75  -7.582   0.778  -3.863
  572   2HG2  VAL  75          2HG2      VAL  75  -8.895   1.881  -4.270
  573   3HG2  VAL  75          3HG2      VAL  75  -8.203   1.894  -2.648
  574    H    GLU  76           H        GLU  76 -12.120  -0.749  -3.578
  575    HA   GLU  76           HA       GLU  76 -13.144  -0.564  -6.243
  576   1HB   GLU  76          1HB       GLU  76 -14.174  -1.391  -3.845
  577   2HB   GLU  76          2HB       GLU  76 -14.945   0.179  -4.040
  578   1HG   GLU  76          1HG       GLU  76 -16.070  -0.463  -5.955
  579   2HG   GLU  76          2HG       GLU  76 -14.956  -1.788  -6.286
  580    H    ALA  77           H        ALA  77 -12.657   1.698  -3.576
  581    HA   ALA  77           HA       ALA  77 -12.684   3.958  -3.458
  582   1HB   ALA  77          1HB       ALA  77 -11.017   3.914  -5.117
  583   2HB   ALA  77          2HB       ALA  77 -12.191   3.593  -6.392
  584   3HB   ALA  77          3HB       ALA  77 -12.163   5.166  -5.594
  585    H    GLU  78           H        GLU  78 -14.231   5.427  -3.206
  586    HA   GLU  78           HA       GLU  78 -16.399   6.173  -3.110
  587   1HB   GLU  78          1HB       GLU  78 -17.038   7.354  -5.109
  588   2HB   GLU  78          2HB       GLU  78 -15.300   7.499  -4.884
  589   1HG   GLU  78          1HG       GLU  78 -15.002   5.653  -6.527
  590   2HG   GLU  78          2HG       GLU  78 -16.738   5.709  -6.827
  591    H    GLY  79           H        GLY  79 -16.248   3.276  -3.379
  592   1HA   GLY  79          1HA       GLY  79 -18.854   2.538  -3.548
  593   2HA   GLY  79          2HA       GLY  79 -17.540   1.454  -3.974
  594    H    THR  80           H        THR  80 -16.908   1.280  -6.183
  595    HA   THR  80           HA       THR  80 -18.068   2.644  -8.316
  596    HB   THR  80           HB       THR  80 -17.173   0.954  -9.731
  597    HG1  THR  80           HG1      THR  80 -17.486  -0.683  -7.477
  598   1HG2  THR  80          1HG2      THR  80 -15.562   2.208  -8.036
  599   2HG2  THR  80          2HG2      THR  80 -15.260   0.550  -7.518
  600   3HG2  THR  80          3HG2      THR  80 -14.981   1.014  -9.197
  601    H    ALA  81           H        ALA  81 -20.300   2.838  -7.845
  602    HA   ALA  81           HA       ALA  81 -22.506   2.258  -7.875
  603   1HB   ALA  81          1HB       ALA  81 -23.177   0.814  -9.732
  604   2HB   ALA  81          2HB       ALA  81 -21.499   0.313  -9.949
  605   3HB   ALA  81          3HB       ALA  81 -21.963   1.990 -10.236

  No H/Q in entry =         605
  Start of MODEL   16
    1    H1   ALA   1           H1       ALA   1 -12.423   6.866  -9.396
    2    H2   ALA   1           H2       ALA   1 -13.596   7.155 -10.615
    3    H3   ALA   1           H3       ALA   1 -14.094   6.695  -9.041
    4    HA   ALA   1           HA       ALA   1 -14.284   4.746 -10.068
    5   1HB   ALA   1          1HB       ALA   1 -13.595   5.553 -12.252
    6   2HB   ALA   1          2HB       ALA   1 -11.904   5.501 -11.758
    7   3HB   ALA   1          3HB       ALA   1 -12.826   4.005 -11.899
    8    H    LEU   2           H        LEU   2 -12.632   2.734 -10.347
    9    HA   LEU   2           HA       LEU   2 -11.694   2.133  -7.823
   10   1HB   LEU   2          1HB       LEU   2 -11.025   1.040 -10.536
   11   2HB   LEU   2          2HB       LEU   2 -10.225   0.423  -9.105
   12    HG   LEU   2           HG       LEU   2 -12.969   0.368  -8.514
   13   1HD1  LEU   2          1HD1      LEU   2 -12.985   0.574 -11.151
   14   2HD1  LEU   2          2HD1      LEU   2 -12.654  -1.155 -11.039
   15   3HD1  LEU   2          3HD1      LEU   2 -14.104  -0.485 -10.291
   16   1HD2  LEU   2          1HD2      LEU   2 -10.720  -1.457  -8.804
   17   2HD2  LEU   2          2HD2      LEU   2 -12.019  -1.444  -7.613
   18   3HD2  LEU   2          3HD2      LEU   2 -12.268  -2.210  -9.181
   19    H    VAL   3           H        VAL   3  -9.336   1.474  -7.371
   20    HA   VAL   3           HA       VAL   3  -7.422   3.406  -8.447
   21    HB   VAL   3           HB       VAL   3  -8.279   3.209  -5.578
   22   1HG1  VAL   3          1HG1      VAL   3  -5.873   2.749  -5.512
   23   2HG1  VAL   3          2HG1      VAL   3  -5.571   4.210  -6.456
   24   3HG1  VAL   3          3HG1      VAL   3  -6.248   4.336  -4.832
   25   1HG2  VAL   3          1HG2      VAL   3  -7.912   5.332  -7.626
   26   2HG2  VAL   3          2HG2      VAL   3  -9.251   5.054  -6.513
   27   3HG2  VAL   3          3HG2      VAL   3  -7.746   5.760  -5.924
   28    H    GLU   4           H        GLU   4  -5.174   2.874  -7.845
   29    HA   GLU   4           HA       GLU   4  -4.746   0.103  -7.021
   30   1HB   GLU   4          1HB       GLU   4  -3.225   1.036  -9.409
   31   2HB   GLU   4          2HB       GLU   4  -3.686  -0.593  -8.941
   32   1HG   GLU   4          1HG       GLU   4  -5.027  -0.263 -10.759
   33   2HG   GLU   4          2HG       GLU   4  -6.099   0.247  -9.456
   34    H    LEU   5           H        LEU   5  -3.589   0.561  -5.218
   35    HA   LEU   5           HA       LEU   5  -1.714   2.677  -5.006
   36   1HB   LEU   5          1HB       LEU   5  -2.387   0.272  -3.364
   37   2HB   LEU   5          2HB       LEU   5  -0.905   1.143  -3.016
   38    HG   LEU   5           HG       LEU   5  -2.500   2.018  -1.529
   39   1HD1  LEU   5          1HD1      LEU   5  -1.144   3.697  -2.817
   40   2HD1  LEU   5          2HD1      LEU   5  -2.569   3.965  -3.819
   41   3HD1  LEU   5          3HD1      LEU   5  -2.628   4.315  -2.091
   42   1HD2  LEU   5          1HD2      LEU   5  -4.387   1.109  -3.213
   43   2HD2  LEU   5          2HD2      LEU   5  -4.714   2.240  -1.899
   44   3HD2  LEU   5          3HD2      LEU   5  -4.489   2.838  -3.544
   45    H    LYS   6           H        LYS   6   0.457   2.749  -5.390
   46    HA   LYS   6           HA       LYS   6   1.772   0.245  -6.187
   47   1HB   LYS   6          1HB       LYS   6   2.549   2.668  -7.699
   48   2HB   LYS   6          2HB       LYS   6   2.445   0.995  -8.221
   49   1HG   LYS   6          1HG       LYS   6  -0.184   1.640  -7.805
   50   2HG   LYS   6          2HG       LYS   6   0.493   3.144  -8.431
   51   1HD   LYS   6          1HD       LYS   6   1.527   1.747 -10.273
   52   2HD   LYS   6          2HD       LYS   6   0.509   0.421  -9.711
   53   1HE   LYS   6          1HE       LYS   6  -1.465   1.945 -10.010
   54   2HE   LYS   6          2HE       LYS   6  -0.376   3.090 -10.792
   55   1HZ   LYS   6          1HZ       LYS   6  -0.257   0.394 -11.831
   56   2HZ   LYS   6          2HZ       LYS   6  -1.737   1.176 -12.078
   57   3HZ   LYS   6          3HZ       LYS   6  -0.307   1.871 -12.655
   58    H    VAL   7           H        VAL   7   2.391   0.756  -3.819
   59    HA   VAL   7           HA       VAL   7   4.022   1.245  -2.313
   60    HB   VAL   7           HB       VAL   7   5.715   1.712  -4.762
   61   1HG1  VAL   7          1HG1      VAL   7   6.688   2.557  -2.663
   62   2HG1  VAL   7          2HG1      VAL   7   6.523   0.943  -1.971
   63   3HG1  VAL   7          3HG1      VAL   7   7.602   1.208  -3.340
   64   1HG2  VAL   7          1HG2      VAL   7   4.595  -0.478  -4.778
   65   2HG2  VAL   7          2HG2      VAL   7   6.347  -0.610  -4.620
   66   3HG2  VAL   7          3HG2      VAL   7   5.315  -0.830  -3.207
   67    HA   PRO   8           HA       PRO   8   3.758   5.643  -1.891
   68   1HB   PRO   8          1HB       PRO   8   5.303   5.972   0.319
   69   2HB   PRO   8          2HB       PRO   8   3.650   5.353   0.368
   70   1HG   PRO   8          1HG       PRO   8   6.231   3.878   0.558
   71   2HG   PRO   8          2HG       PRO   8   4.693   3.560   1.377
   72   1HD   PRO   8          1HD       PRO   8   5.608   2.170  -0.809
   73   2HD   PRO   8          2HD       PRO   8   3.899   2.305  -0.360
   74    H    ASP   9           H        ASP   9   5.558   7.383  -0.966
   75    HA   ASP   9           HA       ASP   9   7.650   7.310  -3.016
   76   1HB   ASP   9          1HB       ASP   9   5.945   9.360  -1.857
   77   2HB   ASP   9          2HB       ASP   9   7.641   9.840  -1.871
   78    H    ILE  10           H        ILE  10   8.815   5.772  -1.532
   79    HA   ILE  10           HA       ILE  10   9.849   6.656   0.945
   80    HB   ILE  10           HB       ILE  10  11.670   4.869   0.427
   81   1HG1  ILE  10          1HG1      ILE  10  11.147   3.263  -1.250
   82   2HG1  ILE  10          2HG1      ILE  10   9.569   3.980  -1.548
   83   1HG2  ILE  10          1HG2      ILE  10   9.652   4.737   1.960
   84   2HG2  ILE  10          2HG2      ILE  10   8.831   3.899   0.639
   85   3HG2  ILE  10          3HG2      ILE  10  10.287   3.206   1.358
   86   1HD1  ILE  10          1HD1      ILE  10  12.087   5.507  -2.072
   87   2HD1  ILE  10          2HD1      ILE  10  11.432   4.372  -3.253
   88   3HD1  ILE  10          3HD1      ILE  10  10.474   5.760  -2.739
   89    H    GLY  11           H        GLY  11  10.600   7.628  -2.205
   90   1HA   GLY  11          1HA       GLY  11  12.365   9.601  -1.568
   91   2HA   GLY  11          2HA       GLY  11  12.358   8.793  -3.127
   92    H    GLY  12           H        GLY  12  13.513   6.580  -3.074
   93   1HA   GLY  12          1HA       GLY  12  15.376   5.681  -1.370
   94   2HA   GLY  12          2HA       GLY  12  16.177   7.095  -2.040
   95    H    HIS  13           H        HIS  13  14.238   4.376  -3.284
   96    HA   HIS  13           HA       HIS  13  15.236   4.250  -5.831
   97   1HB   HIS  13          1HB       HIS  13  16.896   2.275  -5.474
   98   2HB   HIS  13          2HB       HIS  13  17.464   3.924  -5.237
   99    HD1  HIS  13           HD1      HIS  13  16.390   0.891  -3.258
  100    HD2  HIS  13           HD2      HIS  13  18.413   4.480  -2.722
  101    HE1  HIS  13           HE1      HIS  13  17.368   0.772  -0.944
  102    HE2  HIS  13           HE2      HIS  13  18.669   2.913  -0.680
  103    H    GLU  14           H        GLU  14  15.085   1.954  -6.778
  104    HA   GLU  14           HA       GLU  14  12.566   0.885  -6.045
  105   1HB   GLU  14          1HB       GLU  14  13.035  -0.834  -7.749
  106   2HB   GLU  14          2HB       GLU  14  13.356   0.788  -8.346
  107   1HG   GLU  14          1HG       GLU  14  15.741  -0.281  -7.195
  108   2HG   GLU  14          2HG       GLU  14  15.071  -1.438  -8.344
  109    H    ASN  15           H        ASN  15  12.448  -1.662  -5.890
  110    HA   ASN  15           HA       ASN  15  12.527  -3.343  -4.340
  111   1HB   ASN  15          1HB       ASN  15  14.902  -4.258  -4.042
  112   2HB   ASN  15          2HB       ASN  15  14.270  -4.181  -5.683
  113   1HD2  ASN  15          2HD2      ASN  15  16.389  -2.616  -3.366
  114   2HD2  ASN  15          1HD2      ASN  15  17.386  -1.823  -4.532
  115    H    VAL  16           H        VAL  16  11.720  -2.193  -2.550
  116    HA   VAL  16           HA       VAL  16  13.770  -1.541  -0.534
  117    HB   VAL  16           HB       VAL  16  12.321   0.157   0.403
  118   1HG1  VAL  16          1HG1      VAL  16  13.056   0.317  -2.476
  119   2HG1  VAL  16          2HG1      VAL  16  12.126   1.635  -1.765
  120   3HG1  VAL  16          3HG1      VAL  16  13.699   1.203  -1.094
  121   1HG2  VAL  16          1HG2      VAL  16  10.289  -1.191  -0.998
  122   2HG2  VAL  16          2HG2      VAL  16  10.128   0.218   0.050
  123   3HG2  VAL  16          3HG2      VAL  16  10.374   0.432  -1.684
  124    H    ASP  17           H        ASP  17  13.072  -1.832   1.702
  125    HA   ASP  17           HA       ASP  17  11.454  -4.243   1.950
  126   1HB   ASP  17          1HB       ASP  17  13.817  -3.574   3.089
  127   2HB   ASP  17          2HB       ASP  17  12.705  -3.064   4.357
  128    H    ILE  18           H        ILE  18   9.447  -4.272   2.751
  129    HA   ILE  18           HA       ILE  18   8.187  -1.807   3.503
  130    HB   ILE  18           HB       ILE  18   7.177  -4.646   3.329
  131   1HG1  ILE  18          1HG1      ILE  18   5.974  -2.454   1.767
  132   2HG1  ILE  18          2HG1      ILE  18   7.647  -2.827   1.367
  133   1HG2  ILE  18          1HG2      ILE  18   5.658  -2.173   4.151
  134   2HG2  ILE  18          2HG2      ILE  18   4.908  -3.703   3.692
  135   3HG2  ILE  18          3HG2      ILE  18   5.941  -3.620   5.119
  136   1HD1  ILE  18          1HD1      ILE  18   6.107  -5.241   1.585
  137   2HD1  ILE  18          2HD1      ILE  18   5.355  -4.119   0.451
  138   3HD1  ILE  18          3HD1      ILE  18   7.033  -4.615   0.221
  139    H    ILE  19           H        ILE  19   6.937  -1.615   5.508
  140    HA   ILE  19           HA       ILE  19   8.202  -3.043   7.748
  141    HB   ILE  19           HB       ILE  19   9.212  -1.100   8.263
  142   1HG1  ILE  19          1HG1      ILE  19   6.403  -0.284   9.033
  143   2HG1  ILE  19          2HG1      ILE  19   7.560  -1.142  10.046
  144   1HG2  ILE  19          1HG2      ILE  19   7.183   0.351   6.575
  145   2HG2  ILE  19          2HG2      ILE  19   8.553   1.120   7.378
  146   3HG2  ILE  19          3HG2      ILE  19   8.830  -0.091   6.127
  147   1HD1  ILE  19          1HD1      ILE  19   8.894   1.163   9.295
  148   2HD1  ILE  19          2HD1      ILE  19   7.238   1.689   9.593
  149   3HD1  ILE  19          3HD1      ILE  19   8.132   0.840  10.853
  150    H    ALA  20           H        ALA  20   5.390  -1.239   6.604
  151    HA   ALA  20           HA       ALA  20   3.768  -2.612   8.644
  152   1HB   ALA  20          1HB       ALA  20   3.384   0.079   7.358
  153   2HB   ALA  20          2HB       ALA  20   3.722  -0.262   9.054
  154   3HB   ALA  20          3HB       ALA  20   2.165  -0.715   8.355
  155    H    VAL  21           H        VAL  21   1.594  -3.207   8.004
  156    HA   VAL  21           HA       VAL  21   0.933  -3.213   5.201
  157    HB   VAL  21           HB       VAL  21   2.444  -5.139   5.311
  158   1HG1  VAL  21          1HG1      VAL  21   1.776  -5.557   7.790
  159   2HG1  VAL  21          2HG1      VAL  21   0.517  -6.573   7.088
  160   3HG1  VAL  21          3HG1      VAL  21   2.215  -6.921   6.762
  161   1HG2  VAL  21          1HG2      VAL  21  -0.040  -5.055   4.170
  162   2HG2  VAL  21          2HG2      VAL  21   1.179  -6.292   3.863
  163   3HG2  VAL  21          3HG2      VAL  21  -0.089  -6.579   5.055
  164    H    GLU  22           H        GLU  22  -1.151  -2.707   5.207
  165    HA   GLU  22           HA       GLU  22  -2.943  -4.101   7.069
  166   1HB   GLU  22          1HB       GLU  22  -3.110  -1.143   6.474
  167   2HB   GLU  22          2HB       GLU  22  -4.149  -2.057   7.559
  168   1HG   GLU  22          1HG       GLU  22  -1.551  -2.525   8.461
  169   2HG   GLU  22          2HG       GLU  22  -1.612  -0.808   8.069
  170    H    VAL  23           H        VAL  23  -3.189  -5.327   5.000
  171    HA   VAL  23           HA       VAL  23  -5.445  -4.222   3.522
  172    HB   VAL  23           HB       VAL  23  -4.331  -5.200   1.381
  173   1HG1  VAL  23          1HG1      VAL  23  -3.850  -2.564   2.692
  174   2HG1  VAL  23          2HG1      VAL  23  -3.067  -2.920   1.152
  175   3HG1  VAL  23          3HG1      VAL  23  -4.826  -2.957   1.276
  176   1HG2  VAL  23          1HG2      VAL  23  -2.386  -6.140   2.598
  177   2HG2  VAL  23          2HG2      VAL  23  -1.926  -5.034   1.304
  178   3HG2  VAL  23          3HG2      VAL  23  -1.874  -4.498   2.983
  179    H    ASN  24           H        ASN  24  -6.993  -5.687   3.582
  180    HA   ASN  24           HA       ASN  24  -6.257  -8.543   3.542
  181   1HB   ASN  24          1HB       ASN  24  -7.425  -7.329   5.626
  182   2HB   ASN  24          2HB       ASN  24  -8.863  -7.713   4.686
  183   1HD2  ASN  24          2HD2      ASN  24  -8.110  -8.771   7.242
  184   2HD2  ASN  24          1HD2      ASN  24  -7.941 -10.479   7.052
  185    H    VAL  25           H        VAL  25  -7.082  -6.502   1.412
  186    HA   VAL  25           HA       VAL  25  -8.206  -6.546  -0.558
  187    HB   VAL  25           HB       VAL  25  -8.826  -9.378   0.277
  188   1HG1  VAL  25          1HG1      VAL  25  -9.480  -7.878  -2.233
  189   2HG1  VAL  25          2HG1      VAL  25  -9.228  -9.623  -2.260
  190   3HG1  VAL  25          3HG1      VAL  25 -10.513  -8.932  -1.269
  191   1HG2  VAL  25          1HG2      VAL  25  -6.421  -8.485  -0.266
  192   2HG2  VAL  25          2HG2      VAL  25  -6.966 -10.047  -0.879
  193   3HG2  VAL  25          3HG2      VAL  25  -6.978  -8.632  -1.933
  194    H    GLY  26           H        GLY  26 -10.487  -8.750   0.989
  195   1HA   GLY  26          1HA       GLY  26 -12.754  -8.531   1.306
  196   2HA   GLY  26          2HA       GLY  26 -12.679  -7.031   0.391
  197    H    ASP  27           H        ASP  27 -11.338  -5.283   1.706
  198    HA   ASP  27           HA       ASP  27 -12.556  -5.217   4.368
  199   1HB   ASP  27          1HB       ASP  27  -9.857  -5.420   3.936
  200   2HB   ASP  27          2HB       ASP  27 -10.070  -3.679   4.092
  201    H    THR  28           H        THR  28 -12.798  -2.977   5.232
  202    HA   THR  28           HA       THR  28 -13.810  -1.245   3.132
  203    HB   THR  28           HB       THR  28 -13.952  -1.056   6.146
  204    HG1  THR  28           HG1      THR  28 -15.939  -1.858   5.919
  205   1HG2  THR  28          1HG2      THR  28 -15.107   0.736   4.038
  206   2HG2  THR  28          2HG2      THR  28 -15.793   0.603   5.658
  207   3HG2  THR  28          3HG2      THR  28 -14.138   1.173   5.446
  208    H    ILE  29           H        ILE  29 -12.648   0.334   2.271
  209    HA   ILE  29           HA       ILE  29 -10.425   1.464   3.843
  210    HB   ILE  29           HB       ILE  29  -9.404   2.070   1.645
  211   1HG1  ILE  29          1HG1      ILE  29 -10.820   0.058   0.114
  212   2HG1  ILE  29          2HG1      ILE  29 -11.916   1.324   0.657
  213   1HG2  ILE  29          1HG2      ILE  29  -8.710   0.090   2.934
  214   2HG2  ILE  29          2HG2      ILE  29  -9.885  -0.879   2.045
  215   3HG2  ILE  29          3HG2      ILE  29  -8.528  -0.142   1.195
  216   1HD1  ILE  29          1HD1      ILE  29  -9.377   1.738  -0.902
  217   2HD1  ILE  29          2HD1      ILE  29 -11.019   1.816  -1.541
  218   3HD1  ILE  29          3HD1      ILE  29 -10.475   3.007  -0.359
  219    H    ALA  30           H        ALA  30 -10.282   3.635   4.082
  220    HA   ALA  30           HA       ALA  30 -12.304   5.285   2.713
  221   1HB   ALA  30          1HB       ALA  30 -11.321   5.873   5.488
  222   2HB   ALA  30          2HB       ALA  30 -12.753   6.494   4.668
  223   3HB   ALA  30          3HB       ALA  30 -12.699   4.812   5.193
  224    H    VAL  31           H        VAL  31 -11.535   7.763   3.548
  225    HA   VAL  31           HA       VAL  31  -9.041   8.102   2.084
  226    HB   VAL  31           HB       VAL  31 -10.857  10.257   3.165
  227   1HG1  VAL  31          1HG1      VAL  31  -8.312  10.403   2.078
  228   2HG1  VAL  31          2HG1      VAL  31  -9.382  10.822   0.739
  229   3HG1  VAL  31          3HG1      VAL  31  -9.461  11.729   2.249
  230   1HG2  VAL  31          1HG2      VAL  31 -11.321   8.394   1.043
  231   2HG2  VAL  31          2HG2      VAL  31 -12.354   9.701   1.623
  232   3HG2  VAL  31          3HG2      VAL  31 -11.149  10.017   0.375
  233    H    ASP  32           H        ASP  32  -8.618   6.914   4.545
  234    HA   ASP  32           HA       ASP  32  -6.566   8.378   5.643
  235   1HB   ASP  32          1HB       ASP  32  -7.727   8.983   7.888
  236   2HB   ASP  32          2HB       ASP  32  -7.921  10.067   6.513
  237    H    ASP  33           H        ASP  33  -6.225   5.970   5.264
  238    HA   ASP  33           HA       ASP  33  -6.369   4.650   7.855
  239   1HB   ASP  33          1HB       ASP  33  -7.053   2.491   6.568
  240   2HB   ASP  33          2HB       ASP  33  -8.299   3.650   7.024
  241    H    THR  34           H        THR  34  -4.220   4.539   8.153
  242    HA   THR  34           HA       THR  34  -2.221   4.311   6.300
  243    HB   THR  34           HB       THR  34  -1.087   2.947   8.274
  244    HG1  THR  34           HG1      THR  34  -2.170   2.999  10.077
  245   1HG2  THR  34          1HG2      THR  34  -0.641   5.313   7.467
  246   2HG2  THR  34          2HG2      THR  34  -1.738   5.822   8.752
  247   3HG2  THR  34          3HG2      THR  34  -0.265   4.936   9.150
  248    H    LEU  35           H        LEU  35  -1.808   2.896   4.800
  249    HA   LEU  35           HA       LEU  35  -2.798   0.161   5.034
  250   1HB   LEU  35          1HB       LEU  35  -1.465   1.587   2.725
  251   2HB   LEU  35          2HB       LEU  35  -2.114  -0.041   2.669
  252    HG   LEU  35           HG       LEU  35  -3.637   2.542   2.931
  253   1HD1  LEU  35          1HD1      LEU  35  -2.832   1.425   0.694
  254   2HD1  LEU  35          2HD1      LEU  35  -4.220   0.375   0.977
  255   3HD1  LEU  35          3HD1      LEU  35  -4.449   2.118   0.834
  256   1HD2  LEU  35          1HD2      LEU  35  -4.579   0.936   4.509
  257   2HD2  LEU  35          2HD2      LEU  35  -5.665   1.196   3.143
  258   3HD2  LEU  35          3HD2      LEU  35  -4.688  -0.270   3.227
  259    H    ILE  36           H        ILE  36   0.187   1.992   4.770
  260    HA   ILE  36           HA       ILE  36   1.647  -0.181   5.973
  261    HB   ILE  36           HB       ILE  36   3.274  -0.553   4.299
  262   1HG1  ILE  36          1HG1      ILE  36   3.337   1.873   3.519
  263   2HG1  ILE  36          2HG1      ILE  36   3.516   0.657   2.262
  264   1HG2  ILE  36          1HG2      ILE  36   1.163  -1.750   3.993
  265   2HG2  ILE  36          2HG2      ILE  36   0.611  -0.483   2.901
  266   3HG2  ILE  36          3HG2      ILE  36   2.002  -1.478   2.469
  267   1HD1  ILE  36          1HD1      ILE  36   0.935   2.013   2.933
  268   2HD1  ILE  36          2HD1      ILE  36   2.053   2.556   1.681
  269   3HD1  ILE  36          3HD1      ILE  36   1.280   0.978   1.549
  270    H    THR  37           H        THR  37   4.227   0.757   5.316
  271    HA   THR  37           HA       THR  37   4.444   3.550   5.894
  272    HB   THR  37           HB       THR  37   5.210   1.553   8.033
  273    HG1  THR  37           HG1      THR  37   3.177   3.488   7.823
  274   1HG2  THR  37          1HG2      THR  37   5.863   4.436   7.706
  275   2HG2  THR  37          2HG2      THR  37   5.566   3.790   9.321
  276   3HG2  THR  37          3HG2      THR  37   6.855   3.114   8.322
  277    H    LEU  38           H        LEU  38   5.294   1.871   3.882
  278    HA   LEU  38           HA       LEU  38   7.622   0.644   3.723
  279   1HB   LEU  38          1HB       LEU  38   6.078   1.678   1.866
  280   2HB   LEU  38          2HB       LEU  38   7.326   2.912   1.822
  281    HG   LEU  38           HG       LEU  38   8.932   0.833   1.621
  282   1HD1  LEU  38          1HD1      LEU  38   6.875  -0.681   1.889
  283   2HD1  LEU  38          2HD1      LEU  38   6.530  -0.264   0.211
  284   3HD1  LEU  38          3HD1      LEU  38   8.043  -1.070   0.625
  285   1HD2  LEU  38          1HD2      LEU  38   7.466   2.461  -0.326
  286   2HD2  LEU  38          2HD2      LEU  38   9.193   2.142  -0.179
  287   3HD2  LEU  38          3HD2      LEU  38   8.149   0.971  -0.976
  288    H    GLU  39           H        GLU  39   9.817   1.082   3.381
  289    HA   GLU  39           HA       GLU  39  10.961   3.657   3.720
  290   1HB   GLU  39          1HB       GLU  39  10.366   3.439   6.019
  291   2HB   GLU  39          2HB       GLU  39  10.957   1.784   6.083
  292   1HG   GLU  39          1HG       GLU  39  13.251   2.655   5.690
  293   2HG   GLU  39          2HG       GLU  39  12.602   4.289   5.812
  294    H    THR  40           H        THR  40  13.302   3.598   3.670
  295    HA   THR  40           HA       THR  40  14.372   1.024   2.713
  296    HB   THR  40           HB       THR  40  15.525   2.080   0.970
  297    HG1  THR  40           HG1      THR  40  15.634   4.411   0.870
  298   1HG2  THR  40          1HG2      THR  40  13.096   2.069   0.539
  299   2HG2  THR  40          2HG2      THR  40  13.013   3.714   1.164
  300   3HG2  THR  40          3HG2      THR  40  13.949   3.372  -0.292
  301    H    ASP  41           H        ASP  41  15.421   4.241   3.779
  302    HA   ASP  41           HA       ASP  41  16.790   3.479   6.054
  303   1HB   ASP  41          1HB       ASP  41  18.250   2.900   3.593
  304   2HB   ASP  41          2HB       ASP  41  19.148   3.957   4.677
  305    H    LYS  42           H        LYS  42  16.697   5.586   3.254
  306    HA   LYS  42           HA       LYS  42  17.917   7.801   4.650
  307   1HB   LYS  42          1HB       LYS  42  16.912   7.284   1.905
  308   2HB   LYS  42          2HB       LYS  42  16.903   8.956   2.450
  309   1HG   LYS  42          1HG       LYS  42  19.010   9.038   1.751
  310   2HG   LYS  42          2HG       LYS  42  19.405   8.082   3.181
  311   1HD   LYS  42          1HD       LYS  42  19.103   6.025   1.870
  312   2HD   LYS  42          2HD       LYS  42  18.748   6.999   0.442
  313   1HE   LYS  42          1HE       LYS  42  20.969   6.637   0.091
  314   2HE   LYS  42          2HE       LYS  42  21.075   8.098   1.072
  315   1HZ   LYS  42          1HZ       LYS  42  21.153   6.373   3.008
  316   2HZ   LYS  42          2HZ       LYS  42  21.695   5.324   1.798
  317   3HZ   LYS  42          3HZ       LYS  42  22.554   6.741   2.134
  318    H    ALA  43           H        ALA  43  14.683   6.737   3.775
  319    HA   ALA  43           HA       ALA  43  13.544   8.543   5.720
  320   1HB   ALA  43          1HB       ALA  43  13.624   9.309   2.981
  321   2HB   ALA  43          2HB       ALA  43  12.886  10.153   4.343
  322   3HB   ALA  43          3HB       ALA  43  11.948   8.977   3.421
  323    H    THR  44           H        THR  44  11.285   8.128   6.132
  324    HA   THR  44           HA       THR  44  10.454   5.435   5.267
  325    HB   THR  44           HB       THR  44   9.553   5.017   7.382
  326    HG1  THR  44           HG1      THR  44   9.032   6.599   8.841
  327   1HG2  THR  44          1HG2      THR  44  12.166   5.590   7.314
  328   2HG2  THR  44          2HG2      THR  44  11.629   6.765   8.515
  329   3HG2  THR  44          3HG2      THR  44  11.322   5.046   8.765
  330    H    MET  45           H        MET  45   8.731   5.415   3.985
  331    HA   MET  45           HA       MET  45   6.852   7.675   4.152
  332   1HB   MET  45          1HB       MET  45   8.258   6.711   1.959
  333   2HB   MET  45          2HB       MET  45   6.632   6.087   1.733
  334   1HG   MET  45          1HG       MET  45   6.775   8.176   0.614
  335   2HG   MET  45          2HG       MET  45   5.774   8.401   2.047
  336   1HE   MET  45          1HE       MET  45   5.694  10.350   2.844
  337   2HE   MET  45          2HE       MET  45   6.782  10.279   4.231
  338   3HE   MET  45          3HE       MET  45   6.934  11.585   3.056
  339    H    ASP  46           H        ASP  46   4.689   7.327   4.254
  340    HA   ASP  46           HA       ASP  46   3.783   4.536   4.427
  341   1HB   ASP  46          1HB       ASP  46   2.331   5.108   6.285
  342   2HB   ASP  46          2HB       ASP  46   3.987   5.549   6.689
  343    H    VAL  47           H        VAL  47   1.263   4.534   4.437
  344    HA   VAL  47           HA       VAL  47   0.213   6.552   2.601
  345    HB   VAL  47           HB       VAL  47   0.195   3.580   2.077
  346   1HG1  VAL  47          1HG1      VAL  47  -1.804   5.528   1.409
  347   2HG1  VAL  47          2HG1      VAL  47  -1.021   4.954  -0.065
  348   3HG1  VAL  47          3HG1      VAL  47  -1.766   3.802   1.043
  349   1HG2  VAL  47          1HG2      VAL  47   1.423   5.956   0.733
  350   2HG2  VAL  47          2HG2      VAL  47   2.171   4.432   1.209
  351   3HG2  VAL  47          3HG2      VAL  47   1.077   4.485  -0.174
  352    HA   PRO  48           HA       PRO  48  -3.179   5.750   5.444
  353   1HB   PRO  48          1HB       PRO  48  -4.391   8.104   5.192
  354   2HB   PRO  48          2HB       PRO  48  -2.827   7.979   6.004
  355   1HG   PRO  48          1HG       PRO  48  -3.471   8.989   3.281
  356   2HG   PRO  48          2HG       PRO  48  -2.219   9.525   4.411
  357   1HD   PRO  48          1HD       PRO  48  -1.884   7.769   2.222
  358   2HD   PRO  48          2HD       PRO  48  -0.703   8.104   3.503
  359    H    ALA  49           H        ALA  49  -3.211   4.885   2.569
  360    HA   ALA  49           HA       ALA  49  -4.676   4.288   0.926
  361   1HB   ALA  49          1HB       ALA  49  -6.369   3.013   1.707
  362   2HB   ALA  49          2HB       ALA  49  -5.577   3.308   3.255
  363   3HB   ALA  49          3HB       ALA  49  -6.972   4.276   2.780
  364    H    GLU  50           H        GLU  50  -4.883   5.983  -0.449
  365    HA   GLU  50           HA       GLU  50  -6.693   8.164   0.205
  366   1HB   GLU  50          1HB       GLU  50  -4.307   8.039  -1.201
  367   2HB   GLU  50          2HB       GLU  50  -5.517   8.222  -2.461
  368   1HG   GLU  50          1HG       GLU  50  -5.141  10.038  -0.091
  369   2HG   GLU  50          2HG       GLU  50  -4.652  10.374  -1.751
  370    H    VAL  51           H        VAL  51  -8.415   6.414   0.165
  371    HA   VAL  51           HA       VAL  51  -9.978   6.767  -2.181
  372    HB   VAL  51           HB       VAL  51 -10.119   4.129  -2.465
  373   1HG1  VAL  51          1HG1      VAL  51  -9.264   6.188  -3.981
  374   2HG1  VAL  51          2HG1      VAL  51  -7.782   5.238  -3.866
  375   3HG1  VAL  51          3HG1      VAL  51  -9.253   4.506  -4.507
  376   1HG2  VAL  51          1HG2      VAL  51  -7.320   4.632  -1.470
  377   2HG2  VAL  51          2HG2      VAL  51  -8.496   3.469  -0.859
  378   3HG2  VAL  51          3HG2      VAL  51  -7.760   3.227  -2.442
  379    H    ALA  52           H        ALA  52 -12.111   5.985  -1.959
  380    HA   ALA  52           HA       ALA  52 -12.775   5.020   0.749
  381   1HB   ALA  52          1HB       ALA  52 -14.439   6.844  -0.961
  382   2HB   ALA  52          2HB       ALA  52 -14.773   6.338   0.693
  383   3HB   ALA  52          3HB       ALA  52 -13.391   7.380   0.353
  384    H    GLY  53           H        GLY  53 -12.624   2.877  -0.277
  385   1HA   GLY  53          1HA       GLY  53 -13.992   1.856  -2.367
  386   2HA   GLY  53          2HA       GLY  53 -15.250   2.054  -1.161
  387    H    VAL  54           H        VAL  54 -13.365  -0.182  -2.481
  388    HA   VAL  54           HA       VAL  54 -12.720  -1.626  -0.019
  389    HB   VAL  54           HB       VAL  54 -14.497  -2.744  -2.193
  390   1HG1  VAL  54          1HG1      VAL  54 -12.923  -4.002  -0.055
  391   2HG1  VAL  54          2HG1      VAL  54 -14.608  -4.516  -0.131
  392   3HG1  VAL  54          3HG1      VAL  54 -13.569  -4.689  -1.545
  393   1HG2  VAL  54          1HG2      VAL  54 -15.054  -1.895   0.642
  394   2HG2  VAL  54          2HG2      VAL  54 -15.797  -1.295  -0.840
  395   3HG2  VAL  54          3HG2      VAL  54 -16.137  -2.934  -0.285
  396    H    VAL  55           H        VAL  55 -10.976  -2.983  -0.214
  397    HA   VAL  55           HA       VAL  55  -9.438  -2.788  -2.642
  398    HB   VAL  55           HB       VAL  55  -8.823  -4.382  -0.153
  399   1HG1  VAL  55          1HG1      VAL  55  -7.624  -5.199  -2.131
  400   2HG1  VAL  55          2HG1      VAL  55  -7.043  -3.564  -2.453
  401   3HG1  VAL  55          3HG1      VAL  55  -6.525  -4.412  -0.996
  402   1HG2  VAL  55          1HG2      VAL  55  -9.041  -1.746  -0.142
  403   2HG2  VAL  55          2HG2      VAL  55  -7.752  -2.571   0.735
  404   3HG2  VAL  55          3HG2      VAL  55  -7.424  -1.851  -0.841
  405    H    LYS  56           H        LYS  56  -8.708  -4.500  -3.910
  406    HA   LYS  56           HA       LYS  56 -10.350  -6.947  -3.756
  407   1HB   LYS  56          1HB       LYS  56  -9.248  -6.498  -6.391
  408   2HB   LYS  56          2HB       LYS  56 -10.925  -6.749  -5.920
  409   1HG   LYS  56          1HG       LYS  56  -9.625  -4.072  -5.603
  410   2HG   LYS  56          2HG       LYS  56 -10.286  -4.587  -7.155
  411   1HD   LYS  56          1HD       LYS  56 -11.790  -4.384  -4.547
  412   2HD   LYS  56          2HD       LYS  56 -11.931  -3.290  -5.923
  413   1HE   LYS  56          1HE       LYS  56 -12.545  -5.424  -7.250
  414   2HE   LYS  56          2HE       LYS  56 -12.847  -6.130  -5.663
  415   1HZ   LYS  56          1HZ       LYS  56 -14.213  -3.895  -5.410
  416   2HZ   LYS  56          2HZ       LYS  56 -14.326  -4.059  -7.090
  417   3HZ   LYS  56          3HZ       LYS  56 -14.892  -5.292  -6.078
  418    H    GLU  57           H        GLU  57  -7.302  -5.510  -4.788
  419    HA   GLU  57           HA       GLU  57  -6.083  -8.145  -4.605
  420   1HB   GLU  57          1HB       GLU  57  -5.644  -5.831  -6.364
  421   2HB   GLU  57          2HB       GLU  57  -4.179  -6.636  -5.816
  422   1HG   GLU  57          1HG       GLU  57  -6.483  -8.046  -7.138
  423   2HG   GLU  57          2HG       GLU  57  -5.063  -7.447  -7.993
  424    H    VAL  58           H        VAL  58  -3.765  -8.148  -3.907
  425    HA   VAL  58           HA       VAL  58  -2.899  -6.041  -2.132
  426    HB   VAL  58           HB       VAL  58  -4.420  -7.219  -0.640
  427   1HG1  VAL  58          1HG1      VAL  58  -3.552  -9.494  -2.037
  428   2HG1  VAL  58          2HG1      VAL  58  -3.040  -9.715  -0.364
  429   3HG1  VAL  58          3HG1      VAL  58  -4.738  -9.413  -0.734
  430   1HG2  VAL  58          1HG2      VAL  58  -1.961  -6.473  -0.014
  431   2HG2  VAL  58          2HG2      VAL  58  -3.008  -7.284   1.151
  432   3HG2  VAL  58          3HG2      VAL  58  -1.774  -8.200   0.287
  433    H    LYS  59           H        LYS  59  -0.811  -5.886  -2.549
  434    HA   LYS  59           HA       LYS  59   0.773  -8.341  -2.873
  435   1HB   LYS  59          1HB       LYS  59   1.419  -5.931  -4.520
  436   2HB   LYS  59          2HB       LYS  59   1.781  -7.624  -4.833
  437   1HG   LYS  59          1HG       LYS  59  -0.942  -7.629  -4.895
  438   2HG   LYS  59          2HG       LYS  59  -0.569  -6.036  -5.551
  439   1HD   LYS  59          1HD       LYS  59   1.114  -7.286  -7.048
  440   2HD   LYS  59          2HD       LYS  59   0.211  -8.733  -6.594
  441   1HE   LYS  59          1HE       LYS  59  -1.632  -8.123  -7.778
  442   2HE   LYS  59          2HE       LYS  59  -1.372  -6.400  -7.506
  443   1HZ   LYS  59          1HZ       LYS  59   0.724  -7.385  -9.089
  444   2HZ   LYS  59          2HZ       LYS  59  -0.734  -7.904  -9.771
  445   3HZ   LYS  59          3HZ       LYS  59  -0.465  -6.256  -9.505
  446    H    VAL  60           H        VAL  60   1.128  -7.729  -0.557
  447    HA   VAL  60           HA       VAL  60   3.672  -6.577  -0.228
  448    HB   VAL  60           HB       VAL  60   2.907  -4.410  -0.440
  449   1HG1  VAL  60          1HG1      VAL  60   0.358  -5.232   0.940
  450   2HG1  VAL  60          2HG1      VAL  60   0.734  -3.593   0.410
  451   3HG1  VAL  60          3HG1      VAL  60   0.575  -4.890  -0.777
  452   1HG2  VAL  60          1HG2      VAL  60   3.993  -4.624   1.744
  453   2HG2  VAL  60          2HG2      VAL  60   2.759  -3.364   1.757
  454   3HG2  VAL  60          3HG2      VAL  60   2.428  -4.932   2.494
  455    H    LYS  61           H        LYS  61   4.339  -6.509   2.044
  456    HA   LYS  61           HA       LYS  61   2.645  -7.573   4.082
  457   1HB   LYS  61          1HB       LYS  61   3.567  -9.511   2.446
  458   2HB   LYS  61          2HB       LYS  61   4.902  -9.422   3.586
  459   1HG   LYS  61          1HG       LYS  61   3.742 -10.790   4.886
  460   2HG   LYS  61          2HG       LYS  61   2.645  -9.441   5.191
  461   1HD   LYS  61          1HD       LYS  61   2.211 -10.983   2.701
  462   2HD   LYS  61          2HD       LYS  61   1.825 -11.797   4.219
  463   1HE   LYS  61          1HE       LYS  61   0.755  -9.234   4.474
  464   2HE   LYS  61          2HE       LYS  61   0.382  -9.723   2.822
  465   1HZ   LYS  61          1HZ       LYS  61  -0.092 -11.794   4.754
  466   2HZ   LYS  61          2HZ       LYS  61  -1.034 -10.414   5.023
  467   3HZ   LYS  61          3HZ       LYS  61  -1.102 -11.206   3.531
  468    H    VAL  62           H        VAL  62   4.658  -8.726   5.688
  469    HA   VAL  62           HA       VAL  62   6.282  -6.340   6.262
  470    HB   VAL  62           HB       VAL  62   5.424  -8.551   8.135
  471   1HG1  VAL  62          1HG1      VAL  62   7.461  -6.499   8.337
  472   2HG1  VAL  62          2HG1      VAL  62   6.263  -6.371   9.624
  473   3HG1  VAL  62          3HG1      VAL  62   7.143  -7.881   9.385
  474   1HG2  VAL  62          1HG2      VAL  62   4.084  -6.194   7.235
  475   2HG2  VAL  62          2HG2      VAL  62   3.531  -7.417   8.377
  476   3HG2  VAL  62          3HG2      VAL  62   4.459  -6.031   8.950
  477    H    GLY  63           H        GLY  63   7.735  -7.263   4.539
  478   1HA   GLY  63          1HA       GLY  63   9.363  -9.509   5.502
  479   2HA   GLY  63          2HA       GLY  63  10.149  -7.965   5.215
  480    H    ASP  64           H        ASP  64   8.832  -7.161   2.893
  481    HA   ASP  64           HA       ASP  64   9.937  -9.097   0.985
  482   1HB   ASP  64          1HB       ASP  64   7.997  -8.573  -0.548
  483   2HB   ASP  64          2HB       ASP  64   7.596  -9.541   0.867
  484    H    LYS  65           H        LYS  65  10.018  -8.043  -1.283
  485    HA   LYS  65           HA       LYS  65  11.236  -5.403  -0.940
  486   1HB   LYS  65          1HB       LYS  65  11.399  -7.367  -3.232
  487   2HB   LYS  65          2HB       LYS  65  12.242  -5.827  -3.164
  488   1HG   LYS  65          1HG       LYS  65  12.720  -7.528  -0.840
  489   2HG   LYS  65          2HG       LYS  65  13.258  -8.228  -2.367
  490   1HD   LYS  65          1HD       LYS  65  14.327  -5.910  -2.782
  491   2HD   LYS  65          2HD       LYS  65  14.129  -5.685  -1.043
  492   1HE   LYS  65          1HE       LYS  65  15.496  -7.582  -0.568
  493   2HE   LYS  65          2HE       LYS  65  15.528  -8.056  -2.266
  494   1HZ   LYS  65          1HZ       LYS  65  16.584  -5.434  -1.434
  495   2HZ   LYS  65          2HZ       LYS  65  17.537  -6.823  -1.278
  496   3HZ   LYS  65          3HZ       LYS  65  16.970  -6.353  -2.801
  497    H    ILE  66           H        ILE  66  10.398  -3.595  -1.802
  498    HA   ILE  66           HA       ILE  66   8.338  -3.826  -3.865
  499    HB   ILE  66           HB       ILE  66   7.778  -3.245  -1.137
  500   1HG1  ILE  66          1HG1      ILE  66   5.445  -3.165  -1.988
  501   2HG1  ILE  66          2HG1      ILE  66   6.082  -3.159  -3.631
  502   1HG2  ILE  66          1HG2      ILE  66   7.435  -0.850  -2.912
  503   2HG2  ILE  66          2HG2      ILE  66   6.405  -1.132  -1.512
  504   3HG2  ILE  66          3HG2      ILE  66   8.146  -0.942  -1.303
  505   1HD1  ILE  66          1HD1      ILE  66   7.119  -5.322  -1.975
  506   2HD1  ILE  66          2HD1      ILE  66   5.372  -5.373  -2.220
  507   3HD1  ILE  66          3HD1      ILE  66   6.458  -5.354  -3.609
  508    H    SER  67           H        SER  67   8.046  -1.936  -5.145
  509    HA   SER  67           HA       SER  67   9.982   0.223  -4.739
  510   1HB   SER  67          1HB       SER  67   9.669  -0.878  -7.505
  511   2HB   SER  67          2HB       SER  67  11.021   0.006  -6.799
  512    HG   SER  67           HG       SER  67  10.312  -2.706  -6.462
  513    H    GLU  68           H        GLU  68   9.312   2.209  -5.422
  514    HA   GLU  68           HA       GLU  68   6.721   2.958  -5.541
  515   1HB   GLU  68          1HB       GLU  68   8.772   4.282  -7.306
  516   2HB   GLU  68          2HB       GLU  68   7.401   5.024  -6.495
  517   1HG   GLU  68          1HG       GLU  68   8.854   5.645  -4.938
  518   2HG   GLU  68          2HG       GLU  68   8.832   3.963  -4.410
  519    H    GLY  69           H        GLY  69   5.369   1.590  -6.684
  520   1HA   GLY  69          1HA       GLY  69   5.632   1.743  -9.622
  521   2HA   GLY  69          2HA       GLY  69   4.090   1.759  -8.787
  522    H    GLY  70           H        GLY  70   4.070  -0.274  -7.101
  523   1HA   GLY  70          1HA       GLY  70   4.925  -2.618  -7.019
  524   2HA   GLY  70          2HA       GLY  70   4.773  -2.613  -8.769
  525    H    LEU  71           H        LEU  71   2.189  -0.921  -8.099
  526    HA   LEU  71           HA       LEU  71  -0.030  -1.313  -7.757
  527   1HB   LEU  71          1HB       LEU  71   0.243  -2.390  -9.910
  528   2HB   LEU  71          2HB       LEU  71   0.776  -3.871  -9.139
  529    HG   LEU  71           HG       LEU  71  -1.382  -4.413  -8.400
  530   1HD1  LEU  71          1HD1      LEU  71  -1.829  -1.505  -8.564
  531   2HD1  LEU  71          2HD1      LEU  71  -3.211  -2.524  -8.965
  532   3HD1  LEU  71          3HD1      LEU  71  -2.424  -2.684  -7.395
  533   1HD2  LEU  71          1HD2      LEU  71  -1.104  -3.472 -11.151
  534   2HD2  LEU  71          2HD2      LEU  71  -1.725  -5.001 -10.529
  535   3HD2  LEU  71          3HD2      LEU  71  -2.774  -3.584 -10.597
  536    H    ILE  72           H        ILE  72   0.996  -1.539  -5.424
  537    HA   ILE  72           HA       ILE  72   1.078  -3.954  -4.087
  538    HB   ILE  72           HB       ILE  72   0.697  -1.126  -3.297
  539   1HG1  ILE  72          1HG1      ILE  72   2.443  -3.156  -1.964
  540   2HG1  ILE  72          2HG1      ILE  72   2.845  -2.580  -3.580
  541   1HG2  ILE  72          1HG2      ILE  72  -0.296  -3.381  -1.630
  542   2HG2  ILE  72          2HG2      ILE  72   0.618  -2.104  -0.828
  543   3HG2  ILE  72          3HG2      ILE  72  -0.850  -1.710  -1.720
  544   1HD1  ILE  72          1HD1      ILE  72   2.247  -0.533  -1.541
  545   2HD1  ILE  72          2HD1      ILE  72   3.755  -1.431  -1.372
  546   3HD1  ILE  72          3HD1      ILE  72   3.425  -0.532  -2.850
  547    H    VAL  73           H        VAL  73  -1.672  -1.684  -3.778
  548    HA   VAL  73           HA       VAL  73  -3.461  -4.017  -3.847
  549    HB   VAL  73           HB       VAL  73  -4.799  -3.141  -2.040
  550   1HG1  VAL  73          1HG1      VAL  73  -2.269  -4.227  -1.771
  551   2HG1  VAL  73          2HG1      VAL  73  -2.278  -2.878  -0.633
  552   3HG1  VAL  73          3HG1      VAL  73  -3.510  -4.135  -0.520
  553   1HG2  VAL  73          1HG2      VAL  73  -4.392  -0.746  -2.488
  554   2HG2  VAL  73          2HG2      VAL  73  -4.193  -1.163  -0.786
  555   3HG2  VAL  73          3HG2      VAL  73  -2.775  -0.916  -1.805
  556    H    VAL  74           H        VAL  74  -5.574  -3.646  -4.546
  557    HA   VAL  74           HA       VAL  74  -6.009  -1.084  -5.955
  558    HB   VAL  74           HB       VAL  74  -7.028  -3.784  -6.855
  559   1HG1  VAL  74          1HG1      VAL  74  -8.159  -1.553  -7.511
  560   2HG1  VAL  74          2HG1      VAL  74  -6.752  -1.335  -8.549
  561   3HG1  VAL  74          3HG1      VAL  74  -7.803  -2.732  -8.772
  562   1HG2  VAL  74          1HG2      VAL  74  -4.455  -2.408  -7.389
  563   2HG2  VAL  74          2HG2      VAL  74  -4.817  -4.131  -7.285
  564   3HG2  VAL  74          3HG2      VAL  74  -5.242  -3.225  -8.738
  565    H    VAL  75           H        VAL  75  -7.953  -0.094  -5.569
  566    HA   VAL  75           HA       VAL  75  -9.912  -1.612  -3.999
  567    HB   VAL  75           HB       VAL  75 -10.492   0.494  -2.868
  568   1HG1  VAL  75          1HG1      VAL  75  -8.265  -1.156  -2.447
  569   2HG1  VAL  75          2HG1      VAL  75  -7.724   0.494  -2.137
  570   3HG1  VAL  75          3HG1      VAL  75  -9.108  -0.159  -1.260
  571   1HG2  VAL  75          1HG2      VAL  75  -9.422   1.832  -4.835
  572   2HG2  VAL  75          2HG2      VAL  75  -9.399   2.485  -3.198
  573   3HG2  VAL  75          3HG2      VAL  75  -7.960   1.709  -3.856
  574    H    GLU  76           H        GLU  76 -12.058  -0.351  -3.897
  575    HA   GLU  76           HA       GLU  76 -12.972  -0.073  -6.629
  576   1HB   GLU  76          1HB       GLU  76 -14.099  -0.985  -4.196
  577   2HB   GLU  76          2HB       GLU  76 -15.027   0.428  -4.688
  578   1HG   GLU  76          1HG       GLU  76 -15.438  -0.587  -6.864
  579   2HG   GLU  76          2HG       GLU  76 -14.491  -1.996  -6.390
  580    H    ALA  77           H        ALA  77 -12.731   1.889  -3.705
  581    HA   ALA  77           HA       ALA  77 -12.874   4.113  -3.323
  582   1HB   ALA  77          1HB       ALA  77 -11.913   5.562  -4.925
  583   2HB   ALA  77          2HB       ALA  77 -11.059   4.023  -5.032
  584   3HB   ALA  77          3HB       ALA  77 -12.269   4.446  -6.243
  585    H    GLU  78           H        GLU  78 -14.596   5.319  -2.963
  586    HA   GLU  78           HA       GLU  78 -16.757   6.047  -3.074
  587   1HB   GLU  78          1HB       GLU  78 -17.235   7.435  -4.980
  588   2HB   GLU  78          2HB       GLU  78 -15.533   7.607  -4.572
  589   1HG   GLU  78          1HG       GLU  78 -14.833   6.423  -6.436
  590   2HG   GLU  78          2HG       GLU  78 -16.404   5.654  -6.659
  591    H    GLY  79           H        GLY  79 -16.603   3.278  -3.398
  592   1HA   GLY  79          1HA       GLY  79 -17.783   1.463  -4.168
  593   2HA   GLY  79          2HA       GLY  79 -18.061   2.355  -5.656
  594    H    THR  80           H        THR  80 -19.110   2.402  -2.248
  595    HA   THR  80           HA       THR  80 -21.883   2.385  -3.116
  596    HB   THR  80           HB       THR  80 -22.440   1.948  -0.829
  597    HG1  THR  80           HG1      THR  80 -20.980   2.190   0.824
  598   1HG2  THR  80          1HG2      THR  80 -20.812   0.254  -2.221
  599   2HG2  THR  80          2HG2      THR  80 -19.968   0.420  -0.681
  600   3HG2  THR  80          3HG2      THR  80 -21.643  -0.125  -0.713
  601    H    ALA  81           H        ALA  81 -23.448   3.899  -2.237
  602    HA   ALA  81           HA       ALA  81 -22.276   6.559  -1.743
  603   1HB   ALA  81          1HB       ALA  81 -24.680   5.782  -3.373
  604   2HB   ALA  81          2HB       ALA  81 -24.400   7.434  -2.819
  605   3HB   ALA  81          3HB       ALA  81 -23.238   6.654  -3.893

  No H/Q in entry =         605
  Start of MODEL   17
    1    H1   ALA   1           H1       ALA   1 -12.540   4.401 -12.232
    2    H2   ALA   1           H2       ALA   1 -14.156   4.739 -12.701
    3    H3   ALA   1           H3       ALA   1 -13.697   4.870 -11.055
    4    HA   ALA   1           HA       ALA   1 -14.760   2.902 -11.081
    5   1HB   ALA   1          1HB       ALA   1 -14.019   1.244 -13.034
    6   2HB   ALA   1          2HB       ALA   1 -13.759   2.777 -13.865
    7   3HB   ALA   1          3HB       ALA   1 -15.350   2.387 -13.209
    8    H    LEU   2           H        LEU   2 -13.876   1.793  -9.479
    9    HA   LEU   2           HA       LEU   2 -12.382   0.667  -8.185
   10   1HB   LEU   2          1HB       LEU   2 -11.550  -0.166 -10.948
   11   2HB   LEU   2          2HB       LEU   2 -10.703  -0.757  -9.530
   12    HG   LEU   2           HG       LEU   2 -13.586  -1.091  -9.304
   13   1HD1  LEU   2          1HD1      LEU   2 -13.429  -1.316 -11.735
   14   2HD1  LEU   2          2HD1      LEU   2 -12.167  -2.532 -11.539
   15   3HD1  LEU   2          3HD1      LEU   2 -13.802  -2.858 -10.963
   16   1HD2  LEU   2          1HD2      LEU   2 -11.088  -2.578  -8.809
   17   2HD2  LEU   2          2HD2      LEU   2 -12.523  -2.398  -7.801
   18   3HD2  LEU   2          3HD2      LEU   2 -12.522  -3.550  -9.136
   19    H    VAL   3           H        VAL   3  -9.901   0.290  -7.857
   20    HA   VAL   3           HA       VAL   3  -8.256   2.460  -8.848
   21    HB   VAL   3           HB       VAL   3  -9.245   2.345  -6.017
   22   1HG1  VAL   3          1HG1      VAL   3  -6.808   2.230  -5.806
   23   2HG1  VAL   3          2HG1      VAL   3  -6.652   3.646  -6.849
   24   3HG1  VAL   3          3HG1      VAL   3  -7.428   3.796  -5.273
   25   1HG2  VAL   3          1HG2      VAL   3  -9.202   4.263  -8.243
   26   2HG2  VAL   3          2HG2      VAL   3 -10.394   4.027  -6.965
   27   3HG2  VAL   3          3HG2      VAL   3  -8.923   4.945  -6.640
   28    H    GLU   4           H        GLU   4  -6.008   2.275  -8.136
   29    HA   GLU   4           HA       GLU   4  -5.257  -0.355  -7.088
   30   1HB   GLU   4          1HB       GLU   4  -3.895   0.820  -9.507
   31   2HB   GLU   4          2HB       GLU   4  -3.718  -0.799  -8.844
   32   1HG   GLU   4          1HG       GLU   4  -5.062  -1.242 -10.621
   33   2HG   GLU   4          2HG       GLU   4  -6.283  -0.947  -9.384
   34    H    LEU   5           H        LEU   5  -4.180   0.163  -5.289
   35    HA   LEU   5           HA       LEU   5  -2.811   2.619  -4.912
   36   1HB   LEU   5          1HB       LEU   5  -3.556   0.373  -3.327
   37   2HB   LEU   5          2HB       LEU   5  -1.842   0.656  -3.089
   38    HG   LEU   5           HG       LEU   5  -3.373   1.799  -1.448
   39   1HD1  LEU   5          1HD1      LEU   5  -1.025   2.492  -1.920
   40   2HD1  LEU   5          2HD1      LEU   5  -1.660   3.677  -3.061
   41   3HD1  LEU   5          3HD1      LEU   5  -2.068   3.794  -1.350
   42   1HD2  LEU   5          1HD2      LEU   5  -4.487   2.819  -3.915
   43   2HD2  LEU   5          2HD2      LEU   5  -5.132   2.880  -2.275
   44   3HD2  LEU   5          3HD2      LEU   5  -4.010   4.124  -2.828
   45    H    LYS   6           H        LYS   6  -0.431   2.455  -3.994
   46    HA   LYS   6           HA       LYS   6   1.261   0.607  -5.416
   47   1HB   LYS   6          1HB       LYS   6   1.006   3.478  -6.237
   48   2HB   LYS   6          2HB       LYS   6   2.541   2.642  -6.420
   49   1HG   LYS   6          1HG       LYS   6   1.780   1.997  -8.408
   50   2HG   LYS   6          2HG       LYS   6   0.741   0.879  -7.521
   51   1HD   LYS   6          1HD       LYS   6  -1.021   2.588  -7.458
   52   2HD   LYS   6          2HD       LYS   6   0.018   3.682  -8.374
   53   1HE   LYS   6          1HE       LYS   6  -0.280   1.065  -9.624
   54   2HE   LYS   6          2HE       LYS   6  -1.811   1.918  -9.433
   55   1HZ   LYS   6          1HZ       LYS   6  -0.113   3.829 -10.361
   56   2HZ   LYS   6          2HZ       LYS   6   0.359   2.453 -11.222
   57   3HZ   LYS   6          3HZ       LYS   6  -1.246   2.981 -11.288
   58    H    VAL   7           H        VAL   7   3.554   0.961  -4.947
   59    HA   VAL   7           HA       VAL   7   4.099   1.176  -2.253
   60    HB   VAL   7           HB       VAL   7   5.976   1.664  -4.568
   61   1HG1  VAL   7          1HG1      VAL   7   6.821   2.490  -2.378
   62   2HG1  VAL   7          2HG1      VAL   7   6.673   0.846  -1.758
   63   3HG1  VAL   7          3HG1      VAL   7   7.787   1.192  -3.081
   64   1HG2  VAL   7          1HG2      VAL   7   4.766  -0.501  -4.585
   65   2HG2  VAL   7          2HG2      VAL   7   6.513  -0.663  -4.429
   66   3HG2  VAL   7          3HG2      VAL   7   5.481  -0.863  -3.016
   67    HA   PRO   8           HA       PRO   8   4.073   5.497  -1.349
   68   1HB   PRO   8          1HB       PRO   8   6.303   5.115   0.516
   69   2HB   PRO   8          2HB       PRO   8   4.640   5.607   0.841
   70   1HG   PRO   8          1HG       PRO   8   5.580   3.176   1.551
   71   2HG   PRO   8          2HG       PRO   8   3.895   3.435   1.055
   72   1HD   PRO   8          1HD       PRO   8   6.181   2.298  -0.499
   73   2HD   PRO   8          2HD       PRO   8   4.477   1.791  -0.468
   74    H    ASP   9           H        ASP   9   6.217   6.989  -0.388
   75    HA   ASP   9           HA       ASP   9   8.030   7.066  -2.707
   76   1HB   ASP   9          1HB       ASP   9   6.448   8.911  -2.787
   77   2HB   ASP   9          2HB       ASP   9   6.833   9.347  -1.127
   78    H    ILE  10           H        ILE  10   8.878   5.536  -0.742
   79    HA   ILE  10           HA       ILE  10  10.036   6.509   1.520
   80    HB   ILE  10           HB       ILE  10  11.953   4.772   0.931
   81   1HG1  ILE  10          1HG1      ILE  10  11.254   3.040  -0.578
   82   2HG1  ILE  10          2HG1      ILE  10   9.686   3.797  -0.817
   83   1HG2  ILE  10          1HG2      ILE  10  10.052   4.695   2.633
   84   2HG2  ILE  10          2HG2      ILE  10   9.184   3.733   1.435
   85   3HG2  ILE  10          3HG2      ILE  10  10.718   3.156   2.090
   86   1HD1  ILE  10          1HD1      ILE  10  12.147   5.287  -1.580
   87   2HD1  ILE  10          2HD1      ILE  10  11.557   3.989  -2.618
   88   3HD1  ILE  10          3HD1      ILE  10  10.519   5.368  -2.258
   89    H    GLY  11           H        GLY  11  11.066   7.129  -1.738
   90   1HA   GLY  11          1HA       GLY  11  13.027   9.019  -0.724
   91   2HA   GLY  11          2HA       GLY  11  12.477   8.876  -2.387
   92    H    GLY  12           H        GLY  12  13.819   6.339  -0.296
   93   1HA   GLY  12          1HA       GLY  12  15.551   4.875  -0.682
   94   2HA   GLY  12          2HA       GLY  12  16.448   6.338  -1.058
   95    H    HIS  13           H        HIS  13  14.666   3.638  -2.371
   96    HA   HIS  13           HA       HIS  13  14.849   4.389  -5.102
   97   1HB   HIS  13          1HB       HIS  13  16.628   2.864  -5.808
   98   2HB   HIS  13          2HB       HIS  13  17.252   4.061  -4.676
   99    HD1  HIS  13           HD1      HIS  13  17.632   3.176  -2.171
  100    HD2  HIS  13           HD2      HIS  13  17.033   0.262  -5.072
  101    HE1  HIS  13           HE1      HIS  13  18.425   1.025  -1.138
  102    HE2  HIS  13           HE2      HIS  13  17.967  -0.739  -2.878
  103    H    GLU  14           H        GLU  14  14.961   2.040  -6.398
  104    HA   GLU  14           HA       GLU  14  12.468   0.845  -5.774
  105   1HB   GLU  14          1HB       GLU  14  13.127  -0.800  -7.572
  106   2HB   GLU  14          2HB       GLU  14  13.131   0.890  -8.059
  107   1HG   GLU  14          1HG       GLU  14  15.346   0.921  -8.419
  108   2HG   GLU  14          2HG       GLU  14  15.692  -0.131  -7.047
  109    H    ASN  15           H        ASN  15  12.397  -1.694  -5.794
  110    HA   ASN  15           HA       ASN  15  12.516  -3.481  -4.373
  111   1HB   ASN  15          1HB       ASN  15  14.833  -4.455  -4.225
  112   2HB   ASN  15          2HB       ASN  15  14.285  -4.096  -5.859
  113   1HD2  ASN  15          2HD2      ASN  15  16.563  -3.397  -3.394
  114   2HD2  ASN  15          1HD2      ASN  15  17.538  -2.293  -4.299
  115    H    VAL  16           H        VAL  16  11.725  -2.244  -2.553
  116    HA   VAL  16           HA       VAL  16  13.779  -1.896  -0.466
  117    HB   VAL  16           HB       VAL  16  12.387  -0.164   0.556
  118   1HG1  VAL  16          1HG1      VAL  16  13.317   0.177  -2.261
  119   2HG1  VAL  16          2HG1      VAL  16  12.526   1.515  -1.428
  120   3HG1  VAL  16          3HG1      VAL  16  14.003   0.815  -0.766
  121   1HG2  VAL  16          1HG2      VAL  16  10.471  -1.082  -1.443
  122   2HG2  VAL  16          2HG2      VAL  16  10.203  -0.249   0.088
  123   3HG2  VAL  16          3HG2      VAL  16  10.614   0.674  -1.358
  124    H    ASP  17           H        ASP  17  12.983  -2.241   1.743
  125    HA   ASP  17           HA       ASP  17  11.110  -4.483   1.788
  126   1HB   ASP  17          1HB       ASP  17  13.510  -3.810   3.227
  127   2HB   ASP  17          2HB       ASP  17  12.190  -4.074   4.361
  128    H    ILE  18           H        ILE  18   9.058  -4.136   2.321
  129    HA   ILE  18           HA       ILE  18   8.060  -1.701   3.278
  130    HB   ILE  18           HB       ILE  18   6.853  -4.471   3.293
  131   1HG1  ILE  18          1HG1      ILE  18   5.825  -2.281   1.595
  132   2HG1  ILE  18          2HG1      ILE  18   7.426  -2.889   1.186
  133   1HG2  ILE  18          1HG2      ILE  18   5.581  -1.831   3.993
  134   2HG2  ILE  18          2HG2      ILE  18   4.672  -3.292   3.609
  135   3HG2  ILE  18          3HG2      ILE  18   5.731  -3.256   5.018
  136   1HD1  ILE  18          1HD1      ILE  18   5.579  -5.052   1.646
  137   2HD1  ILE  18          2HD1      ILE  18   4.985  -3.947   0.407
  138   3HD1  ILE  18          3HD1      ILE  18   6.574  -4.696   0.235
  139    H    ILE  19           H        ILE  19   6.895  -1.392   5.365
  140    HA   ILE  19           HA       ILE  19   8.312  -2.820   7.524
  141    HB   ILE  19           HB       ILE  19   8.954  -0.940   8.573
  142   1HG1  ILE  19          1HG1      ILE  19   6.458   0.518   7.681
  143   2HG1  ILE  19          2HG1      ILE  19   6.639  -0.324   9.214
  144   1HG2  ILE  19          1HG2      ILE  19   8.290   0.259   5.888
  145   2HG2  ILE  19          2HG2      ILE  19   9.326   1.013   7.101
  146   3HG2  ILE  19          3HG2      ILE  19   9.800  -0.517   6.368
  147   1HD1  ILE  19          1HD1      ILE  19   8.242   2.059   8.318
  148   2HD1  ILE  19          2HD1      ILE  19   6.923   2.068   9.488
  149   3HD1  ILE  19          3HD1      ILE  19   8.420   1.211   9.853
  150    H    ALA  20           H        ALA  20   5.343  -1.147   6.612
  151    HA   ALA  20           HA       ALA  20   3.962  -2.562   8.797
  152   1HB   ALA  20          1HB       ALA  20   3.433   0.101   7.521
  153   2HB   ALA  20          2HB       ALA  20   3.747  -0.262   9.217
  154   3HB   ALA  20          3HB       ALA  20   2.216  -0.737   8.484
  155    H    VAL  21           H        VAL  21   1.665  -3.084   8.340
  156    HA   VAL  21           HA       VAL  21   1.027  -3.476   5.524
  157    HB   VAL  21           HB       VAL  21   0.943  -5.782   7.472
  158   1HG1  VAL  21          1HG1      VAL  21  -0.760  -5.882   5.733
  159   2HG1  VAL  21          2HG1      VAL  21   0.474  -5.657   4.494
  160   3HG1  VAL  21          3HG1      VAL  21   0.468  -7.122   5.478
  161   1HG2  VAL  21          1HG2      VAL  21   2.951  -5.071   5.349
  162   2HG2  VAL  21          2HG2      VAL  21   3.236  -5.401   7.058
  163   3HG2  VAL  21          3HG2      VAL  21   2.762  -6.708   5.976
  164    H    GLU  22           H        GLU  22  -1.133  -3.391   5.095
  165    HA   GLU  22           HA       GLU  22  -3.104  -3.820   7.143
  166   1HB   GLU  22          1HB       GLU  22  -2.475  -1.045   6.163
  167   2HB   GLU  22          2HB       GLU  22  -4.065  -1.463   6.788
  168   1HG   GLU  22          1HG       GLU  22  -2.612  -2.388   8.801
  169   2HG   GLU  22          2HG       GLU  22  -1.479  -1.178   8.202
  170    H    VAL  23           H        VAL  23  -2.662  -5.064   4.701
  171    HA   VAL  23           HA       VAL  23  -5.160  -4.407   3.326
  172    HB   VAL  23           HB       VAL  23  -3.937  -4.933   1.124
  173   1HG1  VAL  23          1HG1      VAL  23  -3.845  -2.400   2.688
  174   2HG1  VAL  23          2HG1      VAL  23  -3.009  -2.473   1.137
  175   3HG1  VAL  23          3HG1      VAL  23  -4.741  -2.790   1.220
  176   1HG2  VAL  23          1HG2      VAL  23  -1.824  -5.497   2.635
  177   2HG2  VAL  23          2HG2      VAL  23  -1.666  -4.863   0.997
  178   3HG2  VAL  23          3HG2      VAL  23  -1.511  -3.779   2.381
  179    H    ASN  24           H        ASN  24  -6.351  -6.177   3.374
  180    HA   ASN  24           HA       ASN  24  -5.084  -8.767   2.808
  181   1HB   ASN  24          1HB       ASN  24  -6.673  -7.979   5.191
  182   2HB   ASN  24          2HB       ASN  24  -6.959  -9.584   4.526
  183   1HD2  ASN  24          2HD2      ASN  24  -4.573 -10.453   3.754
  184   2HD2  ASN  24          1HD2      ASN  24  -3.470 -10.530   5.082
  185    H    VAL  25           H        VAL  25  -7.015  -6.671   1.523
  186    HA   VAL  25           HA       VAL  25  -8.716  -6.718   0.017
  187    HB   VAL  25           HB       VAL  25  -8.275  -9.701   0.153
  188   1HG1  VAL  25          1HG1      VAL  25 -10.499  -9.145  -0.721
  189   2HG1  VAL  25          2HG1      VAL  25  -9.756  -8.086  -1.919
  190   3HG1  VAL  25          3HG1      VAL  25  -9.456  -9.823  -1.972
  191   1HG2  VAL  25          1HG2      VAL  25  -6.375  -8.161  -0.592
  192   2HG2  VAL  25          2HG2      VAL  25  -6.821  -9.486  -1.667
  193   3HG2  VAL  25          3HG2      VAL  25  -7.363  -7.844  -2.019
  194    H    GLY  26           H        GLY  26 -10.782  -6.291   0.446
  195   1HA   GLY  26          1HA       GLY  26 -12.230  -8.085   2.292
  196   2HA   GLY  26          2HA       GLY  26 -12.990  -7.152   1.012
  197    H    ASP  27           H        ASP  27 -10.513  -5.668   2.915
  198    HA   ASP  27           HA       ASP  27 -12.241  -4.578   4.914
  199   1HB   ASP  27          1HB       ASP  27  -9.385  -4.343   4.175
  200   2HB   ASP  27          2HB       ASP  27 -10.077  -2.955   5.008
  201    H    THR  28           H        THR  28 -13.226  -2.618   5.019
  202    HA   THR  28           HA       THR  28 -13.742  -1.255   2.561
  203    HB   THR  28           HB       THR  28 -14.503  -0.560   5.405
  204    HG1  THR  28           HG1      THR  28 -15.688  -2.271   5.016
  205   1HG2  THR  28          1HG2      THR  28 -14.648   1.154   3.281
  206   2HG2  THR  28          2HG2      THR  28 -16.239   0.394   3.275
  207   3HG2  THR  28          3HG2      THR  28 -15.659   1.212   4.725
  208    H    ILE  29           H        ILE  29 -12.106  -0.117   1.698
  209    HA   ILE  29           HA       ILE  29 -10.224   1.335   3.298
  210    HB   ILE  29           HB       ILE  29  -9.348   2.167   1.129
  211   1HG1  ILE  29          1HG1      ILE  29 -11.109   0.287  -0.354
  212   2HG1  ILE  29          2HG1      ILE  29 -11.823   1.808   0.156
  213   1HG2  ILE  29          1HG2      ILE  29  -9.802  -0.796   1.405
  214   2HG2  ILE  29          2HG2      ILE  29  -8.647  -0.071   0.287
  215   3HG2  ILE  29          3HG2      ILE  29  -8.444   0.142   2.025
  216   1HD1  ILE  29          1HD1      ILE  29  -9.294   1.605  -1.451
  217   2HD1  ILE  29          2HD1      ILE  29 -10.900   1.828  -2.152
  218   3HD1  ILE  29          3HD1      ILE  29 -10.220   3.059  -1.089
  219    H    ALA  30           H        ALA  30  -9.934   3.553   3.431
  220    HA   ALA  30           HA       ALA  30 -12.212   5.211   2.577
  221   1HB   ALA  30          1HB       ALA  30 -10.780   5.786   5.136
  222   2HB   ALA  30          2HB       ALA  30 -12.410   6.238   4.637
  223   3HB   ALA  30          3HB       ALA  30 -12.057   4.572   5.094
  224    H    VAL  31           H        VAL  31 -11.392   7.667   3.257
  225    HA   VAL  31           HA       VAL  31  -9.062   8.041   1.545
  226    HB   VAL  31           HB       VAL  31  -9.747  10.512   1.814
  227   1HG1  VAL  31          1HG1      VAL  31 -11.312   8.431   0.325
  228   2HG1  VAL  31          2HG1      VAL  31 -11.641  10.154   0.134
  229   3HG1  VAL  31          3HG1      VAL  31 -10.052   9.508  -0.279
  230   1HG2  VAL  31          1HG2      VAL  31 -11.295   9.895   3.762
  231   2HG2  VAL  31          2HG2      VAL  31 -11.900  11.030   2.556
  232   3HG2  VAL  31          3HG2      VAL  31 -12.417   9.345   2.517
  233    H    ASP  32           H        ASP  32  -8.549   6.995   4.101
  234    HA   ASP  32           HA       ASP  32  -6.415   8.494   4.974
  235   1HB   ASP  32          1HB       ASP  32  -7.454   9.286   7.222
  236   2HB   ASP  32          2HB       ASP  32  -7.696  10.270   5.782
  237    H    ASP  33           H        ASP  33  -6.272   6.004   4.699
  238    HA   ASP  33           HA       ASP  33  -6.358   4.860   7.398
  239   1HB   ASP  33          1HB       ASP  33  -6.997   2.637   6.191
  240   2HB   ASP  33          2HB       ASP  33  -8.260   3.806   6.563
  241    H    THR  34           H        THR  34  -4.197   4.795   7.738
  242    HA   THR  34           HA       THR  34  -2.165   4.479   5.944
  243    HB   THR  34           HB       THR  34  -1.122   3.137   8.013
  244    HG1  THR  34           HG1      THR  34  -3.307   3.317   9.006
  245   1HG2  THR  34          1HG2      THR  34  -0.399   5.330   7.073
  246   2HG2  THR  34          2HG2      THR  34  -1.578   6.094   8.139
  247   3HG2  THR  34          3HG2      THR  34  -0.241   5.171   8.824
  248    H    LEU  35           H        LEU  35  -1.786   3.019   4.479
  249    HA   LEU  35           HA       LEU  35  -2.772   0.301   4.793
  250   1HB   LEU  35          1HB       LEU  35  -1.370   1.640   2.474
  251   2HB   LEU  35          2HB       LEU  35  -2.031   0.016   2.453
  252    HG   LEU  35           HG       LEU  35  -3.801   2.363   3.048
  253   1HD1  LEU  35          1HD1      LEU  35  -2.407   1.889   0.584
  254   2HD1  LEU  35          2HD1      LEU  35  -4.143   1.674   0.356
  255   3HD1  LEU  35          3HD1      LEU  35  -3.520   3.189   1.010
  256   1HD2  LEU  35          1HD2      LEU  35  -4.172  -0.391   2.963
  257   2HD2  LEU  35          2HD2      LEU  35  -5.428   0.847   2.986
  258   3HD2  LEU  35          3HD2      LEU  35  -4.856   0.200   1.449
  259    H    ILE  36           H        ILE  36   0.238   2.095   4.541
  260    HA   ILE  36           HA       ILE  36   1.655   0.028   5.934
  261    HB   ILE  36           HB       ILE  36   3.448  -0.200   4.148
  262   1HG1  ILE  36          1HG1      ILE  36   2.986   0.222   1.899
  263   2HG1  ILE  36          2HG1      ILE  36   1.255   0.369   2.173
  264   1HG2  ILE  36          1HG2      ILE  36   1.446  -1.774   4.836
  265   2HG2  ILE  36          2HG2      ILE  36   0.985  -1.503   3.158
  266   3HG2  ILE  36          3HG2      ILE  36   2.563  -2.194   3.540
  267   1HD1  ILE  36          1HD1      ILE  36   3.348   2.363   3.013
  268   2HD1  ILE  36          2HD1      ILE  36   2.280   2.505   1.616
  269   3HD1  ILE  36          3HD1      ILE  36   1.607   2.525   3.245
  270    H    THR  37           H        THR  37   4.154   0.589   5.779
  271    HA   THR  37           HA       THR  37   4.580   3.471   5.682
  272    HB   THR  37           HB       THR  37   5.194   1.834   8.152
  273    HG1  THR  37           HG1      THR  37   3.122   3.578   7.480
  274   1HG2  THR  37          1HG2      THR  37   5.704   4.715   7.499
  275   2HG2  THR  37          2HG2      THR  37   5.657   4.091   9.148
  276   3HG2  THR  37          3HG2      THR  37   6.863   3.490   8.012
  277    H    LEU  38           H        LEU  38   5.499   1.950   3.812
  278    HA   LEU  38           HA       LEU  38   7.696   0.419   3.859
  279   1HB   LEU  38          1HB       LEU  38   6.431   1.457   1.878
  280   2HB   LEU  38          2HB       LEU  38   7.594   2.763   1.988
  281    HG   LEU  38           HG       LEU  38   9.324   0.756   1.868
  282   1HD1  LEU  38          1HD1      LEU  38   7.220  -0.790   1.791
  283   2HD1  LEU  38          2HD1      LEU  38   7.206  -0.344   0.088
  284   3HD1  LEU  38          3HD1      LEU  38   8.620  -1.139   0.777
  285   1HD2  LEU  38          1HD2      LEU  38   8.269   2.666   0.089
  286   2HD2  LEU  38          2HD2      LEU  38   9.821   1.832  -0.006
  287   3HD2  LEU  38          3HD2      LEU  38   8.405   1.153  -0.810
  288    H    GLU  39           H        GLU  39   9.968   0.711   3.685
  289    HA   GLU  39           HA       GLU  39  11.173   3.244   4.305
  290   1HB   GLU  39          1HB       GLU  39  10.514   2.654   6.544
  291   2HB   GLU  39          2HB       GLU  39  11.170   1.032   6.360
  292   1HG   GLU  39          1HG       GLU  39  12.980   3.375   6.051
  293   2HG   GLU  39          2HG       GLU  39  12.486   2.866   7.665
  294    H    THR  40           H        THR  40  12.914   3.267   3.052
  295    HA   THR  40           HA       THR  40  14.033   0.898   1.940
  296    HB   THR  40           HB       THR  40  15.622   2.384   0.846
  297    HG1  THR  40           HG1      THR  40  15.805   4.503   1.404
  298   1HG2  THR  40          1HG2      THR  40  12.767   2.897   0.787
  299   2HG2  THR  40          2HG2      THR  40  13.732   4.292   0.301
  300   3HG2  THR  40          3HG2      THR  40  13.925   2.752  -0.535
  301    H    ASP  41           H        ASP  41  16.072   3.377   3.395
  302    HA   ASP  41           HA       ASP  41  17.052   1.568   5.431
  303   1HB   ASP  41          1HB       ASP  41  19.450   1.919   4.611
  304   2HB   ASP  41          2HB       ASP  41  18.460   0.775   3.709
  305    H    LYS  42           H        LYS  42  15.804   4.287   5.092
  306    HA   LYS  42           HA       LYS  42  17.120   5.592   7.195
  307   1HB   LYS  42          1HB       LYS  42  18.884   6.079   5.622
  308   2HB   LYS  42          2HB       LYS  42  17.726   6.672   4.439
  309   1HG   LYS  42          1HG       LYS  42  18.971   8.460   5.614
  310   2HG   LYS  42          2HG       LYS  42  17.219   8.578   5.791
  311   1HD   LYS  42          1HD       LYS  42  17.332   7.630   8.005
  312   2HD   LYS  42          2HD       LYS  42  19.062   7.331   7.827
  313   1HE   LYS  42          1HE       LYS  42  19.182   9.289   8.967
  314   2HE   LYS  42          2HE       LYS  42  19.050   9.949   7.337
  315   1HZ   LYS  42          1HZ       LYS  42  16.578   9.416   8.812
  316   2HZ   LYS  42          2HZ       LYS  42  17.496  10.761   9.269
  317   3HZ   LYS  42          3HZ       LYS  42  16.922  10.630   7.683
  318    H    ALA  43           H        ALA  43  15.221   6.083   4.250
  319    HA   ALA  43           HA       ALA  43  13.507   7.978   5.699
  320   1HB   ALA  43          1HB       ALA  43  13.909   7.470   2.762
  321   2HB   ALA  43          2HB       ALA  43  12.601   8.471   3.391
  322   3HB   ALA  43          3HB       ALA  43  14.280   8.931   3.677
  323    H    THR  44           H        THR  44  11.562   7.359   6.377
  324    HA   THR  44           HA       THR  44  10.437   4.869   5.278
  325    HB   THR  44           HB       THR  44   9.560   4.341   7.358
  326    HG1  THR  44           HG1      THR  44   8.714   5.780   8.621
  327   1HG2  THR  44          1HG2      THR  44  12.217   4.894   7.344
  328   2HG2  THR  44          2HG2      THR  44  11.655   5.862   8.708
  329   3HG2  THR  44          3HG2      THR  44  11.348   4.125   8.672
  330    H    MET  45           H        MET  45   8.740   5.121   4.002
  331    HA   MET  45           HA       MET  45   7.013   7.474   4.412
  332   1HB   MET  45          1HB       MET  45   8.169   6.282   2.017
  333   2HB   MET  45          2HB       MET  45   6.428   6.481   1.888
  334   1HG   MET  45          1HG       MET  45   8.458   8.622   2.469
  335   2HG   MET  45          2HG       MET  45   7.505   8.423   1.000
  336   1HE   MET  45          1HE       MET  45   6.946  10.571   0.876
  337   2HE   MET  45          2HE       MET  45   5.352  11.096   1.418
  338   3HE   MET  45          3HE       MET  45   6.793  11.597   2.303
  339    H    ASP  46           H        ASP  46   4.735   7.210   4.126
  340    HA   ASP  46           HA       ASP  46   3.762   4.444   4.222
  341   1HB   ASP  46          1HB       ASP  46   2.182   5.110   6.050
  342   2HB   ASP  46          2HB       ASP  46   3.875   5.096   6.536
  343    H    VAL  47           H        VAL  47   1.353   4.333   3.950
  344    HA   VAL  47           HA       VAL  47   0.376   6.555   2.281
  345    HB   VAL  47           HB       VAL  47   0.063   3.602   1.727
  346   1HG1  VAL  47          1HG1      VAL  47  -1.702   5.729   1.088
  347   2HG1  VAL  47          2HG1      VAL  47  -0.905   5.222  -0.403
  348   3HG1  VAL  47          3HG1      VAL  47  -1.783   4.043   0.573
  349   1HG2  VAL  47          1HG2      VAL  47   2.226   4.795   1.113
  350   2HG2  VAL  47          2HG2      VAL  47   1.390   3.941  -0.184
  351   3HG2  VAL  47          3HG2      VAL  47   1.266   5.696  -0.060
  352    HA   PRO  48           HA       PRO  48  -3.054   5.979   5.137
  353   1HB   PRO  48          1HB       PRO  48  -4.085   8.418   4.930
  354   2HB   PRO  48          2HB       PRO  48  -2.523   8.167   5.719
  355   1HG   PRO  48          1HG       PRO  48  -3.125   9.233   3.002
  356   2HG   PRO  48          2HG       PRO  48  -1.841   9.695   4.132
  357   1HD   PRO  48          1HD       PRO  48  -1.592   7.941   1.942
  358   2HD   PRO  48          2HD       PRO  48  -0.413   8.170   3.247
  359    H    ALA  49           H        ALA  49  -3.172   5.178   2.233
  360    HA   ALA  49           HA       ALA  49  -4.705   4.707   0.609
  361   1HB   ALA  49          1HB       ALA  49  -7.069   4.821   2.277
  362   2HB   ALA  49          2HB       ALA  49  -5.746   3.964   3.067
  363   3HB   ALA  49          3HB       ALA  49  -6.315   3.440   1.482
  364    H    GLU  50           H        GLU  50  -4.800   6.419  -0.757
  365    HA   GLU  50           HA       GLU  50  -6.398   8.740  -0.050
  366   1HB   GLU  50          1HB       GLU  50  -4.355   8.124  -2.118
  367   2HB   GLU  50          2HB       GLU  50  -5.556   9.351  -2.506
  368   1HG   GLU  50          1HG       GLU  50  -4.088  10.741  -1.552
  369   2HG   GLU  50          2HG       GLU  50  -4.802  10.163  -0.045
  370    H    VAL  51           H        VAL  51  -8.213   7.031  -0.066
  371    HA   VAL  51           HA       VAL  51 -10.133   7.642  -1.867
  372    HB   VAL  51           HB       VAL  51  -8.978   6.919  -3.777
  373   1HG1  VAL  51          1HG1      VAL  51  -7.501   5.369  -2.026
  374   2HG1  VAL  51          2HG1      VAL  51  -8.287   4.190  -3.079
  375   3HG1  VAL  51          3HG1      VAL  51  -7.293   5.469  -3.774
  376   1HG2  VAL  51          1HG2      VAL  51 -11.321   5.835  -3.323
  377   2HG2  VAL  51          2HG2      VAL  51 -10.359   5.340  -4.717
  378   3HG2  VAL  51          3HG2      VAL  51 -10.389   4.340  -3.265
  379    H    ALA  52           H        ALA  52 -12.035   6.526  -1.473
  380    HA   ALA  52           HA       ALA  52 -11.939   4.650   0.757
  381   1HB   ALA  52          1HB       ALA  52 -13.578   6.727   0.314
  382   2HB   ALA  52          2HB       ALA  52 -14.041   5.321   1.274
  383   3HB   ALA  52          3HB       ALA  52 -14.531   5.436  -0.418
  384    H    GLY  53           H        GLY  53 -14.087   3.061   0.446
  385   1HA   GLY  53          1HA       GLY  53 -13.603   1.698  -2.136
  386   2HA   GLY  53          2HA       GLY  53 -15.158   1.698  -1.312
  387    H    VAL  54           H        VAL  54 -13.395  -0.522  -2.183
  388    HA   VAL  54           HA       VAL  54 -12.624  -1.747   0.359
  389    HB   VAL  54           HB       VAL  54 -14.547  -3.053  -1.575
  390   1HG1  VAL  54          1HG1      VAL  54 -12.959  -4.630  -0.567
  391   2HG1  VAL  54          2HG1      VAL  54 -13.434  -4.072   1.037
  392   3HG1  VAL  54          3HG1      VAL  54 -14.604  -4.898   0.009
  393   1HG2  VAL  54          1HG2      VAL  54 -14.950  -1.976   1.211
  394   2HG2  VAL  54          2HG2      VAL  54 -15.701  -1.397  -0.276
  395   3HG2  VAL  54          3HG2      VAL  54 -16.113  -2.991   0.357
  396    H    VAL  55           H        VAL  55 -10.947  -3.210   0.165
  397    HA   VAL  55           HA       VAL  55  -9.492  -3.148  -2.302
  398    HB   VAL  55           HB       VAL  55  -8.916  -4.762   0.182
  399   1HG1  VAL  55          1HG1      VAL  55  -7.840  -5.576  -1.935
  400   2HG1  VAL  55          2HG1      VAL  55  -7.044  -4.006  -2.063
  401   3HG1  VAL  55          3HG1      VAL  55  -6.702  -5.058  -0.689
  402   1HG2  VAL  55          1HG2      VAL  55  -9.007  -2.162   0.257
  403   2HG2  VAL  55          2HG2      VAL  55  -7.641  -3.010   0.982
  404   3HG2  VAL  55          3HG2      VAL  55  -7.474  -2.266  -0.609
  405    H    LYS  56           H        LYS  56  -9.014  -4.773  -3.689
  406    HA   LYS  56           HA       LYS  56 -10.677  -7.201  -3.506
  407   1HB   LYS  56          1HB       LYS  56  -9.601  -6.709  -6.153
  408   2HB   LYS  56          2HB       LYS  56 -11.264  -6.995  -5.666
  409   1HG   LYS  56          1HG       LYS  56 -10.279  -4.293  -5.074
  410   2HG   LYS  56          2HG       LYS  56 -10.331  -4.710  -6.784
  411   1HD   LYS  56          1HD       LYS  56 -12.463  -3.941  -6.530
  412   2HD   LYS  56          2HD       LYS  56 -12.716  -5.639  -6.114
  413   1HE   LYS  56          1HE       LYS  56 -11.951  -4.430  -3.730
  414   2HE   LYS  56          2HE       LYS  56 -13.038  -3.269  -4.489
  415   1HZ   LYS  56          1HZ       LYS  56 -14.673  -5.058  -4.735
  416   2HZ   LYS  56          2HZ       LYS  56 -13.636  -6.123  -3.929
  417   3HZ   LYS  56          3HZ       LYS  56 -14.275  -4.786  -3.112
  418    H    GLU  57           H        GLU  57  -7.658  -5.856  -4.752
  419    HA   GLU  57           HA       GLU  57  -6.459  -8.496  -4.467
  420   1HB   GLU  57          1HB       GLU  57  -6.018  -6.274  -6.390
  421   2HB   GLU  57          2HB       GLU  57  -4.631  -7.266  -5.960
  422   1HG   GLU  57          1HG       GLU  57  -5.806  -9.262  -6.692
  423   2HG   GLU  57          2HG       GLU  57  -7.228  -8.293  -7.083
  424    H    VAL  58           H        VAL  58  -3.975  -8.310  -4.113
  425    HA   VAL  58           HA       VAL  58  -3.045  -6.101  -2.545
  426    HB   VAL  58           HB       VAL  58  -4.417  -7.152  -0.833
  427   1HG1  VAL  58          1HG1      VAL  58  -3.512  -9.554  -2.053
  428   2HG1  VAL  58          2HG1      VAL  58  -3.039  -9.578  -0.353
  429   3HG1  VAL  58          3HG1      VAL  58  -4.731  -9.346  -0.794
  430   1HG2  VAL  58          1HG2      VAL  58  -1.592  -6.762  -0.667
  431   2HG2  VAL  58          2HG2      VAL  58  -2.825  -6.496   0.569
  432   3HG2  VAL  58          3HG2      VAL  58  -2.061  -8.078   0.410
  433    H    LYS  59           H        LYS  59  -0.959  -5.957  -2.937
  434    HA   LYS  59           HA       LYS  59   0.616  -8.412  -3.310
  435   1HB   LYS  59          1HB       LYS  59   1.268  -6.007  -4.950
  436   2HB   LYS  59          2HB       LYS  59   1.552  -7.707  -5.298
  437   1HG   LYS  59          1HG       LYS  59  -1.187  -7.548  -5.266
  438   2HG   LYS  59          2HG       LYS  59  -0.710  -6.008  -5.984
  439   1HD   LYS  59          1HD       LYS  59   0.833  -7.409  -7.482
  440   2HD   LYS  59          2HD       LYS  59  -0.122  -8.792  -6.942
  441   1HE   LYS  59          1HE       LYS  59  -2.070  -7.019  -7.630
  442   2HE   LYS  59          2HE       LYS  59  -0.810  -6.626  -8.800
  443   1HZ   LYS  59          1HZ       LYS  59  -0.787  -9.262  -8.976
  444   2HZ   LYS  59          2HZ       LYS  59  -2.406  -9.047  -8.533
  445   3HZ   LYS  59          3HZ       LYS  59  -1.804  -8.295  -9.923
  446    H    VAL  60           H        VAL  60   0.921  -7.698  -0.963
  447    HA   VAL  60           HA       VAL  60   3.504  -6.572  -0.706
  448    HB   VAL  60           HB       VAL  60   2.765  -4.411  -0.884
  449   1HG1  VAL  60          1HG1      VAL  60   0.176  -5.236   0.415
  450   2HG1  VAL  60          2HG1      VAL  60   0.571  -3.589  -0.071
  451   3HG1  VAL  60          3HG1      VAL  60   0.444  -4.861  -1.288
  452   1HG2  VAL  60          1HG2      VAL  60   3.618  -4.967   1.527
  453   2HG2  VAL  60          2HG2      VAL  60   2.969  -3.372   1.154
  454   3HG2  VAL  60          3HG2      VAL  60   1.966  -4.560   1.986
  455    H    LYS  61           H        LYS  61   4.353  -6.776   1.372
  456    HA   LYS  61           HA       LYS  61   2.642  -8.124   3.350
  457   1HB   LYS  61          1HB       LYS  61   5.506  -8.938   2.963
  458   2HB   LYS  61          2HB       LYS  61   4.204  -9.822   3.746
  459   1HG   LYS  61          1HG       LYS  61   4.313  -9.271   0.791
  460   2HG   LYS  61          2HG       LYS  61   4.924 -10.744   1.546
  461   1HD   LYS  61          1HD       LYS  61   2.356 -10.430   2.576
  462   2HD   LYS  61          2HD       LYS  61   2.211 -10.005   0.869
  463   1HE   LYS  61          1HE       LYS  61   3.453 -12.142   0.359
  464   2HE   LYS  61          2HE       LYS  61   3.249 -12.570   2.057
  465   1HZ   LYS  61          1HZ       LYS  61   0.995 -11.927   0.238
  466   2HZ   LYS  61          2HZ       LYS  61   1.532 -13.500   0.549
  467   3HZ   LYS  61          3HZ       LYS  61   0.897 -12.558   1.804
  468    H    VAL  62           H        VAL  62   4.627  -8.505   5.284
  469    HA   VAL  62           HA       VAL  62   5.083  -5.724   6.086
  470    HB   VAL  62           HB       VAL  62   3.798  -7.271   7.600
  471   1HG1  VAL  62          1HG1      VAL  62   5.999  -8.963   7.155
  472   2HG1  VAL  62          2HG1      VAL  62   6.057  -8.495   8.855
  473   3HG1  VAL  62          3HG1      VAL  62   4.604  -9.247   8.197
  474   1HG2  VAL  62          1HG2      VAL  62   6.195  -5.709   8.401
  475   2HG2  VAL  62          2HG2      VAL  62   4.487  -5.417   8.738
  476   3HG2  VAL  62          3HG2      VAL  62   5.364  -6.658   9.634
  477    H    GLY  63           H        GLY  63   6.810  -6.899   4.151
  478   1HA   GLY  63          1HA       GLY  63   9.259  -7.610   5.551
  479   2HA   GLY  63          2HA       GLY  63   9.267  -6.042   4.755
  480    H    ASP  64           H        ASP  64   8.404  -6.187   2.391
  481    HA   ASP  64           HA       ASP  64   9.871  -8.391   1.115
  482   1HB   ASP  64          1HB       ASP  64   8.027  -8.227  -0.711
  483   2HB   ASP  64          2HB       ASP  64   7.693  -9.136   0.761
  484    H    LYS  65           H        LYS  65  10.460  -7.929  -1.146
  485    HA   LYS  65           HA       LYS  65  11.590  -5.316  -1.373
  486   1HB   LYS  65          1HB       LYS  65  11.590  -7.791  -3.050
  487   2HB   LYS  65          2HB       LYS  65  12.123  -6.276  -3.765
  488   1HG   LYS  65          1HG       LYS  65  14.135  -6.798  -2.971
  489   2HG   LYS  65          2HG       LYS  65  13.496  -6.333  -1.393
  490   1HD   LYS  65          1HD       LYS  65  13.669  -8.423  -0.653
  491   2HD   LYS  65          2HD       LYS  65  12.717  -9.026  -2.012
  492   1HE   LYS  65          1HE       LYS  65  14.879 -10.099  -2.006
  493   2HE   LYS  65          2HE       LYS  65  14.760  -9.023  -3.399
  494   1HZ   LYS  65          1HZ       LYS  65  15.858  -7.362  -1.692
  495   2HZ   LYS  65          2HZ       LYS  65  16.436  -8.801  -1.015
  496   3HZ   LYS  65          3HZ       LYS  65  16.791  -8.421  -2.625
  497    H    ILE  66           H        ILE  66  10.451  -3.586  -1.948
  498    HA   ILE  66           HA       ILE  66   8.524  -3.862  -4.141
  499    HB   ILE  66           HB       ILE  66   7.813  -3.379  -1.509
  500   1HG1  ILE  66          1HG1      ILE  66   5.573  -2.828  -2.537
  501   2HG1  ILE  66          2HG1      ILE  66   6.376  -2.876  -4.106
  502   1HG2  ILE  66          1HG2      ILE  66   7.798  -0.756  -2.977
  503   2HG2  ILE  66          2HG2      ILE  66   6.756  -1.103  -1.599
  504   3HG2  ILE  66          3HG2      ILE  66   8.508  -1.123  -1.406
  505   1HD1  ILE  66          1HD1      ILE  66   7.153  -5.223  -2.859
  506   2HD1  ILE  66          2HD1      ILE  66   5.448  -5.038  -2.444
  507   3HD1  ILE  66          3HD1      ILE  66   5.946  -5.047  -4.137
  508    H    SER  67           H        SER  67   7.969  -1.698  -5.141
  509    HA   SER  67           HA       SER  67  10.104   0.278  -4.932
  510   1HB   SER  67          1HB       SER  67   9.591  -0.116  -7.722
  511   2HB   SER  67          2HB       SER  67  11.116  -0.272  -6.850
  512    HG   SER  67           HG       SER  67  10.018  -2.193  -8.012
  513    H    GLU  68           H        GLU  68   9.453   2.328  -5.324
  514    HA   GLU  68           HA       GLU  68   6.913   3.200  -5.075
  515   1HB   GLU  68          1HB       GLU  68   8.798   4.605  -6.956
  516   2HB   GLU  68          2HB       GLU  68   7.594   5.315  -5.889
  517   1HG   GLU  68          1HG       GLU  68   9.329   5.730  -4.553
  518   2HG   GLU  68          2HG       GLU  68   9.185   4.031  -4.107
  519    H    GLY  69           H        GLY  69   5.181   2.432  -6.141
  520   1HA   GLY  69          1HA       GLY  69   5.032   2.903  -9.014
  521   2HA   GLY  69          2HA       GLY  69   3.688   2.510  -7.954
  522    H    GLY  70           H        GLY  70   3.816   0.216  -6.990
  523   1HA   GLY  70          1HA       GLY  70   4.981  -1.989  -7.528
  524   2HA   GLY  70          2HA       GLY  70   4.593  -1.592  -9.194
  525    H    LEU  71           H        LEU  71   1.989  -0.404  -8.249
  526    HA   LEU  71           HA       LEU  71  -0.166  -1.039  -7.831
  527   1HB   LEU  71          1HB       LEU  71  -0.053  -1.949 -10.015
  528   2HB   LEU  71          2HB       LEU  71   0.898  -3.320  -9.478
  529    HG   LEU  71           HG       LEU  71  -0.974  -4.368  -8.479
  530   1HD1  LEU  71          1HD1      LEU  71  -2.024  -1.645  -8.386
  531   2HD1  LEU  71          2HD1      LEU  71  -3.218  -2.854  -8.858
  532   3HD1  LEU  71          3HD1      LEU  71  -2.346  -3.024  -7.334
  533   1HD2  LEU  71          1HD2      LEU  71  -0.918  -3.734 -11.181
  534   2HD2  LEU  71          2HD2      LEU  71  -1.855  -5.017 -10.415
  535   3HD2  LEU  71          3HD2      LEU  71  -2.585  -3.436 -10.692
  536    H    ILE  72           H        ILE  72   0.250  -1.173  -5.550
  537    HA   ILE  72           HA       ILE  72   0.919  -3.655  -4.322
  538    HB   ILE  72           HB       ILE  72   0.252  -0.928  -3.424
  539   1HG1  ILE  72          1HG1      ILE  72   2.061  -2.694  -1.903
  540   2HG1  ILE  72          2HG1      ILE  72   2.493  -2.422  -3.589
  541   1HG2  ILE  72          1HG2      ILE  72  -0.592  -3.305  -1.831
  542   2HG2  ILE  72          2HG2      ILE  72   0.130  -1.932  -0.989
  543   3HG2  ILE  72          3HG2      ILE  72  -1.330  -1.709  -1.953
  544   1HD1  ILE  72          1HD1      ILE  72   1.809   0.079  -2.503
  545   2HD1  ILE  72          2HD1      ILE  72   2.871  -0.722  -1.346
  546   3HD1  ILE  72          3HD1      ILE  72   3.393  -0.499  -3.014
  547    H    VAL  73           H        VAL  73  -2.076  -1.783  -3.793
  548    HA   VAL  73           HA       VAL  73  -3.576  -4.302  -4.041
  549    HB   VAL  73           HB       VAL  73  -4.967  -3.726  -2.150
  550   1HG1  VAL  73          1HG1      VAL  73  -2.218  -4.371  -1.992
  551   2HG1  VAL  73          2HG1      VAL  73  -2.587  -3.297  -0.643
  552   3HG1  VAL  73          3HG1      VAL  73  -3.506  -4.786  -0.861
  553   1HG2  VAL  73          1HG2      VAL  73  -3.240  -1.263  -1.902
  554   2HG2  VAL  73          2HG2      VAL  73  -4.949  -1.311  -2.337
  555   3HG2  VAL  73          3HG2      VAL  73  -4.438  -1.789  -0.717
  556    H    VAL  74           H        VAL  74  -5.631  -4.186  -4.849
  557    HA   VAL  74           HA       VAL  74  -6.373  -1.633  -6.122
  558    HB   VAL  74           HB       VAL  74  -7.203  -4.459  -6.831
  559   1HG1  VAL  74          1HG1      VAL  74  -8.748  -2.368  -7.300
  560   2HG1  VAL  74          2HG1      VAL  74  -7.636  -2.150  -8.652
  561   3HG1  VAL  74          3HG1      VAL  74  -8.547  -3.651  -8.492
  562   1HG2  VAL  74          1HG2      VAL  74  -5.031  -2.679  -7.774
  563   2HG2  VAL  74          2HG2      VAL  74  -5.083  -4.437  -7.648
  564   3HG2  VAL  74          3HG2      VAL  74  -5.885  -3.625  -8.992
  565    H    VAL  75           H        VAL  75  -8.307  -0.700  -5.628
  566    HA   VAL  75           HA       VAL  75 -10.087  -2.200  -3.841
  567    HB   VAL  75           HB       VAL  75 -10.681   0.016  -2.826
  568   1HG1  VAL  75          1HG1      VAL  75  -8.263  -1.557  -2.447
  569   2HG1  VAL  75          2HG1      VAL  75  -8.133   0.083  -1.812
  570   3HG1  VAL  75          3HG1      VAL  75  -9.434  -0.975  -1.264
  571   1HG2  VAL  75          1HG2      VAL  75  -8.784   0.921  -4.813
  572   2HG2  VAL  75          2HG2      VAL  75  -9.943   1.842  -3.860
  573   3HG2  VAL  75          3HG2      VAL  75  -8.354   1.466  -3.195
  574    H    GLU  76           H        GLU  76 -12.288  -1.117  -3.664
  575    HA   GLU  76           HA       GLU  76 -13.406  -0.991  -6.309
  576   1HB   GLU  76          1HB       GLU  76 -14.331  -1.750  -3.785
  577   2HB   GLU  76          2HB       GLU  76 -15.244  -0.297  -4.173
  578   1HG   GLU  76          1HG       GLU  76 -15.541  -1.545  -6.486
  579   2HG   GLU  76          2HG       GLU  76 -15.267  -2.961  -5.472
  580    H    ALA  77           H        ALA  77 -12.444   1.264  -3.864
  581    HA   ALA  77           HA       ALA  77 -12.128   3.527  -4.068
  582   1HB   ALA  77          1HB       ALA  77 -13.907   3.584  -6.468
  583   2HB   ALA  77          2HB       ALA  77 -12.200   3.152  -6.551
  584   3HB   ALA  77          3HB       ALA  77 -12.677   4.747  -5.973
  585    H    GLU  78           H        GLU  78 -13.737   5.580  -4.283
  586    HA   GLU  78           HA       GLU  78 -15.447   5.485  -2.133
  587   1HB   GLU  78          1HB       GLU  78 -14.713   7.391  -4.066
  588   2HB   GLU  78          2HB       GLU  78 -16.471   7.349  -4.076
  589   1HG   GLU  78          1HG       GLU  78 -15.175   7.443  -1.428
  590   2HG   GLU  78          2HG       GLU  78 -15.037   8.888  -2.428
  591    H    GLY  79           H        GLY  79 -16.837   3.761  -2.062
  592   1HA   GLY  79          1HA       GLY  79 -18.632   2.422  -2.611
  593   2HA   GLY  79          2HA       GLY  79 -18.533   3.045  -4.252
  594    H    THR  80           H        THR  80 -19.542   4.016  -0.981
  595    HA   THR  80           HA       THR  80 -21.310   6.046  -1.986
  596    HB   THR  80           HB       THR  80 -22.624   4.030  -2.485
  597    HG1  THR  80           HG1      THR  80 -24.194   5.307  -1.989
  598   1HG2  THR  80          1HG2      THR  80 -21.641   2.676  -0.564
  599   2HG2  THR  80          2HG2      THR  80 -22.828   3.493   0.452
  600   3HG2  THR  80          3HG2      THR  80 -23.363   2.494  -0.900
  601    H    ALA  81           H        ALA  81 -22.938   6.572  -0.002
  602    HA   ALA  81           HA       ALA  81 -21.235   7.486   2.080
  603   1HB   ALA  81          1HB       ALA  81 -22.901   8.922   2.371
  604   2HB   ALA  81          2HB       ALA  81 -23.839   8.051   1.159
  605   3HB   ALA  81          3HB       ALA  81 -23.979   7.615   2.862

  No H/Q in entry =         605
  Start of MODEL   18
    1    H1   ALA   1           H1       ALA   1 -12.129   5.823 -10.084
    2    H2   ALA   1           H2       ALA   1 -12.228   5.888 -11.796
    3    H3   ALA   1           H3       ALA   1 -13.570   6.364 -10.842
    4    HA   ALA   1           HA       ALA   1 -14.115   4.273 -10.274
    5   1HB   ALA   1          1HB       ALA   1 -14.689   4.410 -12.527
    6   2HB   ALA   1          2HB       ALA   1 -13.800   2.889 -12.419
    7   3HB   ALA   1          3HB       ALA   1 -13.009   4.330 -13.059
    8    H    LEU   2           H        LEU   2 -13.067   3.248  -8.655
    9    HA   LEU   2           HA       LEU   2 -11.688   1.774  -7.609
   10   1HB   LEU   2          1HB       LEU   2 -11.274   0.925 -10.467
   11   2HB   LEU   2          2HB       LEU   2 -10.480   0.115  -9.130
   12    HG   LEU   2           HG       LEU   2 -13.260   0.261  -8.531
   13   1HD1  LEU   2          1HD1      LEU   2 -12.601  -0.451 -11.351
   14   2HD1  LEU   2          2HD1      LEU   2 -13.890  -1.314 -10.512
   15   3HD1  LEU   2          3HD1      LEU   2 -13.983   0.436 -10.707
   16   1HD2  LEU   2          1HD2      LEU   2 -11.486  -1.408  -7.830
   17   2HD2  LEU   2          2HD2      LEU   2 -13.055  -2.074  -8.282
   18   3HD2  LEU   2          3HD2      LEU   2 -11.704  -2.155  -9.412
   19    H    VAL   3           H        VAL   3  -9.328   1.067  -7.439
   20    HA   VAL   3           HA       VAL   3  -7.425   2.873  -8.675
   21    HB   VAL   3           HB       VAL   3  -8.050   2.953  -5.729
   22   1HG1  VAL   3          1HG1      VAL   3  -5.643   2.595  -5.911
   23   2HG1  VAL   3          2HG1      VAL   3  -5.520   3.945  -7.044
   24   3HG1  VAL   3          3HG1      VAL   3  -5.996   4.239  -5.371
   25   1HG2  VAL   3          1HG2      VAL   3  -7.945   4.941  -7.960
   26   2HG2  VAL   3          2HG2      VAL   3  -9.242   4.620  -6.809
   27   3HG2  VAL   3          3HG2      VAL   3  -7.783   5.460  -6.283
   28    H    GLU   4           H        GLU   4  -5.203   2.302  -8.194
   29    HA   GLU   4           HA       GLU   4  -4.828  -0.388  -7.091
   30   1HB   GLU   4          1HB       GLU   4  -2.996  -0.349  -9.133
   31   2HB   GLU   4          2HB       GLU   4  -4.539  -1.187  -9.174
   32   1HG   GLU   4          1HG       GLU   4  -5.569   0.654 -10.321
   33   2HG   GLU   4          2HG       GLU   4  -4.106   1.624 -10.156
   34    H    LEU   5           H        LEU   5  -3.731   0.222  -5.290
   35    HA   LEU   5           HA       LEU   5  -1.867   2.326  -5.166
   36   1HB   LEU   5          1HB       LEU   5  -2.452  -0.043  -3.430
   37   2HB   LEU   5          2HB       LEU   5  -1.057   0.962  -3.091
   38    HG   LEU   5           HG       LEU   5  -3.893   1.987  -3.238
   39   1HD1  LEU   5          1HD1      LEU   5  -2.453   0.629  -1.123
   40   2HD1  LEU   5          2HD1      LEU   5  -2.976   2.243  -0.643
   41   3HD1  LEU   5          3HD1      LEU   5  -4.157   1.071  -1.229
   42   1HD2  LEU   5          1HD2      LEU   5  -1.642   3.422  -3.585
   43   2HD2  LEU   5          2HD2      LEU   5  -3.099   4.057  -2.821
   44   3HD2  LEU   5          3HD2      LEU   5  -1.768   3.465  -1.827
   45    H    LYS   6           H        LYS   6   0.248   2.464  -5.632
   46    HA   LYS   6           HA       LYS   6   1.672  -0.023  -6.303
   47   1HB   LYS   6          1HB       LYS   6   2.287   2.494  -7.789
   48   2HB   LYS   6          2HB       LYS   6   2.497   0.823  -8.288
   49   1HG   LYS   6          1HG       LYS   6  -0.253   1.143  -7.967
   50   2HG   LYS   6          2HG       LYS   6   0.302   2.614  -8.770
   51   1HD   LYS   6          1HD       LYS   6   0.967  -0.186  -9.676
   52   2HD   LYS   6          2HD       LYS   6  -0.343   0.793 -10.338
   53   1HE   LYS   6          1HE       LYS   6   2.282   2.112 -10.260
   54   2HE   LYS   6          2HE       LYS   6   2.182   0.716 -11.334
   55   1HZ   LYS   6          1HZ       LYS   6  -0.103   2.117 -11.840
   56   2HZ   LYS   6          2HZ       LYS   6   1.063   3.327 -11.646
   57   3HZ   LYS   6          3HZ       LYS   6   1.293   2.110 -12.798
   58    H    VAL   7           H        VAL   7   2.373   0.277  -4.036
   59    HA   VAL   7           HA       VAL   7   3.946   0.770  -2.490
   60    HB   VAL   7           HB       VAL   7   5.477   1.528  -4.965
   61   1HG1  VAL   7          1HG1      VAL   7   6.405   2.608  -2.921
   62   2HG1  VAL   7          2HG1      VAL   7   6.593   1.005  -2.213
   63   3HG1  VAL   7          3HG1      VAL   7   7.501   1.441  -3.658
   64   1HG2  VAL   7          1HG2      VAL   7   4.752  -0.805  -4.847
   65   2HG2  VAL   7          2HG2      VAL   7   6.505  -0.659  -4.730
   66   3HG2  VAL   7          3HG2      VAL   7   5.547  -0.967  -3.282
   67    HA   PRO   8           HA       PRO   8   3.524   5.102  -1.618
   68   1HB   PRO   8          1HB       PRO   8   5.315   5.000   0.594
   69   2HB   PRO   8          2HB       PRO   8   3.556   4.869   0.629
   70   1HG   PRO   8          1HG       PRO   8   5.336   2.830   1.269
   71   2HG   PRO   8          2HG       PRO   8   3.629   2.610   0.853
   72   1HD   PRO   8          1HD       PRO   8   6.058   2.252  -0.843
   73   2HD   PRO   8          2HD       PRO   8   4.542   1.330  -0.829
   74    H    ASP   9           H        ASP   9   5.423   6.664  -0.304
   75    HA   ASP   9           HA       ASP   9   7.397   7.045  -2.438
   76   1HB   ASP   9          1HB       ASP   9   5.662   8.836  -1.617
   77   2HB   ASP   9          2HB       ASP   9   6.824   9.077  -0.317
   78    H    ILE  10           H        ILE  10   9.144   5.826  -1.860
   79    HA   ILE  10           HA       ILE  10  10.253   6.262   0.832
   80    HB   ILE  10           HB       ILE  10  11.689   4.156  -0.008
   81   1HG1  ILE  10          1HG1      ILE  10  10.032   2.546  -1.047
   82   2HG1  ILE  10          2HG1      ILE  10   9.018   3.941  -1.399
   83   1HG2  ILE  10          1HG2      ILE  10  10.281   4.474   2.070
   84   2HG2  ILE  10          2HG2      ILE  10   8.946   3.781   1.152
   85   3HG2  ILE  10          3HG2      ILE  10  10.397   2.823   1.459
   86   1HD1  ILE  10          1HD1      ILE  10  11.840   4.023  -2.290
   87   2HD1  ILE  10          2HD1      ILE  10  10.722   2.969  -3.156
   88   3HD1  ILE  10          3HD1      ILE  10  10.393   4.698  -3.036
   89    H    GLY  11           H        GLY  11  11.010   8.324  -0.237
   90   1HA   GLY  11          1HA       GLY  11  13.782   7.961  -0.967
   91   2HA   GLY  11          2HA       GLY  11  12.970   9.491  -0.677
   92    H    GLY  12           H        GLY  12  11.166   7.648  -2.830
   93   1HA   GLY  12          1HA       GLY  12  11.987   9.366  -5.023
   94   2HA   GLY  12          2HA       GLY  12  10.607   8.280  -5.007
   95    H    HIS  13           H        HIS  13  13.036   6.406  -3.905
   96    HA   HIS  13           HA       HIS  13  13.943   5.668  -6.603
   97   1HB   HIS  13          1HB       HIS  13  15.843   4.554  -5.493
   98   2HB   HIS  13          2HB       HIS  13  15.774   6.271  -5.115
   99    HD1  HIS  13           HD1      HIS  13  14.825   6.866  -2.677
  100    HD2  HIS  13           HD2      HIS  13  15.840   2.890  -3.327
  101    HE1  HIS  13           HE1      HIS  13  15.024   5.840  -0.389
  102    HE2  HIS  13           HE2      HIS  13  15.727   3.457  -0.806
  103    H    GLU  14           H        GLU  14  14.627   3.207  -6.588
  104    HA   GLU  14           HA       GLU  14  12.224   1.727  -5.768
  105   1HB   GLU  14          1HB       GLU  14  12.925   0.079  -7.487
  106   2HB   GLU  14          2HB       GLU  14  12.640   1.682  -8.147
  107   1HG   GLU  14          1HG       GLU  14  15.346   1.645  -7.495
  108   2HG   GLU  14          2HG       GLU  14  15.019   0.066  -8.208
  109    H    ASN  15           H        ASN  15  13.013  -0.810  -5.801
  110    HA   ASN  15           HA       ASN  15  13.766  -2.405  -4.368
  111   1HB   ASN  15          1HB       ASN  15  16.174  -2.638  -4.254
  112   2HB   ASN  15          2HB       ASN  15  15.710  -2.110  -5.868
  113   1HD2  ASN  15          2HD2      ASN  15  16.141   0.031  -6.494
  114   2HD2  ASN  15          1HD2      ASN  15  17.341   0.976  -5.687
  115    H    VAL  16           H        VAL  16  12.580  -1.796  -2.548
  116    HA   VAL  16           HA       VAL  16  14.243  -0.779  -0.363
  117    HB   VAL  16           HB       VAL  16  12.533   0.666   0.498
  118   1HG1  VAL  16          1HG1      VAL  16  12.992   1.093  -2.445
  119   2HG1  VAL  16          2HG1      VAL  16  12.288   2.301  -1.371
  120   3HG1  VAL  16          3HG1      VAL  16  13.936   1.736  -1.101
  121   1HG2  VAL  16          1HG2      VAL  16  10.795  -0.924  -1.110
  122   2HG2  VAL  16          2HG2      VAL  16  10.380   0.267   0.122
  123   3HG2  VAL  16          3HG2      VAL  16  10.593   0.769  -1.555
  124    H    ASP  17           H        ASP  17  11.979  -0.855   1.515
  125    HA   ASP  17           HA       ASP  17  11.054  -3.604   1.393
  126   1HB   ASP  17          1HB       ASP  17  13.403  -3.006   2.779
  127   2HB   ASP  17          2HB       ASP  17  12.165  -3.112   4.027
  128    H    ILE  18           H        ILE  18   9.157  -3.935   2.441
  129    HA   ILE  18           HA       ILE  18   7.740  -1.633   3.399
  130    HB   ILE  18           HB       ILE  18   6.986  -4.552   3.182
  131   1HG1  ILE  18          1HG1      ILE  18   5.526  -2.432   1.739
  132   2HG1  ILE  18          2HG1      ILE  18   7.195  -2.679   1.237
  133   1HG2  ILE  18          1HG2      ILE  18   5.308  -2.242   4.149
  134   2HG2  ILE  18          2HG2      ILE  18   4.664  -3.814   3.677
  135   3HG2  ILE  18          3HG2      ILE  18   5.759  -3.687   5.054
  136   1HD1  ILE  18          1HD1      ILE  18   5.907  -5.212   1.483
  137   2HD1  ILE  18          2HD1      ILE  18   4.922  -4.144   0.483
  138   3HD1  ILE  18          3HD1      ILE  18   6.606  -4.448   0.055
  139    H    ILE  19           H        ILE  19   6.595  -1.663   5.507
  140    HA   ILE  19           HA       ILE  19   8.088  -3.154   7.550
  141    HB   ILE  19           HB       ILE  19   9.185  -1.262   8.075
  142   1HG1  ILE  19          1HG1      ILE  19   6.494  -0.572   9.261
  143   2HG1  ILE  19          2HG1      ILE  19   7.794  -1.472  10.036
  144   1HG2  ILE  19          1HG2      ILE  19   7.893  -0.138   6.015
  145   2HG2  ILE  19          2HG2      ILE  19   7.206   0.794   7.338
  146   3HG2  ILE  19          3HG2      ILE  19   8.948   0.755   7.102
  147   1HD1  ILE  19          1HD1      ILE  19   8.707   1.116   9.174
  148   2HD1  ILE  19          2HD1      ILE  19   7.279   1.250  10.199
  149   3HD1  ILE  19          3HD1      ILE  19   8.707   0.398  10.786
  150    H    ALA  20           H        ALA  20   5.073  -2.279   6.333
  151    HA   ALA  20           HA       ALA  20   3.797  -3.444   8.666
  152   1HB   ALA  20          1HB       ALA  20   3.947  -0.859   8.833
  153   2HB   ALA  20          2HB       ALA  20   2.645  -0.887   7.643
  154   3HB   ALA  20          3HB       ALA  20   2.423  -1.668   9.207
  155    H    VAL  21           H        VAL  21   1.755  -4.323   8.262
  156    HA   VAL  21           HA       VAL  21   0.746  -4.183   5.519
  157    HB   VAL  21           HB       VAL  21   1.311  -6.782   6.957
  158   1HG1  VAL  21          1HG1      VAL  21  -0.120  -6.164   4.386
  159   2HG1  VAL  21          2HG1      VAL  21   0.598  -7.743   4.705
  160   3HG1  VAL  21          3HG1      VAL  21  -0.680  -7.128   5.754
  161   1HG2  VAL  21          1HG2      VAL  21   2.856  -5.176   5.120
  162   2HG2  VAL  21          2HG2      VAL  21   3.324  -6.614   6.028
  163   3HG2  VAL  21          3HG2      VAL  21   2.535  -6.779   4.459
  164    H    GLU  22           H        GLU  22  -1.355  -3.762   5.564
  165    HA   GLU  22           HA       GLU  22  -3.031  -4.987   7.621
  166   1HB   GLU  22          1HB       GLU  22  -2.976  -2.022   7.038
  167   2HB   GLU  22          2HB       GLU  22  -4.184  -2.826   8.030
  168   1HG   GLU  22          1HG       GLU  22  -2.880  -2.713   9.811
  169   2HG   GLU  22          2HG       GLU  22  -1.557  -3.502   8.953
  170    H    VAL  23           H        VAL  23  -2.625  -5.355   4.729
  171    HA   VAL  23           HA       VAL  23  -5.340  -4.676   3.799
  172    HB   VAL  23           HB       VAL  23  -4.336  -4.998   1.469
  173   1HG1  VAL  23          1HG1      VAL  23  -4.260  -2.741   3.273
  174   2HG1  VAL  23          2HG1      VAL  23  -3.002  -2.629   2.042
  175   3HG1  VAL  23          3HG1      VAL  23  -4.691  -2.802   1.564
  176   1HG2  VAL  23          1HG2      VAL  23  -2.198  -5.990   2.584
  177   2HG2  VAL  23          2HG2      VAL  23  -2.052  -4.983   1.144
  178   3HG2  VAL  23          3HG2      VAL  23  -1.723  -4.297   2.734
  179    H    ASN  24           H        ASN  24  -6.658  -6.328   3.437
  180    HA   ASN  24           HA       ASN  24  -5.534  -8.943   2.729
  181   1HB   ASN  24          1HB       ASN  24  -7.278  -8.286   5.063
  182   2HB   ASN  24          2HB       ASN  24  -7.463  -9.848   4.272
  183   1HD2  ASN  24          2HD2      ASN  24  -5.904  -8.231   6.677
  184   2HD2  ASN  24          1HD2      ASN  24  -4.562  -9.294   6.914
  185    H    VAL  25           H        VAL  25  -7.311  -6.593   1.603
  186    HA   VAL  25           HA       VAL  25  -8.947  -6.391   0.041
  187    HB   VAL  25           HB       VAL  25  -8.613  -9.384  -0.176
  188   1HG1  VAL  25          1HG1      VAL  25 -10.784  -8.544  -1.055
  189   2HG1  VAL  25          2HG1      VAL  25  -9.885  -7.503  -2.159
  190   3HG1  VAL  25          3HG1      VAL  25  -9.745  -9.256  -2.290
  191   1HG2  VAL  25          1HG2      VAL  25  -6.644  -7.788  -0.653
  192   2HG2  VAL  25          2HG2      VAL  25  -7.044  -9.021  -1.851
  193   3HG2  VAL  25          3HG2      VAL  25  -7.552  -7.351  -2.101
  194    H    GLY  26           H        GLY  26 -11.048  -6.000   0.344
  195   1HA   GLY  26          1HA       GLY  26 -12.603  -7.915   1.965
  196   2HA   GLY  26          2HA       GLY  26 -13.288  -6.864   0.734
  197    H    ASP  27           H        ASP  27 -10.892  -5.548   2.841
  198    HA   ASP  27           HA       ASP  27 -12.737  -4.598   4.827
  199   1HB   ASP  27          1HB       ASP  27  -9.832  -3.996   4.268
  200   2HB   ASP  27          2HB       ASP  27 -10.730  -3.237   5.579
  201    H    THR  28           H        THR  28 -13.289  -2.407   5.227
  202    HA   THR  28           HA       THR  28 -13.737  -0.903   2.797
  203    HB   THR  28           HB       THR  28 -14.509  -0.212   5.637
  204    HG1  THR  28           HG1      THR  28 -15.379  -2.226   4.843
  205   1HG2  THR  28          1HG2      THR  28 -14.651   1.689   4.108
  206   2HG2  THR  28          2HG2      THR  28 -15.674   0.737   3.032
  207   3HG2  THR  28          3HG2      THR  28 -16.242   1.153   4.648
  208    H    ILE  29           H        ILE  29 -12.416   0.615   2.063
  209    HA   ILE  29           HA       ILE  29 -10.501   1.839   3.934
  210    HB   ILE  29           HB       ILE  29  -9.179   2.419   1.905
  211   1HG1  ILE  29          1HG1      ILE  29 -10.289   0.467   0.127
  212   2HG1  ILE  29          2HG1      ILE  29 -11.558   1.594   0.592
  213   1HG2  ILE  29          1HG2      ILE  29  -9.767  -0.510   2.314
  214   2HG2  ILE  29          2HG2      ILE  29  -8.339   0.143   1.511
  215   3HG2  ILE  29          3HG2      ILE  29  -8.612   0.465   3.224
  216   1HD1  ILE  29          1HD1      ILE  29  -9.733   3.383   0.021
  217   2HD1  ILE  29          2HD1      ILE  29  -9.071   2.071  -0.950
  218   3HD1  ILE  29          3HD1      ILE  29 -10.713   2.643  -1.243
  219    H    ALA  30           H        ALA  30 -10.034   4.085   3.743
  220    HA   ALA  30           HA       ALA  30 -12.043   5.675   2.304
  221   1HB   ALA  30          1HB       ALA  30 -11.327   6.934   4.795
  222   2HB   ALA  30          2HB       ALA  30 -12.922   6.533   4.158
  223   3HB   ALA  30          3HB       ALA  30 -12.011   5.332   5.074
  224    H    VAL  31           H        VAL  31 -11.305   8.168   2.774
  225    HA   VAL  31           HA       VAL  31  -8.692   8.321   1.523
  226    HB   VAL  31           HB       VAL  31 -10.430  10.669   2.249
  227   1HG1  VAL  31          1HG1      VAL  31  -8.194  10.157   0.326
  228   2HG1  VAL  31          2HG1      VAL  31  -9.350  11.456   0.033
  229   3HG1  VAL  31          3HG1      VAL  31  -8.379  11.455   1.505
  230   1HG2  VAL  31          1HG2      VAL  31 -10.712   8.750  -0.044
  231   2HG2  VAL  31          2HG2      VAL  31 -11.949   9.326   1.073
  232   3HG2  VAL  31          3HG2      VAL  31 -11.287  10.414  -0.147
  233    H    ASP  32           H        ASP  32  -8.332   7.401   4.056
  234    HA   ASP  32           HA       ASP  32  -6.367   8.939   5.143
  235   1HB   ASP  32          1HB       ASP  32  -7.665   9.821   7.233
  236   2HB   ASP  32          2HB       ASP  32  -7.683  10.762   5.745
  237    H    ASP  33           H        ASP  33  -5.925   6.579   5.176
  238    HA   ASP  33           HA       ASP  33  -6.222   5.579   7.856
  239   1HB   ASP  33          1HB       ASP  33  -7.138   3.327   6.895
  240   2HB   ASP  33          2HB       ASP  33  -8.259   4.639   7.245
  241    H    THR  34           H        THR  34  -4.257   4.847   8.321
  242    HA   THR  34           HA       THR  34  -2.266   4.343   6.428
  243    HB   THR  34           HB       THR  34  -1.358   2.958   8.535
  244    HG1  THR  34           HG1      THR  34  -2.150   3.908  10.406
  245   1HG2  THR  34          1HG2      THR  34  -0.318   4.950   7.527
  246   2HG2  THR  34          2HG2      THR  34  -1.425   5.956   8.464
  247   3HG2  THR  34          3HG2      THR  34  -0.250   4.934   9.291
  248    H    LEU  35           H        LEU  35  -2.066   2.763   5.048
  249    HA   LEU  35           HA       LEU  35  -3.425   0.226   5.523
  250   1HB   LEU  35          1HB       LEU  35  -1.939   1.165   3.067
  251   2HB   LEU  35          2HB       LEU  35  -2.964  -0.254   3.187
  252    HG   LEU  35           HG       LEU  35  -3.866   2.618   3.370
  253   1HD1  LEU  35          1HD1      LEU  35  -3.727   0.630   1.206
  254   2HD1  LEU  35          2HD1      LEU  35  -5.248   1.511   1.340
  255   3HD1  LEU  35          3HD1      LEU  35  -3.733   2.393   1.137
  256   1HD2  LEU  35          1HD2      LEU  35  -5.273   0.027   3.866
  257   2HD2  LEU  35          2HD2      LEU  35  -5.340   1.531   4.784
  258   3HD2  LEU  35          3HD2      LEU  35  -6.158   1.411   3.225
  259    H    ILE  36           H        ILE  36  -0.202   1.512   4.815
  260    HA   ILE  36           HA       ILE  36   0.986  -0.680   6.285
  261    HB   ILE  36           HB       ILE  36   2.626  -1.208   4.459
  262   1HG1  ILE  36          1HG1      ILE  36   2.285  -0.655   2.234
  263   2HG1  ILE  36          2HG1      ILE  36   0.589  -0.256   2.476
  264   1HG2  ILE  36          1HG2      ILE  36   0.320  -2.364   5.115
  265   2HG2  ILE  36          2HG2      ILE  36   0.012  -2.044   3.410
  266   3HG2  ILE  36          3HG2      ILE  36   1.413  -3.003   3.889
  267   1HD1  ILE  36          1HD1      ILE  36   1.291   1.807   3.634
  268   2HD1  ILE  36          2HD1      ILE  36   2.970   1.398   3.283
  269   3HD1  ILE  36          3HD1      ILE  36   1.846   1.724   1.964
  270    H    THR  37           H        THR  37   3.524  -0.458   5.959
  271    HA   THR  37           HA       THR  37   4.256   2.377   6.012
  272    HB   THR  37           HB       THR  37   5.420   0.423   7.984
  273    HG1  THR  37           HG1      THR  37   3.905   1.282   9.491
  274   1HG2  THR  37          1HG2      THR  37   6.557   2.601   7.618
  275   2HG2  THR  37          2HG2      THR  37   5.088   3.404   8.173
  276   3HG2  THR  37          3HG2      THR  37   5.984   2.352   9.267
  277    H    LEU  38           H        LEU  38   6.353   2.795   5.261
  278    HA   LEU  38           HA       LEU  38   7.787   0.464   4.178
  279   1HB   LEU  38          1HB       LEU  38   6.545   2.569   2.749
  280   2HB   LEU  38          2HB       LEU  38   8.276   2.779   2.589
  281    HG   LEU  38           HG       LEU  38   8.200   0.207   1.992
  282   1HD1  LEU  38          1HD1      LEU  38   5.411   1.021   1.988
  283   2HD1  LEU  38          2HD1      LEU  38   5.927   0.343   0.443
  284   3HD1  LEU  38          3HD1      LEU  38   6.121  -0.592   1.926
  285   1HD2  LEU  38          1HD2      LEU  38   7.612   2.579   0.257
  286   2HD2  LEU  38          2HD2      LEU  38   9.120   1.689   0.447
  287   3HD2  LEU  38          3HD2      LEU  38   7.773   0.960  -0.427
  288    H    GLU  39           H        GLU  39  10.006   1.579   3.187
  289    HA   GLU  39           HA       GLU  39  11.201   3.564   4.809
  290   1HB   GLU  39          1HB       GLU  39  10.956   1.435   6.300
  291   2HB   GLU  39          2HB       GLU  39  12.342   0.867   5.382
  292   1HG   GLU  39          1HG       GLU  39  13.759   2.410   6.293
  293   2HG   GLU  39          2HG       GLU  39  12.469   3.566   6.615
  294    H    THR  40           H        THR  40  13.675   3.493   4.564
  295    HA   THR  40           HA       THR  40  14.514   2.245   2.057
  296    HB   THR  40           HB       THR  40  15.081   4.194   0.962
  297    HG1  THR  40           HG1      THR  40  15.879   5.905   1.925
  298   1HG2  THR  40          1HG2      THR  40  12.548   4.158   1.699
  299   2HG2  THR  40          2HG2      THR  40  13.036   5.631   2.534
  300   3HG2  THR  40          3HG2      THR  40  13.247   5.494   0.790
  301    H    ASP  41           H        ASP  41  16.953   3.766   1.922
  302    HA   ASP  41           HA       ASP  41  18.557   2.238   3.676
  303   1HB   ASP  41          1HB       ASP  41  18.962   4.110   1.505
  304   2HB   ASP  41          2HB       ASP  41  20.115   4.399   2.805
  305    H    LYS  42           H        LYS  42  16.920   5.229   4.057
  306    HA   LYS  42           HA       LYS  42  17.591   5.426   6.792
  307   1HB   LYS  42          1HB       LYS  42  19.736   6.225   5.901
  308   2HB   LYS  42          2HB       LYS  42  18.896   7.469   4.986
  309   1HG   LYS  42          1HG       LYS  42  19.245   8.807   6.721
  310   2HG   LYS  42          2HG       LYS  42  18.022   7.864   7.576
  311   1HD   LYS  42          1HD       LYS  42  19.661   6.491   8.595
  312   2HD   LYS  42          2HD       LYS  42  20.931   7.093   7.528
  313   1HE   LYS  42          1HE       LYS  42  21.411   8.694   8.987
  314   2HE   LYS  42          2HE       LYS  42  19.766   9.314   8.862
  315   1HZ   LYS  42          1HZ       LYS  42  19.790   7.008  10.484
  316   2HZ   LYS  42          2HZ       LYS  42  20.955   8.096  11.053
  317   3HZ   LYS  42          3HZ       LYS  42  19.345   8.587  10.896
  318    H    ALA  43           H        ALA  43  15.171   5.335   5.731
  319    HA   ALA  43           HA       ALA  43  13.928   7.702   6.641
  320   1HB   ALA  43          1HB       ALA  43  14.657   7.658   3.842
  321   2HB   ALA  43          2HB       ALA  43  14.020   8.980   4.822
  322   3HB   ALA  43          3HB       ALA  43  12.916   7.834   4.061
  323    H    THR  44           H        THR  44  11.870   7.272   7.208
  324    HA   THR  44           HA       THR  44  10.730   4.717   6.298
  325    HB   THR  44           HB       THR  44   9.364   4.819   8.372
  326    HG1  THR  44           HG1      THR  44   9.982   6.379   9.936
  327   1HG2  THR  44          1HG2      THR  44  12.239   4.500   8.306
  328   2HG2  THR  44          2HG2      THR  44  11.655   5.012   9.889
  329   3HG2  THR  44          3HG2      THR  44  11.010   3.551   9.141
  330    H    MET  45           H        MET  45   8.462   4.588   5.875
  331    HA   MET  45           HA       MET  45   6.961   7.056   5.620
  332   1HB   MET  45          1HB       MET  45   8.416   6.142   3.425
  333   2HB   MET  45          2HB       MET  45   6.771   5.600   3.116
  334   1HG   MET  45          1HG       MET  45   6.772   8.316   4.049
  335   2HG   MET  45          2HG       MET  45   7.851   8.135   2.666
  336   1HE   MET  45          1HE       MET  45   5.465   9.941   2.905
  337   2HE   MET  45          2HE       MET  45   5.881   9.900   1.191
  338   3HE   MET  45          3HE       MET  45   4.215   9.623   1.701
  339    H    ASP  46           H        ASP  46   4.843   6.280   4.158
  340    HA   ASP  46           HA       ASP  46   3.868   3.680   4.595
  341   1HB   ASP  46          1HB       ASP  46   2.121   4.371   6.357
  342   2HB   ASP  46          2HB       ASP  46   3.760   4.050   6.913
  343    H    VAL  47           H        VAL  47   1.338   3.689   4.430
  344    HA   VAL  47           HA       VAL  47   0.547   5.892   2.638
  345    HB   VAL  47           HB       VAL  47  -0.065   2.958   2.265
  346   1HG1  VAL  47          1HG1      VAL  47  -1.599   5.200   1.492
  347   2HG1  VAL  47          2HG1      VAL  47  -0.816   4.584   0.035
  348   3HG1  VAL  47          3HG1      VAL  47  -1.818   3.514   1.016
  349   1HG2  VAL  47          1HG2      VAL  47   2.216   3.745   1.610
  350   2HG2  VAL  47          2HG2      VAL  47   1.259   3.089   0.283
  351   3HG2  VAL  47          3HG2      VAL  47   1.447   4.833   0.457
  352    HA   PRO  48           HA       PRO  48  -2.958   5.842   5.445
  353   1HB   PRO  48          1HB       PRO  48  -3.838   8.297   4.933
  354   2HB   PRO  48          2HB       PRO  48  -2.300   8.050   5.771
  355   1HG   PRO  48          1HG       PRO  48  -2.813   8.831   2.944
  356   2HG   PRO  48          2HG       PRO  48  -1.502   9.326   4.027
  357   1HD   PRO  48          1HD       PRO  48  -1.390   7.312   2.051
  358   2HD   PRO  48          2HD       PRO  48  -0.182   7.626   3.312
  359    H    ALA  49           H        ALA  49  -3.083   4.725   2.644
  360    HA   ALA  49           HA       ALA  49  -4.598   4.204   1.018
  361   1HB   ALA  49          1HB       ALA  49  -6.904   4.492   2.808
  362   2HB   ALA  49          2HB       ALA  49  -5.594   3.490   3.430
  363   3HB   ALA  49          3HB       ALA  49  -6.347   3.099   1.884
  364    H    GLU  50           H        GLU  50  -4.530   5.944  -0.367
  365    HA   GLU  50           HA       GLU  50  -6.295   8.208   0.132
  366   1HB   GLU  50          1HB       GLU  50  -4.112   7.654  -1.851
  367   2HB   GLU  50          2HB       GLU  50  -5.264   8.950  -2.143
  368   1HG   GLU  50          1HG       GLU  50  -4.253  10.302  -0.703
  369   2HG   GLU  50          2HG       GLU  50  -4.180   9.052   0.538
  370    H    VAL  51           H        VAL  51  -7.993   6.372  -0.037
  371    HA   VAL  51           HA       VAL  51  -9.329   6.741  -2.556
  372    HB   VAL  51           HB       VAL  51  -9.587   4.016  -2.455
  373   1HG1  VAL  51          1HG1      VAL  51  -8.761   5.938  -4.243
  374   2HG1  VAL  51          2HG1      VAL  51  -7.382   4.842  -4.160
  375   3HG1  VAL  51          3HG1      VAL  51  -8.975   4.222  -4.589
  376   1HG2  VAL  51          1HG2      VAL  51  -6.757   4.715  -1.684
  377   2HG2  VAL  51          2HG2      VAL  51  -7.856   3.587  -0.893
  378   3HG2  VAL  51          3HG2      VAL  51  -7.183   3.198  -2.475
  379    H    ALA  52           H        ALA  52 -11.528   6.182  -2.486
  380    HA   ALA  52           HA       ALA  52 -12.546   5.588   0.221
  381   1HB   ALA  52          1HB       ALA  52 -13.983   7.147  -1.912
  382   2HB   ALA  52          2HB       ALA  52 -14.401   6.994  -0.203
  383   3HB   ALA  52          3HB       ALA  52 -12.960   7.892  -0.678
  384    H    GLY  53           H        GLY  53 -12.395   3.277  -0.503
  385   1HA   GLY  53          1HA       GLY  53 -13.707   2.136  -2.609
  386   2HA   GLY  53          2HA       GLY  53 -14.983   2.462  -1.453
  387    H    VAL  54           H        VAL  54 -13.409   0.028  -2.588
  388    HA   VAL  54           HA       VAL  54 -12.786  -1.284  -0.034
  389    HB   VAL  54           HB       VAL  54 -14.605  -2.396  -2.178
  390   1HG1  VAL  54          1HG1      VAL  54 -12.954  -3.745  -0.300
  391   2HG1  VAL  54          2HG1      VAL  54 -14.631  -3.947   0.206
  392   3HG1  VAL  54          3HG1      VAL  54 -14.135  -4.431  -1.415
  393   1HG2  VAL  54          1HG2      VAL  54 -15.084  -1.223   0.527
  394   2HG2  VAL  54          2HG2      VAL  54 -15.971  -0.982  -0.978
  395   3HG2  VAL  54          3HG2      VAL  54 -16.155  -2.487  -0.078
  396    H    VAL  55           H        VAL  55 -11.119  -2.753  -0.137
  397    HA   VAL  55           HA       VAL  55  -9.481  -2.708  -2.478
  398    HB   VAL  55           HB       VAL  55  -9.171  -4.416  -0.008
  399   1HG1  VAL  55          1HG1      VAL  55  -7.961  -5.238  -2.031
  400   2HG1  VAL  55          2HG1      VAL  55  -7.115  -3.690  -2.100
  401   3HG1  VAL  55          3HG1      VAL  55  -6.891  -4.756  -0.713
  402   1HG2  VAL  55          1HG2      VAL  55  -9.141  -1.803   0.127
  403   2HG2  VAL  55          2HG2      VAL  55  -7.909  -2.750   0.961
  404   3HG2  VAL  55          3HG2      VAL  55  -7.537  -1.985  -0.584
  405    H    LYS  56           H        LYS  56  -8.932  -4.363  -3.843
  406    HA   LYS  56           HA       LYS  56 -10.769  -6.668  -3.860
  407   1HB   LYS  56          1HB       LYS  56  -9.489  -6.289  -6.402
  408   2HB   LYS  56          2HB       LYS  56 -11.208  -6.292  -6.025
  409   1HG   LYS  56          1HG       LYS  56  -9.518  -3.853  -5.603
  410   2HG   LYS  56          2HG       LYS  56 -10.221  -4.233  -7.174
  411   1HD   LYS  56          1HD       LYS  56 -11.866  -4.087  -4.659
  412   2HD   LYS  56          2HD       LYS  56 -11.557  -2.676  -5.672
  413   1HE   LYS  56          1HE       LYS  56 -12.551  -3.848  -7.586
  414   2HE   LYS  56          2HE       LYS  56 -12.880  -5.239  -6.553
  415   1HZ   LYS  56          1HZ       LYS  56 -13.909  -2.762  -5.514
  416   2HZ   LYS  56          2HZ       LYS  56 -14.586  -3.195  -7.003
  417   3HZ   LYS  56          3HZ       LYS  56 -14.674  -4.262  -5.692
  418    H    GLU  57           H        GLU  57  -7.530  -5.526  -4.674
  419    HA   GLU  57           HA       GLU  57  -6.605  -8.280  -4.417
  420   1HB   GLU  57          1HB       GLU  57  -5.845  -6.081  -6.241
  421   2HB   GLU  57          2HB       GLU  57  -4.540  -7.118  -5.680
  422   1HG   GLU  57          1HG       GLU  57  -5.472  -9.021  -6.667
  423   2HG   GLU  57          2HG       GLU  57  -7.046  -8.251  -6.868
  424    H    VAL  58           H        VAL  58  -4.158  -8.332  -3.858
  425    HA   VAL  58           HA       VAL  58  -3.204  -6.285  -2.079
  426    HB   VAL  58           HB       VAL  58  -4.744  -7.384  -0.553
  427   1HG1  VAL  58          1HG1      VAL  58  -3.895  -9.734  -1.919
  428   2HG1  VAL  58          2HG1      VAL  58  -3.574  -9.931  -0.196
  429   3HG1  VAL  58          3HG1      VAL  58  -5.202  -9.543  -0.752
  430   1HG2  VAL  58          1HG2      VAL  58  -2.044  -6.975  -0.108
  431   2HG2  VAL  58          2HG2      VAL  58  -3.288  -7.195   1.123
  432   3HG2  VAL  58          3HG2      VAL  58  -2.348  -8.578   0.562
  433    H    LYS  59           H        LYS  59  -1.131  -6.206  -2.587
  434    HA   LYS  59           HA       LYS  59   0.366  -8.719  -2.880
  435   1HB   LYS  59          1HB       LYS  59   1.001  -6.369  -4.617
  436   2HB   LYS  59          2HB       LYS  59   1.360  -8.072  -4.877
  437   1HG   LYS  59          1HG       LYS  59  -1.360  -8.089  -4.882
  438   2HG   LYS  59          2HG       LYS  59  -1.011  -6.513  -5.596
  439   1HD   LYS  59          1HD       LYS  59   0.753  -8.040  -6.939
  440   2HD   LYS  59          2HD       LYS  59  -0.522  -9.224  -6.648
  441   1HE   LYS  59          1HE       LYS  59  -1.990  -7.099  -7.451
  442   2HE   LYS  59          2HE       LYS  59  -0.508  -6.831  -8.368
  443   1HZ   LYS  59          1HZ       LYS  59  -0.804  -9.342  -8.929
  444   2HZ   LYS  59          2HZ       LYS  59  -2.424  -9.047  -8.542
  445   3HZ   LYS  59          3HZ       LYS  59  -1.676  -8.171  -9.782
  446    H    VAL  60           H        VAL  60   1.005  -8.221  -0.669
  447    HA   VAL  60           HA       VAL  60   3.511  -6.949  -0.540
  448    HB   VAL  60           HB       VAL  60   2.647  -4.826  -0.540
  449   1HG1  VAL  60          1HG1      VAL  60   0.258  -5.827   0.997
  450   2HG1  VAL  60          2HG1      VAL  60   0.519  -4.152   0.513
  451   3HG1  VAL  60          3HG1      VAL  60   0.316  -5.403  -0.715
  452   1HG2  VAL  60          1HG2      VAL  60   3.851  -5.339   1.653
  453   2HG2  VAL  60          2HG2      VAL  60   2.882  -3.869   1.585
  454   3HG2  VAL  60          3HG2      VAL  60   2.254  -5.302   2.398
  455    H    LYS  61           H        LYS  61   4.519  -7.146   1.490
  456    HA   LYS  61           HA       LYS  61   3.060  -8.623   3.557
  457   1HB   LYS  61          1HB       LYS  61   4.935  -9.799   1.786
  458   2HB   LYS  61          2HB       LYS  61   5.714  -9.684   3.358
  459   1HG   LYS  61          1HG       LYS  61   4.711 -11.651   3.726
  460   2HG   LYS  61          2HG       LYS  61   3.296 -10.654   4.073
  461   1HD   LYS  61          1HD       LYS  61   2.253 -11.226   2.137
  462   2HD   LYS  61          2HD       LYS  61   3.765 -11.368   1.239
  463   1HE   LYS  61          1HE       LYS  61   4.166 -13.454   2.714
  464   2HE   LYS  61          2HE       LYS  61   2.434 -13.366   3.031
  465   1HZ   LYS  61          1HZ       LYS  61   2.567 -13.131   0.343
  466   2HZ   LYS  61          2HZ       LYS  61   3.825 -14.217   0.662
  467   3HZ   LYS  61          3HZ       LYS  61   2.253 -14.569   1.177
  468    H    VAL  62           H        VAL  62   4.586  -8.901   5.539
  469    HA   VAL  62           HA       VAL  62   5.656  -6.249   6.105
  470    HB   VAL  62           HB       VAL  62   4.061  -7.314   7.688
  471   1HG1  VAL  62          1HG1      VAL  62   5.904  -9.496   7.450
  472   2HG1  VAL  62          2HG1      VAL  62   5.764  -9.007   9.139
  473   3HG1  VAL  62          3HG1      VAL  62   4.321  -9.449   8.227
  474   1HG2  VAL  62          1HG2      VAL  62   6.513  -5.993   8.262
  475   2HG2  VAL  62          2HG2      VAL  62   4.987  -5.924   9.144
  476   3HG2  VAL  62          3HG2      VAL  62   6.188  -7.151   9.551
  477    H    GLY  63           H        GLY  63   7.333  -7.345   4.384
  478   1HA   GLY  63          1HA       GLY  63   9.423  -8.828   5.748
  479   2HA   GLY  63          2HA       GLY  63   9.828  -7.167   5.344
  480    H    ASP  64           H        ASP  64   8.818  -6.771   2.899
  481    HA   ASP  64           HA       ASP  64  10.238  -8.768   1.269
  482   1HB   ASP  64          1HB       ASP  64   8.491  -8.216  -0.536
  483   2HB   ASP  64          2HB       ASP  64   7.987  -9.259   0.790
  484    H    LYS  65           H        LYS  65  10.256  -7.685  -1.145
  485    HA   LYS  65           HA       LYS  65  11.612  -5.109  -0.741
  486   1HB   LYS  65          1HB       LYS  65  12.029  -7.383  -2.631
  487   2HB   LYS  65          2HB       LYS  65  12.483  -5.766  -3.151
  488   1HG   LYS  65          1HG       LYS  65  13.436  -6.597  -0.485
  489   2HG   LYS  65          2HG       LYS  65  14.143  -7.428  -1.872
  490   1HD   LYS  65          1HD       LYS  65  13.936  -4.487  -2.070
  491   2HD   LYS  65          2HD       LYS  65  15.091  -5.113  -0.892
  492   1HE   LYS  65          1HE       LYS  65  15.779  -6.666  -2.909
  493   2HE   LYS  65          2HE       LYS  65  15.074  -5.358  -3.858
  494   1HZ   LYS  65          1HZ       LYS  65  16.565  -3.863  -2.433
  495   2HZ   LYS  65          2HZ       LYS  65  17.411  -5.279  -2.060
  496   3HZ   LYS  65          3HZ       LYS  65  17.289  -4.764  -3.668
  497    H    ILE  66           H        ILE  66  11.265  -3.392  -2.193
  498    HA   ILE  66           HA       ILE  66   9.002  -3.661  -4.027
  499    HB   ILE  66           HB       ILE  66   8.895  -2.297  -1.505
  500   1HG1  ILE  66          1HG1      ILE  66   6.524  -2.137  -2.049
  501   2HG1  ILE  66          2HG1      ILE  66   6.871  -2.504  -3.736
  502   1HG2  ILE  66          1HG2      ILE  66   9.690  -0.327  -2.870
  503   2HG2  ILE  66          2HG2      ILE  66   8.172  -0.445  -3.761
  504   3HG2  ILE  66          3HG2      ILE  66   8.156  -0.116  -2.029
  505   1HD1  ILE  66          1HD1      ILE  66   7.774  -4.441  -1.685
  506   2HD1  ILE  66          2HD1      ILE  66   6.048  -4.346  -2.039
  507   3HD1  ILE  66          3HD1      ILE  66   7.195  -4.713  -3.329
  508    H    SER  67           H        SER  67   8.762  -1.560  -5.355
  509    HA   SER  67           HA       SER  67  11.211  -0.069  -5.739
  510   1HB   SER  67          1HB       SER  67  11.032  -0.746  -8.295
  511   2HB   SER  67          2HB       SER  67  11.956  -1.727  -7.159
  512    HG   SER  67           HG       SER  67  10.105  -2.613  -8.665
  513    H    GLU  68           H        GLU  68   8.875   0.949  -4.917
  514    HA   GLU  68           HA       GLU  68   7.095   2.331  -5.386
  515   1HB   GLU  68          1HB       GLU  68   9.276   3.390  -7.188
  516   2HB   GLU  68          2HB       GLU  68   7.793   4.263  -6.831
  517   1HG   GLU  68          1HG       GLU  68   8.382   4.235  -4.442
  518   2HG   GLU  68          2HG       GLU  68   9.896   3.429  -4.848
  519    H    GLY  69           H        GLY  69   6.155   0.283  -6.506
  520   1HA   GLY  69          1HA       GLY  69   5.851   0.667  -9.390
  521   2HA   GLY  69          2HA       GLY  69   4.406   0.799  -8.402
  522    H    GLY  70           H        GLY  70   4.081  -1.140  -6.864
  523   1HA   GLY  70          1HA       GLY  70   4.780  -3.556  -6.667
  524   2HA   GLY  70          2HA       GLY  70   4.678  -3.583  -8.421
  525    H    LEU  71           H        LEU  71   2.250  -1.690  -8.038
  526    HA   LEU  71           HA       LEU  71  -0.013  -1.844  -7.729
  527   1HB   LEU  71          1HB       LEU  71   0.330  -3.103  -9.812
  528   2HB   LEU  71          2HB       LEU  71   0.527  -4.579  -8.887
  529    HG   LEU  71           HG       LEU  71  -1.754  -4.646  -8.288
  530   1HD1  LEU  71          1HD1      LEU  71  -1.637  -1.757  -8.797
  531   2HD1  LEU  71          2HD1      LEU  71  -3.129  -2.546  -9.305
  532   3HD1  LEU  71          3HD1      LEU  71  -2.593  -2.669  -7.629
  533   1HD2  LEU  71          1HD2      LEU  71  -0.963  -4.638 -10.934
  534   2HD2  LEU  71          2HD2      LEU  71  -2.488  -5.255 -10.300
  535   3HD2  LEU  71          3HD2      LEU  71  -2.394  -3.607 -10.918
  536    H    ILE  72           H        ILE  72   1.113  -2.175  -5.354
  537    HA   ILE  72           HA       ILE  72   0.884  -4.451  -3.894
  538    HB   ILE  72           HB       ILE  72   0.516  -1.572  -3.202
  539   1HG1  ILE  72          1HG1      ILE  72   2.374  -3.360  -1.765
  540   2HG1  ILE  72          2HG1      ILE  72   2.676  -3.164  -3.489
  541   1HG2  ILE  72          1HG2      ILE  72  -0.434  -3.818  -1.540
  542   2HG2  ILE  72          2HG2      ILE  72   0.610  -2.653  -0.723
  543   3HG2  ILE  72          3HG2      ILE  72  -0.875  -2.109  -1.503
  544   1HD1  ILE  72          1HD1      ILE  72   2.166  -0.656  -2.114
  545   2HD1  ILE  72          2HD1      ILE  72   3.579  -1.521  -1.510
  546   3HD1  ILE  72          3HD1      ILE  72   3.462  -1.106  -3.220
  547    H    VAL  73           H        VAL  73  -1.685  -2.068  -3.348
  548    HA   VAL  73           HA       VAL  73  -3.626  -4.280  -3.538
  549    HB   VAL  73           HB       VAL  73  -4.930  -3.252  -1.768
  550   1HG1  VAL  73          1HG1      VAL  73  -2.428  -4.485  -1.459
  551   2HG1  VAL  73          2HG1      VAL  73  -2.493  -3.193  -0.259
  552   3HG1  VAL  73          3HG1      VAL  73  -3.754  -4.425  -0.296
  553   1HG2  VAL  73          1HG2      VAL  73  -2.791  -1.144  -1.849
  554   2HG2  VAL  73          2HG2      VAL  73  -4.534  -0.944  -2.024
  555   3HG2  VAL  73          3HG2      VAL  73  -3.847  -1.369  -0.456
  556    H    VAL  74           H        VAL  74  -5.606  -3.898  -4.416
  557    HA   VAL  74           HA       VAL  74  -5.947  -1.337  -5.850
  558    HB   VAL  74           HB       VAL  74  -6.981  -4.087  -6.591
  559   1HG1  VAL  74          1HG1      VAL  74  -8.348  -1.967  -7.197
  560   2HG1  VAL  74          2HG1      VAL  74  -7.072  -1.696  -8.384
  561   3HG1  VAL  74          3HG1      VAL  74  -8.030  -3.175  -8.442
  562   1HG2  VAL  74          1HG2      VAL  74  -4.558  -2.580  -7.323
  563   2HG2  VAL  74          2HG2      VAL  74  -4.854  -4.319  -7.303
  564   3HG2  VAL  74          3HG2      VAL  74  -5.420  -3.343  -8.659
  565    H    VAL  75           H        VAL  75  -7.896  -0.265  -5.612
  566    HA   VAL  75           HA       VAL  75  -9.931  -1.590  -3.962
  567    HB   VAL  75           HB       VAL  75 -10.314   0.807  -3.024
  568   1HG1  VAL  75          1HG1      VAL  75  -8.277  -1.213  -2.214
  569   2HG1  VAL  75          2HG1      VAL  75  -8.420   0.287  -1.301
  570   3HG1  VAL  75          3HG1      VAL  75  -9.808  -0.790  -1.447
  571   1HG2  VAL  75          1HG2      VAL  75  -8.182   1.372  -4.652
  572   2HG2  VAL  75          2HG2      VAL  75  -8.747   2.371  -3.314
  573   3HG2  VAL  75          3HG2      VAL  75  -7.433   1.222  -3.065
  574    H    GLU  76           H        GLU  76 -11.971  -0.180  -3.857
  575    HA   GLU  76           HA       GLU  76 -12.851   0.246  -6.581
  576   1HB   GLU  76          1HB       GLU  76 -14.063  -0.705  -4.265
  577   2HB   GLU  76          2HB       GLU  76 -14.775   0.890  -4.485
  578   1HG   GLU  76          1HG       GLU  76 -15.441   0.287  -6.754
  579   2HG   GLU  76          2HG       GLU  76 -14.726  -1.311  -6.537
  580    H    ALA  77           H        ALA  77 -12.176   2.113  -3.707
  581    HA   ALA  77           HA       ALA  77 -12.091   4.335  -3.268
  582   1HB   ALA  77          1HB       ALA  77 -10.729   5.420  -4.662
  583   2HB   ALA  77          2HB       ALA  77 -11.759   5.130  -6.064
  584   3HB   ALA  77          3HB       ALA  77 -10.658   3.872  -5.503
  585    H    GLU  78           H        GLU  78 -13.040   6.476  -3.631
  586    HA   GLU  78           HA       GLU  78 -14.771   7.905  -3.965
  587   1HB   GLU  78          1HB       GLU  78 -16.045   6.095  -5.957
  588   2HB   GLU  78          2HB       GLU  78 -15.958   7.849  -5.934
  589   1HG   GLU  78          1HG       GLU  78 -13.455   7.549  -6.348
  590   2HG   GLU  78          2HG       GLU  78 -13.856   5.882  -6.759
  591    H    GLY  79           H        GLY  79 -16.276   4.738  -4.570
  592   1HA   GLY  79          1HA       GLY  79 -18.129   5.334  -2.347
  593   2HA   GLY  79          2HA       GLY  79 -17.417   3.742  -2.554
  594    H    THR  80           H        THR  80 -18.713   2.305  -3.454
  595    HA   THR  80           HA       THR  80 -21.133   3.119  -4.774
  596    HB   THR  80           HB       THR  80 -20.656   1.849  -6.866
  597    HG1  THR  80           HG1      THR  80 -18.047   1.779  -5.771
  598   1HG2  THR  80          1HG2      THR  80 -20.315   4.344  -6.698
  599   2HG2  THR  80          2HG2      THR  80 -18.594   4.000  -6.525
  600   3HG2  THR  80          3HG2      THR  80 -19.448   3.517  -7.991
  601    H    ALA  81           H        ALA  81 -20.459   1.625  -2.433
  602    HA   ALA  81           HA       ALA  81 -22.072  -0.709  -2.921
  603   1HB   ALA  81          1HB       ALA  81 -20.180  -1.886  -3.487
  604   2HB   ALA  81          2HB       ALA  81 -19.141  -0.940  -2.421
  605   3HB   ALA  81          3HB       ALA  81 -20.230  -2.152  -1.744

  No H/Q in entry =         605