*HEADER    UNKNOWN FUNCTION                        27-MAR-12   2LR7              
*TITLE     CATHELICIDIN-PY                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CATHELICIDIN-PY;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RANA CATESBEIANA;                               
*SOURCE   3 ORGANISM_TAXID: 8400;                                                
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET-28(A)                                  
*KEYWDS    UNKNOWN FUNCTION                                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.YANG                                                                
*REVDAT   1   27-MAR-13 2LR7    0                                                


      Assignment         w1         w2        Volume               
              ?-?      1.214      3.794   1.16e+09  
              ?-?      1.062      3.883   1.64e+09  
              ?-?      1.065      3.794   4.28e+08  
              ?-?      1.042      4.021   1.35e+09         
              ?-?      0.936      3.872   2.78e+08  
              ?-?      1.797      4.239   2.23e+09                
              ?-?      1.407      4.222   9.18e+07  
              ?-?      2.281      4.018   4.96e+08                
              ?-?      2.012      4.009   1.43e+09  
              ?-?      1.803      4.007   3.62e+08  
              ?-?      1.694      4.007   1.03e+09  
              ?-?      1.498      4.005   2.26e+08                
              ?-?      2.449      3.767   1.64e+09  
              ?-?      2.440      3.863   1.50e+08  
              ?-?      2.449      3.793   6.33e+08  
              ?-?      2.281      3.895   3.15e+08  
              ?-?      2.142      3.784   1.77e+09  
              ?-?      2.141      3.762   2.11e+09  
              ?-?      2.095      3.884   5.82e+09  
              ?-?      2.071      3.788   6.79e+09  
              ?-?      2.056      3.753   4.69e+07  
              ?-?      2.020      3.880   7.68e+09  
              ?-?      1.952      3.763   4.73e+08  
              ?-?      1.953      3.794   1.21e+09  
              ?-?      1.886      3.881   6.76e+08  
              ?-?      1.739      3.751   7.08e+07  
              ?-?      2.438      4.178   6.14e+08               
              ?-?      2.110      4.086   5.26e+09  
              ?-?      2.021      4.089   5.37e+09                
              ?-?      3.406      4.323   3.85e+08  
              ?-?      3.337      4.083   2.07e+08  
              ?-?      3.263      4.320   7.93e+07              
              ?-?      4.313      4.442   9.85e+08            
              ?-?      2.063      3.118   1.01e+08  
              ?-?      2.087      2.792   3.62e+08  
              ?-?      2.155      3.031   5.22e+07  
              ?-?      2.131      3.317   1.37e+09  
              ?-?      2.131      3.367   1.92e+09  
              ?-?      1.947      3.330   1.86e+09  
              ?-?      1.743      3.329   2.34e+09  
              ?-?      1.813      3.041   6.51e+09  
              ?-?      1.634      3.030   4.34e+08             
              ?-?      1.500      3.020   1.65e+08               
              ?-?      1.216      2.445   1.45e+09  
              ?-?      1.059      2.444   1.76e+09               
              ?-?      1.259      2.020   4.41e+08                
              ?-?      1.346      2.110   3.51e+08                             
              ?-?      2.499      8.526   2.75e+08  
              ?-?      2.335      8.525   1.59e+08  
              ?-?      2.116      8.458   1.05e+10  
              ?-?      1.835      8.321   8.65e+09               
              ?-?      3.261      7.321   3.68e+07  
              ?-?      3.403      7.414   4.60e+07  
              ?-?      3.326      7.604   3.46e+07  
              ?-?      3.147      6.742   8.85e+07  
              ?-?      1.664      7.376   2.09e+08  
              ?-?      0.979      7.394   8.08e+08  
              ?-?      3.601      6.743   6.42e+07          
              ?-?      4.759      7.510   5.14e+08  
              ?-?      4.758      7.613   5.48e+08  
              ?-?      4.757      8.776   2.22e+08 
              ?-?      5.042      8.485   9.68e+07  
              ?-?      4.878      8.491   6.05e+09               
              ?-?      3.889      8.444   5.27e+08  
              ?-?      3.589      8.477   1.37e+08               
              ?-?      7.746      8.608   1.41e+08  
              ?-?      7.641      8.448   1.95e+08  
              ?-?      7.918      8.526   2.47e+08               
              ?-?      8.491      8.832   6.33e+09  
              ?-?      8.388      8.830   6.47e+09  
              ?-?      8.264      8.820   2.27e+08  
              ?-?      8.436      8.860   1.73e+09                
              ?-?      8.169      8.509   1.89e+08  
              ?-?      8.381      8.608   2.02e+08                
              ?-?      8.161      8.452   3.16e+09  
              ?-?      8.101      8.419   3.11e+09  
              ?-?      8.082      8.452   5.14e+09  
              ?-?      8.060      8.318   2.80e+08  
              ?-?      8.051      8.259   9.58e+07                
              ?-?      6.743      7.812   1.11e+08  
              ?-?      6.795      7.638   1.07e+09               
              ?-?      1.764      8.385   7.08e+07  
              ?-?      4.212      8.168   3.13e+07               
              ?-?      3.860      8.410   1.04e+08              
              ?-?      4.738      7.122   3.69e+08               
              ?-?      4.193      8.499   7.77e+09           
          ?-E11HN      1.065      8.322   6.14e+08  
     R1HG1-E11HG1      1.041      2.282   2.72e+09  
          K2HA-HN      4.574      8.525   3.88e+08  
       K2HB2-K8HN      2.168      8.821   4.00e+08  
        C3HA-K2HN      4.761      8.509   3.72e+09  
          C3HA-HN      4.757      8.776   2.23e+08  
        N4HA-C3HN      4.757      8.776   2.23e+08 
          N4HA-HN      4.753      8.610   1.15e+08  
        F5HA-K2HN      4.578      8.523   3.88e+08 
          F5HA-HN      4.600      8.326   3.88e+07  
        F5HA-L9HN      4.611      8.445   2.08e+08  
         F5HB1-HN      3.491      8.324   6.91e+07  
     F5HB1-K10HE1      3.488      3.869   3.72e+08  
      F5HB1-K10HN      3.489      7.128   2.24e+08  
         F5HB2-HN      3.369      8.326   5.90e+07  
     F5HB2-K10HE1      3.350      3.871   7.77e+08  
      F5HB2-K10HN      3.372      7.128   1.54e+08  
        F5HD2-HE1      7.192      7.417   6.66e+07  
          L6HA-HN      4.095      8.396   6.40e+09  
        L6HA-C7HN      4.113      8.314   8.84e+07  
       L6HA-S19HN      4.108      8.610   1.71e+08  
        L6HD11-HN      0.984      8.393   6.93e+09  
     L6HD11-E11HN      0.990      8.322   6.77e+08  
     L6HD11-K12HN      0.997      7.320   3.65e+08  
     L6HD11-K23HN      0.979      7.409   5.31e+08  
       L6HD21-HB1      1.049      1.798   4.13e+09  
     L6HD21-K10HN      1.053      7.128   2.15e+08  
     L6HD21-T18HB      1.075      4.071   2.77e+10  
        C7HA-L6HN      4.183      8.400   7.77e+09  
          C7HA-HN      4.221      8.312   1.05e+08  
         C7HB1-HA      3.334      4.210   7.58e+07  
         C7HB2-HA      2.588      4.215   1.92e+08  
          K8HA-HN      4.175      8.822   5.46e+08  
       K8HA-H20HN      4.190      8.851   4.26e+09  
       K8HA-I21HN      4.219      8.260   1.40e+08  
         K8HB1-HN      1.929      8.830   2.51e+09  
         K8HB2-HN      1.687      8.821   3.33e+08  
         K8HG1-HA      1.217      4.170   4.24e+08  
        K8HG1-HE1      1.216      3.029   1.31e+08  
         K8HG1-HN      1.241      8.837   2.17e+09  
      K8HG1-H20HN      1.242      8.862   4.35e+08  
         L9HB1-HN      1.896      8.447   8.64e+09  
       L9HB2-L6HN      1.652      8.391   7.18e+09  
       L9HB2-C7HN      1.670      8.309   7.42e+07  
         L9HB2-HN      1.671      8.450   9.93e+07  
        L9HD11-HN      0.969      8.456   6.95e+09  
      L9HD12-K8HN      0.955      8.832   9.24e+08  
     L9HD12-K10HN      0.965      7.127   3.90e+07  
        L9HD21-HA      0.961      4.168   3.09e+08  
       L9HD21-HB1      0.968      1.888   4.42e+09  
          L9HG-HN      1.217      8.440   4.97e+08      
         K10HA-HN      4.599      7.128   9.86e+07  
        K10HB1-HN      1.881      7.126   5.26e+07  
      K10HE1-F5HN      3.889      8.325   1.20e+08  
       K10HG1-HB1      1.347      1.886   8.86e+08  
       K10HG1-HE1      1.337      3.888   1.42e+10  
        K10HG1-HN      1.348      7.128   5.80e+07  
     K10HG1-E11HN      1.344      8.325   1.21e+08  
       E11HA-C7HN      3.987      8.310   4.43e+07  
       E11HA-K8HN      3.985      8.821   3.60e+07  
      E11HB1-L6HN      2.079      8.392   9.72e+09  
        E11HB1-HN      2.025      8.323   1.00e+10  
        E11HB2-HA      1.867      4.097   2.78e+10  
        E11HB2-HN      1.891      8.333   9.28e+09  
      E11HG1-R1HN      2.281      7.818   9.44e+07  
        E11HG1-HA      2.355      4.100   2.88e+08  
        E11HG2-HA      2.252      4.090   4.36e+09  
         K12HA-HN      4.322      7.319   3.15e+08  
       K12HB1-HE1      1.840      3.114   1.87e+10  
        K12HB1-HN      1.852      7.320   1.03e+08  
       K12HB2-HE1      1.742      3.113   1.51e+10  
        K12HB2-HN      1.699      7.323   8.19e+08  
        K12HD1-HN      1.578      7.328   1.80e+09  
     K12HD1-S19HN      1.565      8.610   1.72e+08  
        K12HE1-HN      3.133      7.319   5.89e+08  
      L13HB1-L6HN      1.849      8.388   8.55e+09  
        L13HB1-HA      1.940      4.168   5.17e+08  
     L13HB1-S19HN      1.863      8.610   9.48e+08  
        L13HB2-HA      1.694      4.167   4.85e+08  
        L13HB2-HN      1.687      7.640   1.44e+08  
         L13HG-HA      1.572      4.164   8.25e+07  
        R14HB1-HA      2.066      4.248   1.29e+09  
     R14HB1-S19HN      2.073      8.609   2.30e+08  
        R14HD1-HA      3.694      4.244   1.01e+08  
        R14HG1-HN      1.711      7.747   5.59e+07  
     R14HG1-I17HN      1.709      8.509   2.14e+08  
         T15HA-HN      4.201      8.448   7.52e+09  
         T15HB-HN      3.797      8.444   5.31e+08  
      T15HB-S19HN      3.756      8.528   7.76e+07  
       T15HG21-HN      1.356      8.436   7.33e+09  
         V16HA-HN      4.242      7.746   1.37e+08  
      V16HA-S19HN      4.226      8.608   8.21e+07  
         V16HB-HA      2.162      4.211   2.40e+10  
    V16HG11-H20HN      0.953      8.854   1.11e+09  
         I17HA-HN      4.097      8.508   1.92e+08  
        I17HB-HN      1.928      8.509   3.46e+08  
     I17HB-H20HN      1.902      8.853   3.86e+09  
     I17HD11-R1HN      1.044      7.818   5.32e+07  
     I17HD11-L9HN      1.067      8.438   7.64e+08  
    I17HD11-H20HN      1.058      8.863   3.44e+08  
       I17HG11-HA      1.544      4.101   8.21e+09  
       I17HG11-HN      0.949      8.507   6.33e+07  
      T18HB-K12HN      4.089      7.321   2.50e+08  
      T18HB-T15HN      4.117      8.434   5.64e+09  
         T18HB-HN      4.105      8.409   6.00e+09  
       T18HG21-HA      1.458      4.436   2.06e+08  
       T18HG21-HN      1.463      8.415   6.18e+09  
         S19HA-HN      4.323      8.608   6.25e+07  
     S19HB1-V16HN      3.832      7.748   4.21e+07  
        S19HB1-HN      3.836      8.608   6.29e+07  
     S19HB1-H20HN      3.981      8.861   2.87e+07  
     S19HB2-R14HN      3.712      7.747   6.18e+07  
        S19HB2-HN      3.720      8.609   8.67e+07  
      H20HA-D22HN      4.459      8.445   6.32e+08  
     H20HB1-K10HN      3.881      7.128   9.13e+07  
        H20HB1-HN      3.864      8.863   2.52e+08  
       I21HA-K8HN      4.131      8.823   1.45e+09  
      I21HA-H20HN      4.113      8.855   6.88e+09  
         I21HA-HN      4.116      8.261   4.07e+07  
        I21HB1-HN      2.179      8.260   2.61e+08  
       I21HD11-HA      0.990      4.104   2.69e+10  
       I21HG21-HN      1.631      8.259   7.48e+07  
      D22HA-V24HN      4.464      7.641   9.60e+07  
        D22HB1-HA      2.903      4.460   1.06e+09  
        D22HB1-HN      2.908      8.447   4.23e+08  
     D22HB1-V24HN      2.910      7.642   7.37e+07  
        D22HB2-HA      2.794      4.460   1.12e+09  
        D22HB2-HN      2.785      8.447   3.80e+08  
     D22HB2-V24HN      2.787      7.641   1.04e+08  
        K23HB2-HA      1.678      4.239   2.15e+09  
        K23HB2-HN      1.652      7.414   1.19e+08  
        K23HE1-HA      3.118      4.256   9.70e+08  
        K23HE1-HN      3.133      7.414   7.28e+07  
     K23HE1-R26HN      3.139      8.479   1.71e+08  
     K23HE1-P27HA      3.128      4.322   5.44e+08  
         V24HA-HN      4.255      7.640   2.80e+08  
       V24HB-F5HN      2.081      8.329   1.02e+10  
         V24HB-HN      2.073      7.641   3.33e+08  
    V24HG11-L25HN      1.074      8.422   1.93e+09  
       V24HG21-HB      1.064      2.108   1.82e+09  
         L25HA-HN      4.446      8.419   1.64e+09  
       L25HD11-HN      0.954      8.417   7.07e+09  
         R26HA-HN      4.758      8.483   2.04e+09  
        R26HD1-HN      3.394      8.475   9.69e+07  
       P27HB1-HB2      2.348      2.527   1.30e+09  
     P27HD2-K12HN      3.403      7.319   4.23e+08  
         P27HG1-?      2.119      2.350   3.22e+09  
     P27HG1-H20HN      2.007      8.854   4.00e+09  
        Q28HB1-HN      2.127      8.516   1.12e+09  
     Q28HG1-T15HN      2.445      8.441   3.08e+08  
     Q28HG1-H20HN      2.444      8.862   3.41e+08  
         G29HA1-HN      3.958      7.922   4.03e+07  
         G29HA1-?      3.961      4.238   2.39e+08  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H1       ARG   1  -5.679  -1.703   5.746
    2    H2   ARG   1           H2       ARG   1  -6.372  -0.164   5.818
    3    H3   ARG   1           H3       ARG   1  -6.071  -0.887   4.317
    4    HA   ARG   1           HA       ARG   1  -7.689  -2.617   4.801
    5    HB2  ARG   1           HB3      ARG   1  -8.347  -0.952   7.237
    6    HB3  ARG   1           HB2      ARG   1  -9.107  -2.458   6.749
    7    HG2  ARG   1           HG3      ARG   1  -7.111  -3.689   7.240
    8    HG3  ARG   1           HG2      ARG   1  -6.224  -2.196   7.563
    9    HD2  ARG   1           HD3      ARG   1  -8.579  -3.249   9.124
   10    HD3  ARG   1           HD2      ARG   1  -6.895  -3.260   9.645
   11    HE   ARG   1           HE       ARG   1  -7.935  -0.646   8.997
   12   HH11  ARG   1          HH12      ARG   1  -7.501  -3.038  11.505
   13   HH12  ARG   1          HH11      ARG   1  -7.583  -1.887  12.797
   14   HH21  ARG   1          HH21      ARG   1  -8.060   0.879  10.690
   15   HH22  ARG   1          HH22      ARG   1  -7.898   0.346  12.333
   16    H    LYS   2           H        LYS   2  -9.192  -2.198   3.354
   17    HA   LYS   2           HA       LYS   2 -11.191  -0.279   3.511
   18    HB2  LYS   2           HB3      LYS   2  -8.726   0.775   2.418
   19    HB3  LYS   2           HB2      LYS   2  -9.985   0.783   1.199
   20    HG2  LYS   2           HG3      LYS   2 -11.425   1.917   3.027
   21    HG3  LYS   2           HG2      LYS   2  -9.873   2.237   3.810
   22    HD2  LYS   2           HD3      LYS   2 -10.416   4.144   2.480
   23    HD3  LYS   2           HD2      LYS   2  -9.108   3.284   1.667
   24    HE2  LYS   2           HE3      LYS   2 -10.814   2.193   0.216
   25    HE3  LYS   2           HE2      LYS   2 -12.041   3.207   0.970
   26    HZ1  LYS   2           HZ1      LYS   2  -9.708   4.158  -0.598
   27    HZ2  LYS   2           HZ2      LYS   2 -10.842   5.157   0.166
   28    HZ3  LYS   2           HZ3      LYS   2 -11.320   4.152  -1.107
   29    H    CYS   3           H        CYS   3  -9.033  -2.001   1.344
   30    HA   CYS   3           HA       CYS   3 -11.313  -2.850  -0.279
   31    HB2  CYS   3           HB3      CYS   3  -9.534  -2.376  -2.229
   32    HB3  CYS   3           HB2      CYS   3 -10.671  -1.149  -1.669
   33    H    ASN   4           H        ASN   4  -7.816  -3.107  -0.807
   34    HA   ASN   4           HA       ASN   4  -7.548  -5.780   0.075
   35    HB2  ASN   4           HB3      ASN   4  -7.365  -6.918  -2.086
   36    HB3  ASN   4           HB2      ASN   4  -8.976  -6.244  -1.886
   37   HD21  ASN   4          HD22      ASN   4  -7.545  -6.990  -4.309
   38   HD22  ASN   4          HD21      ASN   4  -7.493  -5.566  -5.291
   39    H    PHE   5           H        PHE   5  -5.539  -6.720  -1.462
   40    HA   PHE   5           HA       PHE   5  -3.306  -5.186  -0.769
   41    HB2  PHE   5           HB3      PHE   5  -2.121  -6.722  -2.464
   42    HB3  PHE   5           HB2      PHE   5  -2.894  -7.472  -1.075
   43    HD1  PHE   5           HD2      PHE   5  -3.460  -6.670  -4.668
   44    HD2  PHE   5           HD1      PHE   5  -4.434  -9.177  -1.371
   45    HE1  PHE   5           HE2      PHE   5  -4.737  -8.139  -6.169
   46    HE2  PHE   5           HE1      PHE   5  -5.716 -10.649  -2.867
   47    HZ   PHE   5           HZ       PHE   5  -5.867 -10.132  -5.269
   48    H    LEU   6           H        LEU   6  -1.739  -4.130  -2.160
   49    HA   LEU   6           HA       LEU   6  -1.241  -2.402  -3.538
   50    HB2  LEU   6           HB3      LEU   6  -2.833  -4.154  -5.415
   51    HB3  LEU   6           HB2      LEU   6  -1.945  -2.742  -5.943
   52    HG   LEU   6           HG       LEU   6  -0.664  -4.719  -6.447
   53   HD11  LEU   6          HD11      LEU   6   0.619  -3.422  -4.058
   54   HD12  LEU   6          HD12      LEU   6   0.516  -2.677  -5.656
   55   HD13  LEU   6          HD13      LEU   6   1.409  -4.180  -5.441
   56   HD21  LEU   6          HD21      LEU   6  -1.607  -6.245  -4.792
   57   HD22  LEU   6          HD22      LEU   6  -0.772  -5.371  -3.506
   58   HD23  LEU   6          HD23      LEU   6   0.153  -6.240  -4.733
   59    H    CYS   7           H        CYS   7  -3.028  -1.498  -1.895
   60    HA   CYS   7           HA       CYS   7  -4.679   0.326  -3.289
   61    HB2  CYS   7           HB3      CYS   7  -6.008  -1.740  -3.667
   62    HB3  CYS   7           HB2      CYS   7  -6.140  -1.952  -1.927
   63    H    LYS   8           H        LYS   8  -4.612  -1.535  -0.240
   64    HA   LYS   8           HA       LYS   8  -3.603   0.658   1.243
   65    HB2  LYS   8           HB3      LYS   8  -6.086   1.251   1.030
   66    HB3  LYS   8           HB2      LYS   8  -6.407  -0.153   2.039
   67    HG2  LYS   8           HG3      LYS   8  -4.994   0.825   3.809
   68    HG3  LYS   8           HG2      LYS   8  -4.755   2.252   2.801
   69    HD2  LYS   8           HD3      LYS   8  -7.178   2.662   2.837
   70    HD3  LYS   8           HD2      LYS   8  -7.390   1.249   3.873
   71    HE2  LYS   8           HE3      LYS   8  -5.908   2.318   5.549
   72    HE3  LYS   8           HE2      LYS   8  -5.852   3.753   4.531
   73    HZ1  LYS   8           HZ1      LYS   8  -8.195   4.057   4.809
   74    HZ2  LYS   8           HZ2      LYS   8  -7.488   3.907   6.337
   75    HZ3  LYS   8           HZ3      LYS   8  -8.340   2.608   5.671
   76    H    LEU   9           H        LEU   9  -2.962  -2.022   0.673
   77    HA   LEU   9           HA       LEU   9  -2.814  -3.131   3.368
   78    HB2  LEU   9           HB3      LEU   9  -4.013  -4.542   1.010
   79    HB3  LEU   9           HB2      LEU   9  -3.124  -5.467   2.201
   80    HG   LEU   9           HG       LEU   9  -4.738  -4.439   3.927
   81   HD11  LEU   9          HD11      LEU   9  -6.314  -3.932   1.410
   82   HD12  LEU   9          HD12      LEU   9  -5.694  -2.706   2.517
   83   HD13  LEU   9          HD13      LEU   9  -6.936  -3.835   3.056
   84   HD21  LEU   9          HD21      LEU   9  -6.387  -6.181   3.501
   85   HD22  LEU   9          HD22      LEU   9  -4.747  -6.781   3.256
   86   HD23  LEU   9          HD23      LEU   9  -5.758  -6.385   1.866
   87    H    LYS  10           H        LYS  10  -2.003  -5.000   0.535
   88    HA   LYS  10           HA       LYS  10   0.830  -4.673   1.113
   89    HB2  LYS  10           HB3      LYS  10  -0.314  -6.914   0.545
   90    HB3  LYS  10           HB2      LYS  10  -0.332  -6.337  -1.115
   91    HG2  LYS  10           HG3      LYS  10   2.065  -6.208  -1.158
   92    HG3  LYS  10           HG2      LYS  10   2.156  -6.601   0.559
   93    HD2  LYS  10           HD3      LYS  10   2.657  -8.595  -0.622
   94    HD3  LYS  10           HD2      LYS  10   1.020  -8.779   0.007
   95    HE2  LYS  10           HE3      LYS  10   0.973  -9.572  -2.222
   96    HE3  LYS  10           HE2      LYS  10   0.193  -7.991  -2.242
   97    HZ1  LYS  10           HZ1      LYS  10   3.020  -8.503  -2.992
   98    HZ2  LYS  10           HZ2      LYS  10   2.214  -7.020  -3.086
   99    HZ3  LYS  10           HZ3      LYS  10   1.750  -8.299  -4.085
  100    H    GLU  11           H        GLU  11   1.171  -2.607   0.499
  101    HA   GLU  11           HA       GLU  11  -0.007  -1.348  -1.721
  102    HB2  GLU  11           HB3      GLU  11   2.375  -0.343  -0.188
  103    HB3  GLU  11           HB2      GLU  11   1.124   0.597  -0.991
  104    HG2  GLU  11           HG3      GLU  11   0.708  -1.143   1.422
  105    HG3  GLU  11           HG2      GLU  11   0.908   0.604   1.449
  106    H    LYS  12           H        LYS  12   1.840   0.288  -2.766
  107    HA   LYS  12           HA       LYS  12   3.704  -1.413  -4.227
  108    HB2  LYS  12           HB3      LYS  12   2.601   0.125  -6.249
  109    HB3  LYS  12           HB2      LYS  12   2.287  -1.578  -5.953
  110    HG2  LYS  12           HG3      LYS  12   0.161  -0.692  -6.131
  111    HG3  LYS  12           HG2      LYS  12   0.411  -0.754  -4.392
  112    HD2  LYS  12           HD3      LYS  12  -0.624   1.327  -4.917
  113    HD3  LYS  12           HD2      LYS  12   1.047   1.673  -4.480
  114    HE2  LYS  12           HE3      LYS  12   0.519   2.978  -6.409
  115    HE3  LYS  12           HE2      LYS  12   1.575   1.674  -6.935
  116    HZ1  LYS  12           HZ1      LYS  12  -0.225   1.944  -8.478
  117    HZ2  LYS  12           HZ2      LYS  12  -1.369   1.768  -7.244
  118    HZ3  LYS  12           HZ3      LYS  12  -0.395   0.461  -7.685
  119    H    LEU  13           H        LEU  13   2.545   1.814  -5.033
  120    HA   LEU  13           HA       LEU  13   4.458   3.227  -3.537
  121    HB2  LEU  13           HB3      LEU  13   5.902   4.113  -5.230
  122    HB3  LEU  13           HB2      LEU  13   6.006   2.374  -5.252
  123    HG   LEU  13           HG       LEU  13   6.152   2.982  -7.480
  124   HD11  LEU  13          HD11      LEU  13   3.239   2.395  -7.106
  125   HD12  LEU  13          HD12      LEU  13   4.535   1.209  -7.228
  126   HD13  LEU  13          HD13      LEU  13   4.143   2.235  -8.609
  127   HD21  LEU  13          HD21      LEU  13   4.726   4.602  -8.616
  128   HD22  LEU  13          HD22      LEU  13   5.605   5.323  -7.267
  129   HD23  LEU  13          HD23      LEU  13   3.894   4.931  -7.095
  130    H    ARG  14           H        ARG  14   3.385   5.028  -3.001
  131    HA   ARG  14           HA       ARG  14   2.056   6.568  -5.014
  132    HB2  ARG  14           HB3      ARG  14   0.460   4.652  -4.365
  133    HB3  ARG  14           HB2      ARG  14   0.238   5.529  -2.861
  134    HG2  ARG  14           HG3      ARG  14  -1.520   5.982  -4.536
  135    HG3  ARG  14           HG2      ARG  14  -0.648   7.429  -4.032
  136    HD2  ARG  14           HD3      ARG  14   0.200   5.919  -6.473
  137    HD3  ARG  14           HD2      ARG  14  -1.146   7.055  -6.548
  138    HE   ARG  14           HE       ARG  14   0.547   8.694  -5.568
  139   HH11  ARG  14          HH11      ARG  14   1.423   6.083  -7.738
  140   HH12  ARG  14          HH12      ARG  14   2.807   6.916  -8.370
  141   HH21  ARG  14          HH22      ARG  14   2.354   9.777  -6.390
  142   HH22  ARG  14          HH21      ARG  14   3.341   9.018  -7.598
  143    H    THR  15           H        THR  15   0.912   6.536  -1.660
  144    HA   THR  15           HA       THR  15   2.629   8.744  -0.985
  145    HB   THR  15           HB       THR  15   1.139  10.022  -2.245
  146    HG1  THR  15           HG1      THR  15   1.622  10.862  -0.125
  147   HG21  THR  15          HG21      THR  15  -1.240   8.973  -0.747
  148   HG22  THR  15          HG22      THR  15  -0.704   8.313  -2.292
  149   HG23  THR  15          HG23      THR  15  -1.218   9.993  -2.182
  150    H    VAL  16           H        VAL  16  -0.651   7.867   0.233
  151    HA   VAL  16           HA       VAL  16   0.631   7.101   2.749
  152    HB   VAL  16           HB       VAL  16  -1.589   9.139   2.564
  153   HG11  VAL  16          HG11      VAL  16  -0.543   7.514   4.839
  154   HG12  VAL  16          HG12      VAL  16  -2.210   7.920   4.422
  155   HG13  VAL  16          HG13      VAL  16  -1.155   9.144   5.132
  156   HG21  VAL  16          HG21      VAL  16  -0.013  10.611   3.731
  157   HG22  VAL  16          HG22      VAL  16   0.626  10.083   2.174
  158   HG23  VAL  16          HG23      VAL  16   1.213   9.346   3.666
  159    H    ILE  17           H        ILE  17  -2.625   7.471   1.268
  160    HA   ILE  17           HA       ILE  17  -3.706   5.403   2.870
  161    HB   ILE  17           HB       ILE  17  -5.073   7.204   1.855
  162   HG12  ILE  17          HG13      ILE  17  -6.052   5.001   2.645
  163   HG13  ILE  17          HG12      ILE  17  -7.043   5.940   1.543
  164   HG21  ILE  17          HG21      ILE  17  -4.694   5.709  -0.723
  165   HG22  ILE  17          HG22      ILE  17  -4.092   7.321  -0.336
  166   HG23  ILE  17          HG23      ILE  17  -5.826   7.035  -0.460
  167   HD11  ILE  17          HD11      ILE  17  -7.290   3.769   0.794
  168   HD12  ILE  17          HD12      ILE  17  -5.590   3.373   1.060
  169   HD13  ILE  17          HD13      ILE  17  -6.056   4.420  -0.285
  170    H    THR  18           H        THR  18  -2.599   5.422  -0.529
  171    HA   THR  18           HA       THR  18  -2.798   2.528  -0.628
  172    HB   THR  18           HB       THR  18  -1.714   4.347  -2.773
  173    HG1  THR  18           HG1      THR  18  -4.390   3.828  -1.972
  174   HG21  THR  18          HG21      THR  18  -1.426   1.949  -3.128
  175   HG22  THR  18          HG22      THR  18  -2.604   2.621  -4.248
  176   HG23  THR  18          HG23      THR  18  -3.151   1.692  -2.857
  177    H    SER  19           H        SER  19  -0.654   4.737   0.501
  178    HA   SER  19           HA       SER  19   1.545   2.790   0.298
  179    HB2  SER  19           HB3      SER  19   2.260   4.873  -0.629
  180    HB3  SER  19           HB2      SER  19   1.534   5.787   0.687
  181    HG   SER  19           HG       SER  19   3.119   4.592   2.050
  182    H    HIS  20           H        HIS  20  -0.418   2.118   2.026
  183    HA   HIS  20           HA       HIS  20   0.039   3.419   4.582
  184    HB2  HIS  20           HB3      HIS  20  -2.221   2.507   3.406
  185    HB3  HIS  20           HB2      HIS  20  -1.832   1.147   4.459
  186    HD1  HIS  20           HD1      HIS  20  -2.877   1.345   6.693
  187    HD2  HIS  20           HD2      HIS  20  -2.070   5.064   5.027
  188    HE1  HIS  20           HE1      HIS  20  -3.718   3.031   8.359
  189    HE2  HIS  20           HE2      HIS  20  -3.047   5.264   7.408
  190    H    ILE  21           H        ILE  21  -0.107  -0.023   3.541
  191    HA   ILE  21           HA       ILE  21   1.506  -0.638   5.931
  192    HB   ILE  21           HB       ILE  21  -0.166  -2.517   4.256
  193   HG12  ILE  21          HG13      ILE  21  -1.546  -0.919   5.500
  194   HG13  ILE  21          HG12      ILE  21  -1.704  -2.537   6.171
  195   HG21  ILE  21          HG21      ILE  21   0.199  -4.127   6.063
  196   HG22  ILE  21          HG22      ILE  21   1.254  -2.972   6.878
  197   HG23  ILE  21          HG23      ILE  21   1.720  -3.640   5.314
  198   HD11  ILE  21          HD11      ILE  21  -1.580  -0.908   7.941
  199   HD12  ILE  21          HD12      ILE  21  -0.058  -0.288   7.302
  200   HD13  ILE  21          HD13      ILE  21  -0.137  -1.921   7.959
  201    H    ASP  22           H        ASP  22   1.091  -2.127   2.738
  202    HA   ASP  22           HA       ASP  22   2.566  -2.754   1.122
  203    HB2  ASP  22           HB3      ASP  22   3.875  -0.716   1.456
  204    HB3  ASP  22           HB2      ASP  22   4.712  -1.459   2.805
  205    H    LYS  23           H        LYS  23   4.257  -4.340   0.727
  206    HA   LYS  23           HA       LYS  23   4.219  -6.591   2.340
  207    HB2  LYS  23           HB3      LYS  23   6.180  -7.329   1.080
  208    HB3  LYS  23           HB2      LYS  23   5.010  -6.576   0.010
  209    HG2  LYS  23           HG3      LYS  23   6.514  -4.441   0.511
  210    HG3  LYS  23           HG2      LYS  23   7.727  -5.689   0.787
  211    HD2  LYS  23           HD3      LYS  23   7.924  -5.117  -1.491
  212    HD3  LYS  23           HD2      LYS  23   7.033  -6.641  -1.472
  213    HE2  LYS  23           HE3      LYS  23   4.926  -5.397  -1.678
  214    HE3  LYS  23           HE2      LYS  23   5.831  -3.885  -1.728
  215    HZ1  LYS  23           HZ1      LYS  23   6.009  -6.085  -3.716
  216    HZ2  LYS  23           HZ2      LYS  23   6.900  -4.646  -3.763
  217    HZ3  LYS  23           HZ3      LYS  23   5.219  -4.606  -3.935
  218    H    VAL  24           H        VAL  24   6.386  -3.791   2.357
  219    HA   VAL  24           HA       VAL  24   6.806  -3.237   4.855
  220    HB   VAL  24           HB       VAL  24   7.262  -5.672   5.378
  221   HG11  VAL  24          HG11      VAL  24   9.877  -5.081   4.008
  222   HG12  VAL  24          HG12      VAL  24   8.673  -6.281   3.536
  223   HG13  VAL  24          HG13      VAL  24   9.569  -6.477   5.042
  224   HG21  VAL  24          HG21      VAL  24   7.804  -3.935   6.963
  225   HG22  VAL  24          HG22      VAL  24   9.346  -3.642   6.160
  226   HG23  VAL  24          HG23      VAL  24   9.059  -5.174   6.984
  227    H    LEU  25           H        LEU  25   8.327  -3.852   1.834
  228    HA   LEU  25           HA       LEU  25  10.829  -2.595   2.502
  229    HB2  LEU  25           HB3      LEU  25   9.721  -3.653  -0.083
  230    HB3  LEU  25           HB2      LEU  25  11.254  -2.811   0.002
  231    HG   LEU  25           HG       LEU  25  11.843  -4.625   1.793
  232   HD11  LEU  25          HD11      LEU  25   9.582  -5.573   1.904
  233   HD12  LEU  25          HD12      LEU  25  10.789  -6.764   1.421
  234   HD13  LEU  25          HD13      LEU  25   9.716  -6.056   0.213
  235   HD21  LEU  25          HD21      LEU  25  12.715  -6.067   0.013
  236   HD22  LEU  25          HD22      LEU  25  12.985  -4.359  -0.331
  237   HD23  LEU  25          HD23      LEU  25  11.694  -5.231  -1.156
  238    H    ARG  26           H        ARG  26   8.005  -1.684   0.498
  239    HA   ARG  26           HA       ARG  26   8.771   1.078   0.660
  240    HB2  ARG  26           HB3      ARG  26   8.883   1.259  -1.919
  241    HB3  ARG  26           HB2      ARG  26  10.302   0.717  -1.039
  242    HG2  ARG  26           HG3      ARG  26  10.348  -0.917  -2.566
  243    HG3  ARG  26           HG2      ARG  26   9.091  -1.653  -1.574
  244    HD2  ARG  26           HD3      ARG  26   8.376  -1.693  -3.859
  245    HD3  ARG  26           HD2      ARG  26   7.396  -0.510  -2.993
  246    HE   ARG  26           HE       ARG  26   9.464   0.943  -4.052
  247   HH11  ARG  26          HH11      ARG  26   6.969  -1.152  -5.330
  248   HH12  ARG  26          HH12      ARG  26   6.918  -0.363  -6.873
  249   HH21  ARG  26          HH22      ARG  26   9.390   1.991  -6.085
  250   HH22  ARG  26          HH21      ARG  26   8.293   1.425  -7.302
  251    HA   PRO  27           HA       PRO  27   4.277   0.712   0.034
  252    HB2  PRO  27           HB2      PRO  27   4.151   2.996   1.839
  253    HB3  PRO  27           HB3      PRO  27   3.462   1.374   2.043
  254    HG2  PRO  27           HG3      PRO  27   5.538   2.313   3.533
  255    HG3  PRO  27           HG2      PRO  27   5.308   0.597   3.154
  256    HD2  PRO  27           HD3      PRO  27   7.160   2.586   1.899
  257    HD3  PRO  27           HD2      PRO  27   7.448   0.881   2.309
  258    H    GLN  28           H        GLN  28   6.250   3.661   0.288
  259    HA   GLN  28           HA       GLN  28   4.442   5.043  -1.536
  260    HB2  GLN  28           HB3      GLN  28   5.433   6.087   0.596
  261    HB3  GLN  28           HB2      GLN  28   6.937   6.200  -0.308
  262    HG2  GLN  28           HG3      GLN  28   5.791   7.546  -2.011
  263    HG3  GLN  28           HG2      GLN  28   4.314   7.467  -1.056
  264   HE21  GLN  28          HE22      GLN  28   4.195   8.592   0.891
  265   HE22  GLN  28          HE21      GLN  28   5.286   9.881   1.266
  266    H    GLY  29           H        GLY  29   7.143   3.126  -1.675
  267    HA2  GLY  29           HA3      GLY  29   7.764   2.545  -4.003
  268    HA3  GLY  29           HA2      GLY  29   7.920   4.274  -4.276
  Start of MODEL    2
    1    H1   ARG   1           H1       ARG   1 -10.645   3.000   3.509
    2    H2   ARG   1           H2       ARG   1 -10.566   1.335   3.768
    3    H3   ARG   1           H3       ARG   1 -11.574   2.287   4.727
    4    HA   ARG   1           HA       ARG   1 -12.861   1.086   3.111
    5    HB2  ARG   1           HB3      ARG   1 -12.646   4.058   2.602
    6    HB3  ARG   1           HB2      ARG   1 -13.978   3.050   2.050
    7    HG2  ARG   1           HG3      ARG   1 -14.603   2.549   4.320
    8    HG3  ARG   1           HG2      ARG   1 -13.195   3.420   4.934
    9    HD2  ARG   1           HD3      ARG   1 -15.191   4.785   5.131
   10    HD3  ARG   1           HD2      ARG   1 -14.072   5.494   3.971
   11    HE   ARG   1           HE       ARG   1 -16.187   3.803   2.897
   12   HH11  ARG   1          HH12      ARG   1 -15.013   7.033   3.553
   13   HH12  ARG   1          HH11      ARG   1 -16.083   7.792   2.419
   14   HH21  ARG   1          HH21      ARG   1 -17.604   4.797   1.413
   15   HH22  ARG   1          HH22      ARG   1 -17.555   6.517   1.196
   16    H    LYS   2           H        LYS   2 -10.245   0.622   2.103
   17    HA   LYS   2           HA       LYS   2 -10.825   0.874  -0.762
   18    HB2  LYS   2           HB3      LYS   2  -8.112   1.270   0.512
   19    HB3  LYS   2           HB2      LYS   2  -8.381   1.096  -1.215
   20    HG2  LYS   2           HG3      LYS   2 -10.063   3.124  -0.687
   21    HG3  LYS   2           HG2      LYS   2  -8.835   3.392   0.557
   22    HD2  LYS   2           HD3      LYS   2  -7.091   3.438  -1.120
   23    HD3  LYS   2           HD2      LYS   2  -8.258   3.051  -2.385
   24    HE2  LYS   2           HE3      LYS   2  -7.723   5.431  -2.375
   25    HE3  LYS   2           HE2      LYS   2  -9.416   5.153  -1.974
   26    HZ1  LYS   2           HZ1      LYS   2  -8.471   6.809  -0.526
   27    HZ2  LYS   2           HZ2      LYS   2  -7.241   5.753  -0.048
   28    HZ3  LYS   2           HZ3      LYS   2  -8.845   5.426   0.373
   29    H    CYS   3           H        CYS   3  -8.601  -0.539  -1.661
   30    HA   CYS   3           HA       CYS   3  -9.447  -3.220  -1.094
   31    HB2  CYS   3           HB3      CYS   3  -7.147  -3.245  -2.724
   32    HB3  CYS   3           HB2      CYS   3  -8.824  -3.428  -3.229
   33    H    ASN   4           H        ASN   4  -7.217  -4.747  -1.307
   34    HA   ASN   4           HA       ASN   4  -5.770  -4.131   1.177
   35    HB2  ASN   4           HB3      ASN   4  -6.393  -6.746  -0.192
   36    HB3  ASN   4           HB2      ASN   4  -5.209  -6.615   1.104
   37   HD21  ASN   4          HD22      ASN   4  -7.833  -7.997   0.887
   38   HD22  ASN   4          HD21      ASN   4  -8.729  -7.459   2.264
   39    H    PHE   5           H        PHE   5  -4.568  -6.536  -0.999
   40    HA   PHE   5           HA       PHE   5  -2.011  -5.331  -0.877
   41    HB2  PHE   5           HB3      PHE   5  -1.340  -7.156  -2.459
   42    HB3  PHE   5           HB2      PHE   5  -2.088  -7.697  -0.968
   43    HD1  PHE   5           HD2      PHE   5  -2.827  -7.059  -4.554
   44    HD2  PHE   5           HD1      PHE   5  -3.927  -9.108  -0.995
   45    HE1  PHE   5           HE2      PHE   5  -4.458  -8.382  -5.829
   46    HE2  PHE   5           HE1      PHE   5  -5.562 -10.436  -2.263
   47    HZ   PHE   5           HZ       PHE   5  -5.830 -10.074  -4.684
   48    H    LEU   6           H        LEU   6  -0.811  -4.310  -2.360
   49    HA   LEU   6           HA       LEU   6  -0.389  -2.728  -3.925
   50    HB2  LEU   6           HB3      LEU   6  -2.323  -4.395  -5.539
   51    HB3  LEU   6           HB2      LEU   6  -1.435  -3.040  -6.196
   52    HG   LEU   6           HG       LEU   6  -0.266  -4.928  -6.910
   53   HD11  LEU   6          HD11      LEU   6   1.189  -4.028  -4.426
   54   HD12  LEU   6          HD12      LEU   6   1.193  -3.206  -5.986
   55   HD13  LEU   6          HD13      LEU   6   1.892  -4.814  -5.844
   56   HD21  LEU   6          HD21      LEU   6  -1.300  -6.612  -5.558
   57   HD22  LEU   6          HD22      LEU   6  -0.485  -6.014  -4.110
   58   HD23  LEU   6          HD23      LEU   6   0.449  -6.750  -5.415
   59    H    CYS   7           H        CYS   7  -2.130  -1.900  -1.996
   60    HA   CYS   7           HA       CYS   7  -3.633   0.156  -3.302
   61    HB2  CYS   7           HB3      CYS   7  -5.118  -1.811  -3.699
   62    HB3  CYS   7           HB2      CYS   7  -5.250  -2.024  -1.959
   63    H    LYS   8           H        LYS   8  -3.331  -1.803  -0.424
   64    HA   LYS   8           HA       LYS   8  -2.817   0.546   1.224
   65    HB2  LYS   8           HB3      LYS   8  -5.198   0.282   1.507
   66    HB3  LYS   8           HB2      LYS   8  -5.035  -1.452   1.723
   67    HG2  LYS   8           HG3      LYS   8  -4.333  -1.256   3.893
   68    HG3  LYS   8           HG2      LYS   8  -3.683   0.368   3.650
   69    HD2  LYS   8           HD3      LYS   8  -5.816   0.158   5.039
   70    HD3  LYS   8           HD2      LYS   8  -5.809   1.358   3.750
   71    HE2  LYS   8           HE3      LYS   8  -7.914   0.138   3.792
   72    HE3  LYS   8           HE2      LYS   8  -7.034  -0.188   2.302
   73    HZ1  LYS   8           HZ1      LYS   8  -7.199  -1.967   4.675
   74    HZ2  LYS   8           HZ2      LYS   8  -6.284  -2.285   3.291
   75    HZ3  LYS   8           HZ3      LYS   8  -7.968  -2.208   3.189
   76    H    LEU   9           H        LEU   9  -2.997  -2.887   0.748
   77    HA   LEU   9           HA       LEU   9  -0.551  -3.255   2.314
   78    HB2  LEU   9           HB3      LEU   9  -2.457  -5.201   1.019
   79    HB3  LEU   9           HB2      LEU   9  -0.934  -5.692   1.728
   80    HG   LEU   9           HG       LEU   9  -1.838  -4.641   3.905
   81   HD11  LEU   9          HD11      LEU   9  -4.307  -4.739   4.071
   82   HD12  LEU   9          HD12      LEU   9  -4.370  -4.941   2.320
   83   HD13  LEU   9          HD13      LEU   9  -3.721  -3.456   3.010
   84   HD21  LEU   9          HD21      LEU   9  -2.982  -6.723   4.481
   85   HD22  LEU   9          HD22      LEU   9  -1.502  -7.029   3.573
   86   HD23  LEU   9          HD23      LEU   9  -3.070  -7.150   2.772
   87    H    LYS  10           H        LYS  10   0.261  -5.483   0.659
   88    HA   LYS  10           HA       LYS  10   2.297  -5.510  -0.403
   89    HB2  LYS  10           HB3      LYS  10   0.363  -6.260  -1.899
   90    HB3  LYS  10           HB2      LYS  10   0.654  -4.772  -2.779
   91    HG2  LYS  10           HG3      LYS  10   1.856  -6.483  -3.887
   92    HG3  LYS  10           HG2      LYS  10   3.028  -5.474  -3.040
   93    HD2  LYS  10           HD3      LYS  10   3.654  -7.752  -2.700
   94    HD3  LYS  10           HD2      LYS  10   3.004  -7.141  -1.180
   95    HE2  LYS  10           HE3      LYS  10   2.068  -9.284  -1.452
   96    HE3  LYS  10           HE2      LYS  10   0.789  -8.147  -1.881
   97    HZ1  LYS  10           HZ1      LYS  10   1.298  -8.514  -4.214
   98    HZ2  LYS  10           HZ2      LYS  10   0.915  -9.973  -3.450
   99    HZ3  LYS  10           HZ3      LYS  10   2.525  -9.598  -3.803
  100    H    GLU  11           H        GLU  11   0.741  -2.834  -2.196
  101    HA   GLU  11           HA       GLU  11   1.357  -0.621  -2.340
  102    HB2  GLU  11           HB3      GLU  11   2.993  -1.240  -0.323
  103    HB3  GLU  11           HB2      GLU  11   4.202  -1.104  -1.585
  104    HG2  GLU  11           HG3      GLU  11   2.257   1.049  -0.803
  105    HG3  GLU  11           HG2      GLU  11   3.934   0.942  -0.276
  106    H    LYS  12           H        LYS  12   2.366   0.573  -4.050
  107    HA   LYS  12           HA       LYS  12   3.954  -0.951  -5.956
  108    HB2  LYS  12           HB3      LYS  12   2.437  -0.776  -7.782
  109    HB3  LYS  12           HB2      LYS  12   1.543  -1.462  -6.442
  110    HG2  LYS  12           HG3      LYS  12   1.416   1.471  -6.803
  111    HG3  LYS  12           HG2      LYS  12   0.579   0.464  -7.980
  112    HD2  LYS  12           HD3      LYS  12  -0.503  -0.685  -5.970
  113    HD3  LYS  12           HD2      LYS  12   0.106   0.682  -5.017
  114    HE2  LYS  12           HE3      LYS  12  -1.140   2.240  -6.291
  115    HE3  LYS  12           HE2      LYS  12  -1.512   1.042  -7.527
  116    HZ1  LYS  12           HZ1      LYS  12  -2.584   1.154  -4.764
  117    HZ2  LYS  12           HZ2      LYS  12  -2.832  -0.151  -5.817
  118    HZ3  LYS  12           HZ3      LYS  12  -3.434   1.382  -6.203
  119    H    LEU  13           H        LEU  13   4.513   1.371  -4.386
  120    HA   LEU  13           HA       LEU  13   5.460   3.414  -4.523
  121    HB2  LEU  13           HB3      LEU  13   6.677   2.470  -6.462
  122    HB3  LEU  13           HB2      LEU  13   5.383   3.000  -7.517
  123    HG   LEU  13           HG       LEU  13   5.883   5.347  -6.937
  124   HD11  LEU  13          HD11      LEU  13   6.799   5.054  -4.725
  125   HD12  LEU  13          HD12      LEU  13   7.982   5.860  -5.757
  126   HD13  LEU  13          HD13      LEU  13   8.164   4.147  -5.377
  127   HD21  LEU  13          HD21      LEU  13   8.238   3.762  -7.949
  128   HD22  LEU  13          HD22      LEU  13   8.001   5.496  -8.159
  129   HD23  LEU  13          HD23      LEU  13   6.889   4.356  -8.913
  130    H    ARG  14           H        ARG  14   2.938   3.466  -3.935
  131    HA   ARG  14           HA       ARG  14   1.699   5.505  -5.666
  132    HB2  ARG  14           HB3      ARG  14   0.458   3.350  -5.232
  133    HB3  ARG  14           HB2      ARG  14   0.338   3.840  -3.549
  134    HG2  ARG  14           HG3      ARG  14  -1.710   4.348  -4.742
  135    HG3  ARG  14           HG2      ARG  14  -0.915   5.833  -4.215
  136    HD2  ARG  14           HD3      ARG  14  -0.014   6.171  -6.440
  137    HD3  ARG  14           HD2      ARG  14  -0.709   4.644  -6.979
  138    HE   ARG  14           HE       ARG  14  -2.857   6.047  -6.092
  139   HH11  ARG  14          HH11      ARG  14  -0.270   6.740  -8.338
  140   HH12  ARG  14          HH12      ARG  14  -1.235   7.766  -9.347
  141   HH21  ARG  14          HH22      ARG  14  -4.154   7.388  -7.433
  142   HH22  ARG  14          HH21      ARG  14  -3.452   8.120  -8.841
  143    H    THR  15           H        THR  15   3.027   4.916  -2.514
  144    HA   THR  15           HA       THR  15   3.349   6.185  -0.717
  145    HB   THR  15           HB       THR  15   4.036   8.475  -1.178
  146    HG1  THR  15           HG1      THR  15   2.448   8.299  -3.264
  147   HG21  THR  15          HG21      THR  15   5.911   7.934  -2.651
  148   HG22  THR  15          HG22      THR  15   5.074   6.468  -3.162
  149   HG23  THR  15          HG23      THR  15   5.607   6.642  -1.491
  150    H    VAL  16           H        VAL  16   1.327   5.770   0.175
  151    HA   VAL  16           HA       VAL  16  -0.077   7.944   1.162
  152    HB   VAL  16           HB       VAL  16  -0.895   8.050  -1.236
  153   HG11  VAL  16          HG11      VAL  16  -2.422   5.558  -0.531
  154   HG12  VAL  16          HG12      VAL  16  -1.087   5.666  -1.679
  155   HG13  VAL  16          HG13      VAL  16  -2.599   6.518  -2.001
  156   HG21  VAL  16          HG21      VAL  16  -2.902   7.746   0.982
  157   HG22  VAL  16          HG22      VAL  16  -3.294   8.379  -0.615
  158   HG23  VAL  16          HG23      VAL  16  -2.129   9.218   0.406
  159    H    ILE  17           H        ILE  17  -2.689   6.218   1.248
  160    HA   ILE  17           HA       ILE  17  -1.938   4.615   3.461
  161    HB   ILE  17           HB       ILE  17  -4.177   3.688   3.430
  162   HG12  ILE  17          HG13      ILE  17  -5.067   5.273   1.099
  163   HG13  ILE  17          HG12      ILE  17  -4.077   3.867   0.726
  164   HG21  ILE  17          HG21      ILE  17  -5.460   5.763   3.640
  165   HG22  ILE  17          HG22      ILE  17  -4.166   6.641   2.825
  166   HG23  ILE  17          HG23      ILE  17  -3.872   5.895   4.397
  167   HD11  ILE  17          HD11      ILE  17  -6.561   3.803   2.407
  168   HD12  ILE  17          HD12      ILE  17  -5.608   2.423   1.864
  169   HD13  ILE  17          HD13      ILE  17  -6.490   3.404   0.692
  170    H    THR  18           H        THR  18  -1.739   4.129   0.123
  171    HA   THR  18           HA       THR  18  -1.861   1.351  -0.109
  172    HB   THR  18           HB       THR  18  -0.065   3.280  -1.591
  173    HG1  THR  18           HG1      THR  18  -2.813   2.653  -1.760
  174   HG21  THR  18          HG21      THR  18   0.528   0.980  -2.015
  175   HG22  THR  18          HG22      THR  18  -0.294   1.649  -3.417
  176   HG23  THR  18          HG23      THR  18  -1.156   0.564  -2.329
  177    H    SER  19           H        SER  19   0.894   3.507   0.386
  178    HA   SER  19           HA       SER  19   2.602   1.372   1.280
  179    HB2  SER  19           HB3      SER  19   4.109   3.443   1.759
  180    HB3  SER  19           HB2      SER  19   3.731   3.038   0.083
  181    HG   SER  19           HG       SER  19   2.776   5.147   1.671
  182    H    HIS  20           H        HIS  20   0.280   1.560   2.877
  183    HA   HIS  20           HA       HIS  20   1.202   2.843   5.353
  184    HB2  HIS  20           HB3      HIS  20  -1.166   3.187   4.523
  185    HB3  HIS  20           HB2      HIS  20  -1.454   1.484   4.858
  186    HD1  HIS  20           HD1      HIS  20  -2.448   1.054   7.081
  187    HD2  HIS  20           HD2      HIS  20  -0.238   4.570   7.032
  188    HE1  HIS  20           HE1      HIS  20  -2.737   2.064   9.363
  189    HE2  HIS  20           HE2      HIS  20  -1.286   4.121   9.352
  190    H    ILE  21           H        ILE  21  -0.279  -0.237   4.353
  191    HA   ILE  21           HA       ILE  21   1.031  -1.603   6.552
  192    HB   ILE  21           HB       ILE  21  -0.753  -2.676   4.359
  193   HG12  ILE  21          HG13      ILE  21  -1.275  -2.123   7.291
  194   HG13  ILE  21          HG12      ILE  21  -1.888  -1.173   5.942
  195   HG21  ILE  21          HG21      ILE  21   0.750  -4.415   5.118
  196   HG22  ILE  21          HG22      ILE  21  -0.864  -4.718   5.763
  197   HG23  ILE  21          HG23      ILE  21   0.387  -4.036   6.801
  198   HD11  ILE  21          HD11      ILE  21  -3.584  -2.655   6.860
  199   HD12  ILE  21          HD12      ILE  21  -2.563  -4.049   6.508
  200   HD13  ILE  21          HD13      ILE  21  -3.202  -3.068   5.189
  201    H    ASP  22           H        ASP  22   0.941  -1.932   2.985
  202    HA   ASP  22           HA       ASP  22   2.609  -2.332   1.466
  203    HB2  ASP  22           HB3      ASP  22   3.781  -0.565   2.744
  204    HB3  ASP  22           HB2      ASP  22   4.405  -1.780   3.840
  205    H    LYS  23           H        LYS  23   4.285  -3.996   0.879
  206    HA   LYS  23           HA       LYS  23   3.937  -6.480   2.265
  207    HB2  LYS  23           HB3      LYS  23   6.120  -6.985   0.747
  208    HB3  LYS  23           HB2      LYS  23   4.469  -7.090   0.163
  209    HG2  LYS  23           HG3      LYS  23   5.807  -5.913  -1.432
  210    HG3  LYS  23           HG2      LYS  23   4.661  -4.790  -0.704
  211    HD2  LYS  23           HD3      LYS  23   6.619  -4.262   0.919
  212    HD3  LYS  23           HD2      LYS  23   7.621  -4.983  -0.341
  213    HE2  LYS  23           HE3      LYS  23   5.725  -2.665  -0.680
  214    HE3  LYS  23           HE2      LYS  23   7.479  -2.560  -0.600
  215    HZ1  LYS  23           HZ1      LYS  23   6.676  -2.461  -2.869
  216    HZ2  LYS  23           HZ2      LYS  23   5.927  -3.965  -2.702
  217    HZ3  LYS  23           HZ3      LYS  23   7.611  -3.844  -2.637
  218    H    VAL  24           H        VAL  24   5.046  -4.145   3.711
  219    HA   VAL  24           HA       VAL  24   6.426  -3.736   5.438
  220    HB   VAL  24           HB       VAL  24   7.020  -6.691   5.524
  221   HG11  VAL  24          HG11      VAL  24   6.904  -4.532   7.625
  222   HG12  VAL  24          HG12      VAL  24   8.335  -5.394   7.063
  223   HG13  VAL  24          HG13      VAL  24   7.090  -6.250   7.974
  224   HG21  VAL  24          HG21      VAL  24   5.019  -6.927   6.935
  225   HG22  VAL  24          HG22      VAL  24   4.612  -6.427   5.294
  226   HG23  VAL  24          HG23      VAL  24   4.599  -5.247   6.605
  227    H    LEU  25           H        LEU  25   7.535  -3.211   3.057
  228    HA   LEU  25           HA       LEU  25  10.360  -3.808   3.602
  229    HB2  LEU  25           HB3      LEU  25   9.027  -3.805   0.899
  230    HB3  LEU  25           HB2      LEU  25  10.764  -3.751   1.122
  231    HG   LEU  25           HG       LEU  25   8.937  -6.009   1.962
  232   HD11  LEU  25          HD11      LEU  25   9.283  -5.898  -0.447
  233   HD12  LEU  25          HD12      LEU  25  10.118  -7.284   0.249
  234   HD13  LEU  25          HD13      LEU  25  11.027  -5.843  -0.203
  235   HD21  LEU  25          HD21      LEU  25  11.016  -7.204   2.501
  236   HD22  LEU  25          HD22      LEU  25  10.780  -5.790   3.525
  237   HD23  LEU  25          HD23      LEU  25  11.932  -5.729   2.192
  238    H    ARG  26           H        ARG  26   8.008  -1.568   2.105
  239    HA   ARG  26           HA       ARG  26   9.769   0.608   2.864
  240    HB2  ARG  26           HB3      ARG  26   9.663   1.589   0.520
  241    HB3  ARG  26           HB2      ARG  26  10.755   0.240   0.778
  242    HG2  ARG  26           HG3      ARG  26   9.832  -0.593  -1.073
  243    HG3  ARG  26           HG2      ARG  26   8.499  -1.043  -0.016
  244    HD2  ARG  26           HD3      ARG  26   7.756   0.108  -2.068
  245    HD3  ARG  26           HD2      ARG  26   7.294   0.960  -0.597
  246    HE   ARG  26           HE       ARG  26   9.180   2.478  -1.039
  247   HH11  ARG  26          HH11      ARG  26   7.913   0.584  -3.700
  248   HH12  ARG  26          HH12      ARG  26   8.507   1.669  -4.917
  249   HH21  ARG  26          HH22      ARG  26   9.942   3.914  -2.635
  250   HH22  ARG  26          HH21      ARG  26   9.654   3.565  -4.310
  251    HA   PRO  27           HA       PRO  27   5.230   1.792   2.942
  252    HB2  PRO  27           HB2      PRO  27   5.619   2.025   5.841
  253    HB3  PRO  27           HB3      PRO  27   4.350   1.166   4.948
  254    HG2  PRO  27           HG3      PRO  27   6.267  -0.138   6.318
  255    HG3  PRO  27           HG2      PRO  27   5.578  -0.770   4.814
  256    HD2  PRO  27           HD3      PRO  27   8.177   0.667   5.247
  257    HD3  PRO  27           HD2      PRO  27   7.841  -0.773   4.259
  258    H    GLN  28           H        GLN  28   4.525   3.954   3.420
  259    HA   GLN  28           HA       GLN  28   6.381   5.754   4.700
  260    HB2  GLN  28           HB3      GLN  28   6.629   7.296   2.862
  261    HB3  GLN  28           HB2      GLN  28   7.216   5.717   2.391
  262    HG2  GLN  28           HG3      GLN  28   6.118   6.513   0.511
  263    HG3  GLN  28           HG2      GLN  28   4.937   5.417   1.221
  264   HE21  GLN  28          HE22      GLN  28   5.800   8.749   0.665
  265   HE22  GLN  28          HE21      GLN  28   4.236   9.414   0.980
  266    H    GLY  29           H        GLY  29   3.366   4.715   4.339
  267    HA2  GLY  29           HA3      GLY  29   2.165   7.390   4.641
  268    HA3  GLY  29           HA2      GLY  29   1.337   6.032   3.890
  Start of MODEL    3
    1    H1   ARG   1           H1       ARG   1 -10.790  -0.115   4.683
    2    H2   ARG   1           H2       ARG   1  -9.860   1.131   4.022
    3    H3   ARG   1           H3       ARG   1  -9.627  -0.459   3.509
    4    HA   ARG   1           HA       ARG   1 -11.781  -0.533   2.515
    5    HB2  ARG   1           HB3      ARG   1 -12.022   2.345   3.420
    6    HB3  ARG   1           HB2      ARG   1 -13.179   1.481   2.418
    7    HG2  ARG   1           HG3      ARG   1 -12.506   0.948   5.300
    8    HG3  ARG   1           HG2      ARG   1 -14.021   1.573   4.649
    9    HD2  ARG   1           HD3      ARG   1 -12.877  -1.179   4.166
   10    HD3  ARG   1           HD2      ARG   1 -14.224  -0.788   5.232
   11    HE   ARG   1           HE       ARG   1 -15.102   0.162   2.895
   12   HH11  ARG   1          HH12      ARG   1 -13.628  -2.908   3.708
   13   HH12  ARG   1          HH11      ARG   1 -14.481  -3.784   2.476
   14   HH21  ARG   1          HH21      ARG   1 -16.243  -1.001   1.286
   15   HH22  ARG   1          HH22      ARG   1 -15.977  -2.707   1.117
   16    H    LYS   2           H        LYS   2 -10.636  -0.859   0.719
   17    HA   LYS   2           HA       LYS   2 -10.235   1.144  -1.190
   18    HB2  LYS   2           HB3      LYS   2  -8.327   1.465   0.665
   19    HB3  LYS   2           HB2      LYS   2  -7.566   0.174  -0.248
   20    HG2  LYS   2           HG3      LYS   2  -6.757   2.311  -0.990
   21    HG3  LYS   2           HG2      LYS   2  -7.685   1.559  -2.272
   22    HD2  LYS   2           HD3      LYS   2  -9.602   2.961  -1.739
   23    HD3  LYS   2           HD2      LYS   2  -8.718   3.679  -0.391
   24    HE2  LYS   2           HE3      LYS   2  -7.089   4.615  -1.923
   25    HE3  LYS   2           HE2      LYS   2  -7.885   3.834  -3.287
   26    HZ1  LYS   2           HZ1      LYS   2  -8.513   6.144  -3.149
   27    HZ2  LYS   2           HZ2      LYS   2  -9.056   5.946  -1.561
   28    HZ3  LYS   2           HZ3      LYS   2  -9.859   5.175  -2.830
   29    H    CYS   3           H        CYS   3  -7.984  -0.160  -2.536
   30    HA   CYS   3           HA       CYS   3  -9.235  -2.638  -3.295
   31    HB2  CYS   3           HB3      CYS   3  -6.748  -2.655  -4.487
   32    HB3  CYS   3           HB2      CYS   3  -8.221  -2.004  -5.195
   33    H    ASN   4           H        ASN   4  -7.522  -1.848  -0.688
   34    HA   ASN   4           HA       ASN   4  -6.536  -2.987   0.983
   35    HB2  ASN   4           HB3      ASN   4  -7.699  -5.263  -0.571
   36    HB3  ASN   4           HB2      ASN   4  -6.626  -5.589   0.785
   37   HD21  ASN   4          HD22      ASN   4  -8.230  -6.530   2.000
   38   HD22  ASN   4          HD21      ASN   4  -9.512  -5.617   2.720
   39    H    PHE   5           H        PHE   5  -5.672  -5.514  -1.291
   40    HA   PHE   5           HA       PHE   5  -2.921  -5.189  -0.509
   41    HB2  PHE   5           HB3      PHE   5  -2.628  -7.154  -2.152
   42    HB3  PHE   5           HB2      PHE   5  -3.510  -7.429  -0.657
   43    HD1  PHE   5           HD2      PHE   5  -3.906  -6.874  -4.293
   44    HD2  PHE   5           HD1      PHE   5  -5.769  -8.083  -0.663
   45    HE1  PHE   5           HE2      PHE   5  -5.845  -7.695  -5.563
   46    HE2  PHE   5           HE1      PHE   5  -7.710  -8.907  -1.929
   47    HZ   PHE   5           HZ       PHE   5  -7.750  -8.713  -4.382
   48    H    LEU   6           H        LEU   6  -1.182  -4.833  -1.888
   49    HA   LEU   6           HA       LEU   6  -0.079  -3.390  -3.244
   50    HB2  LEU   6           HB3      LEU   6  -2.159  -4.313  -5.227
   51    HB3  LEU   6           HB2      LEU   6  -0.720  -3.412  -5.645
   52    HG   LEU   6           HG       LEU   6  -0.119  -5.562  -6.209
   53   HD11  LEU   6          HD11      LEU   6   1.211  -4.468  -4.068
   54   HD12  LEU   6          HD12      LEU   6   1.739  -5.850  -5.034
   55   HD13  LEU   6          HD13      LEU   6   0.863  -6.116  -3.532
   56   HD21  LEU   6          HD21      LEU   6  -2.100  -6.681  -5.395
   57   HD22  LEU   6          HD22      LEU   6  -1.512  -6.562  -3.737
   58   HD23  LEU   6          HD23      LEU   6  -0.653  -7.564  -4.907
   59    H    CYS   7           H        CYS   7  -1.980  -2.263  -1.578
   60    HA   CYS   7           HA       CYS   7  -2.538   0.232  -2.884
   61    HB2  CYS   7           HB3      CYS   7  -4.715  -1.722  -2.264
   62    HB3  CYS   7           HB2      CYS   7  -5.036   0.003  -2.117
   63    H    LYS   8           H        LYS   8  -2.100  -1.702  -0.151
   64    HA   LYS   8           HA       LYS   8  -1.867   0.391   1.691
   65    HB2  LYS   8           HB3      LYS   8  -4.310   0.533   1.509
   66    HB3  LYS   8           HB2      LYS   8  -4.451  -1.181   1.868
   67    HG2  LYS   8           HG3      LYS   8  -3.488  -0.768   4.093
   68    HG3  LYS   8           HG2      LYS   8  -3.432   0.956   3.727
   69    HD2  LYS   8           HD3      LYS   8  -5.933  -0.727   3.764
   70    HD3  LYS   8           HD2      LYS   8  -5.400   0.324   5.075
   71    HE2  LYS   8           HE3      LYS   8  -6.081   1.202   2.273
   72    HE3  LYS   8           HE2      LYS   8  -7.107   1.396   3.691
   73    HZ1  LYS   8           HZ1      LYS   8  -5.950   3.432   3.250
   74    HZ2  LYS   8           HZ2      LYS   8  -4.450   2.649   3.258
   75    HZ3  LYS   8           HZ3      LYS   8  -5.353   2.773   4.685
   76    H    LEU   9           H        LEU   9  -3.186  -2.891   1.608
   77    HA   LEU   9           HA       LEU   9  -1.664  -3.897   3.771
   78    HB2  LEU   9           HB3      LEU   9  -3.175  -5.159   1.509
   79    HB3  LEU   9           HB2      LEU   9  -2.184  -6.150   2.562
   80    HG   LEU   9           HG       LEU   9  -3.524  -5.380   4.504
   81   HD11  LEU   9          HD11      LEU   9  -5.655  -4.249   4.121
   82   HD12  LEU   9          HD12      LEU   9  -5.258  -4.077   2.412
   83   HD13  LEU   9          HD13      LEU   9  -4.293  -3.242   3.628
   84   HD21  LEU   9          HD21      LEU   9  -5.529  -6.680   3.957
   85   HD22  LEU   9          HD22      LEU   9  -4.051  -7.477   3.420
   86   HD23  LEU   9          HD23      LEU   9  -5.076  -6.642   2.254
   87    H    LYS  10           H        LYS  10  -1.292  -4.533   0.271
   88    HA   LYS  10           HA       LYS  10   1.621  -4.390   0.703
   89    HB2  LYS  10           HB3      LYS  10   0.315  -5.296  -1.854
   90    HB3  LYS  10           HB2      LYS  10   1.948  -5.606  -1.293
   91    HG2  LYS  10           HG3      LYS  10   1.079  -7.069   0.446
   92    HG3  LYS  10           HG2      LYS  10  -0.559  -6.751  -0.117
   93    HD2  LYS  10           HD3      LYS  10   0.077  -7.685  -2.327
   94    HD3  LYS  10           HD2      LYS  10   1.647  -8.114  -1.647
   95    HE2  LYS  10           HE3      LYS  10   0.466  -9.472   0.065
   96    HE3  LYS  10           HE2      LYS  10  -1.048  -9.122  -0.769
   97    HZ1  LYS  10           HZ1      LYS  10  -0.176 -10.211  -2.738
   98    HZ2  LYS  10           HZ2      LYS  10  -0.153 -11.265  -1.415
   99    HZ3  LYS  10           HZ3      LYS  10   1.281 -10.538  -1.942
  100    H    GLU  11           H        GLU  11   2.390  -3.592  -1.852
  101    HA   GLU  11           HA       GLU  11   1.199  -0.901  -1.913
  102    HB2  GLU  11           HB3      GLU  11   3.396   0.069  -2.103
  103    HB3  GLU  11           HB2      GLU  11   3.268  -0.907  -0.646
  104    HG2  GLU  11           HG3      GLU  11   5.318  -1.525  -1.409
  105    HG3  GLU  11           HG2      GLU  11   4.311  -2.764  -2.136
  106    H    LYS  12           H        LYS  12   2.084   0.386  -3.817
  107    HA   LYS  12           HA       LYS  12   2.932  -1.050  -6.145
  108    HB2  LYS  12           HB3      LYS  12   1.073  -0.701  -7.553
  109    HB3  LYS  12           HB2      LYS  12   0.370  -1.295  -6.066
  110    HG2  LYS  12           HG3      LYS  12   0.513   1.590  -6.843
  111    HG3  LYS  12           HG2      LYS  12  -0.865   0.536  -7.152
  112    HD2  LYS  12           HD3      LYS  12  -0.976   0.118  -4.685
  113    HD3  LYS  12           HD2      LYS  12   0.245   1.388  -4.486
  114    HE2  LYS  12           HE3      LYS  12  -1.785   2.512  -4.232
  115    HE3  LYS  12           HE2      LYS  12  -1.268   2.811  -5.892
  116    HZ1  LYS  12           HZ1      LYS  12  -3.659   2.242  -5.651
  117    HZ2  LYS  12           HZ2      LYS  12  -3.199   0.690  -5.168
  118    HZ3  LYS  12           HZ3      LYS  12  -2.809   1.247  -6.715
  119    H    LEU  13           H        LEU  13   3.696   1.168  -4.332
  120    HA   LEU  13           HA       LEU  13   4.425   3.308  -4.260
  121    HB2  LEU  13           HB3      LEU  13   4.401   3.026  -7.264
  122    HB3  LEU  13           HB2      LEU  13   5.090   4.392  -6.410
  123    HG   LEU  13           HG       LEU  13   6.036   1.531  -6.180
  124   HD11  LEU  13          HD11      LEU  13   7.275   3.906  -7.565
  125   HD12  LEU  13          HD12      LEU  13   6.543   2.512  -8.358
  126   HD13  LEU  13          HD13      LEU  13   8.005   2.311  -7.393
  127   HD21  LEU  13          HD21      LEU  13   7.918   2.500  -4.943
  128   HD22  LEU  13          HD22      LEU  13   6.383   2.776  -4.119
  129   HD23  LEU  13          HD23      LEU  13   7.147   4.085  -5.020
  130    H    ARG  14           H        ARG  14   3.264   4.978  -3.604
  131    HA   ARG  14           HA       ARG  14   1.503   6.423  -5.251
  132    HB2  ARG  14           HB3      ARG  14   0.100   4.377  -4.860
  133    HB3  ARG  14           HB2      ARG  14   0.082   4.780  -3.146
  134    HG2  ARG  14           HG3      ARG  14  -1.956   5.467  -4.398
  135    HG3  ARG  14           HG2      ARG  14  -1.142   6.784  -3.557
  136    HD2  ARG  14           HD3      ARG  14  -1.906   7.364  -5.854
  137    HD3  ARG  14           HD2      ARG  14  -0.178   7.583  -5.594
  138    HE   ARG  14           HE       ARG  14  -0.717   5.016  -6.677
  139   HH11  ARG  14          HH11      ARG  14  -0.549   8.398  -7.541
  140   HH12  ARG  14          HH12      ARG  14  -0.136   8.088  -9.196
  141   HH21  ARG  14          HH22      ARG  14  -0.147   4.598  -8.855
  142   HH22  ARG  14          HH21      ARG  14   0.097   5.929  -9.945
  143    H    THR  15           H        THR  15   0.736   5.764  -1.880
  144    HA   THR  15           HA       THR  15   2.306   7.835  -0.771
  145    HB   THR  15           HB       THR  15   0.684   9.240  -2.033
  146    HG1  THR  15           HG1      THR  15   1.550  10.184  -0.219
  147   HG21  THR  15          HG21      THR  15  -1.357   8.079  -0.133
  148   HG22  THR  15          HG22      THR  15  -1.278   7.774  -1.867
  149   HG23  THR  15          HG23      THR  15  -1.631   9.395  -1.274
  150    H    VAL  16           H        VAL  16   0.863   8.492   1.452
  151    HA   VAL  16           HA       VAL  16   1.308   6.431   3.162
  152    HB   VAL  16           HB       VAL  16   0.924   8.824   3.770
  153   HG11  VAL  16          HG11      VAL  16  -1.969   8.005   3.600
  154   HG12  VAL  16          HG12      VAL  16  -1.155   9.244   2.641
  155   HG13  VAL  16          HG13      VAL  16  -1.385   9.480   4.374
  156   HG21  VAL  16          HG21      VAL  16  -0.528   6.748   5.405
  157   HG22  VAL  16          HG22      VAL  16   0.004   8.325   5.991
  158   HG23  VAL  16          HG23      VAL  16   1.193   7.128   5.480
  159    H    ILE  17           H        ILE  17  -1.710   6.927   1.346
  160    HA   ILE  17           HA       ILE  17  -3.296   5.164   2.853
  161    HB   ILE  17           HB       ILE  17  -4.237   6.656   1.112
  162   HG12  ILE  17          HG13      ILE  17  -5.476   4.620   1.955
  163   HG13  ILE  17          HG12      ILE  17  -6.008   5.217   0.389
  164   HG21  ILE  17          HG21      ILE  17  -3.061   4.719  -0.869
  165   HG22  ILE  17          HG22      ILE  17  -2.575   6.396  -0.624
  166   HG23  ILE  17          HG23      ILE  17  -4.180   6.028  -1.249
  167   HD11  ILE  17          HD11      ILE  17  -5.301   3.376  -0.707
  168   HD12  ILE  17          HD12      ILE  17  -5.618   2.647   0.871
  169   HD13  ILE  17          HD13      ILE  17  -3.971   3.077   0.406
  170    H    THR  18           H        THR  18  -1.112   4.606   0.152
  171    HA   THR  18           HA       THR  18  -1.488   1.740   0.190
  172    HB   THR  18           HB       THR  18   0.546   3.418  -1.293
  173    HG1  THR  18           HG1      THR  18  -2.137   2.788  -1.779
  174   HG21  THR  18          HG21      THR  18  -0.418   0.619  -1.869
  175   HG22  THR  18          HG22      THR  18   1.088   1.001  -1.034
  176   HG23  THR  18          HG23      THR  18   0.856   1.505  -2.705
  177    H    SER  19           H        SER  19   0.967   4.115   0.931
  178    HA   SER  19           HA       SER  19   2.815   2.245   2.076
  179    HB2  SER  19           HB3      SER  19   3.496   4.367   0.982
  180    HB3  SER  19           HB2      SER  19   2.697   5.278   2.264
  181    HG   SER  19           HG       SER  19   4.165   4.239   3.739
  182    H    HIS  20           H        HIS  20   0.059   2.312   3.148
  183    HA   HIS  20           HA       HIS  20   0.014   3.501   5.715
  184    HB2  HIS  20           HB3      HIS  20  -1.999   2.735   4.463
  185    HB3  HIS  20           HB2      HIS  20  -1.497   1.069   4.732
  186    HD1  HIS  20           HD1      HIS  20  -2.582  -0.010   6.672
  187    HD2  HIS  20           HD2      HIS  20  -2.387   4.121   7.107
  188    HE1  HIS  20           HE1      HIS  20  -3.777   0.501   8.823
  189    HE2  HIS  20           HE2      HIS  20  -3.544   2.992   9.123
  190    H    ILE  21           H        ILE  21   1.047   0.376   4.523
  191    HA   ILE  21           HA       ILE  21   2.708  -0.010   6.823
  192    HB   ILE  21           HB       ILE  21   0.689  -0.893   7.792
  193   HG12  ILE  21          HG13      ILE  21   1.351  -3.256   8.188
  194   HG13  ILE  21          HG12      ILE  21   2.525  -3.117   6.885
  195   HG21  ILE  21          HG21      ILE  21   0.454  -2.666   5.369
  196   HG22  ILE  21          HG22      ILE  21  -0.596  -1.309   5.781
  197   HG23  ILE  21          HG23      ILE  21  -0.567  -2.745   6.806
  198   HD11  ILE  21          HD11      ILE  21   3.691  -1.372   8.137
  199   HD12  ILE  21          HD12      ILE  21   3.591  -2.880   9.043
  200   HD13  ILE  21          HD13      ILE  21   2.521  -1.538   9.444
  201    H    ASP  22           H        ASP  22   1.245  -1.520   3.960
  202    HA   ASP  22           HA       ASP  22   2.142  -2.598   2.180
  203    HB2  ASP  22           HB3      ASP  22   3.661  -0.723   1.959
  204    HB3  ASP  22           HB2      ASP  22   4.715  -1.371   3.197
  205    H    LYS  23           H        LYS  23   3.739  -4.378   1.546
  206    HA   LYS  23           HA       LYS  23   3.798  -6.458   3.424
  207    HB2  LYS  23           HB3      LYS  23   5.341  -7.594   1.900
  208    HB3  LYS  23           HB2      LYS  23   4.014  -6.864   1.014
  209    HG2  LYS  23           HG3      LYS  23   6.252  -5.057   1.199
  210    HG3  LYS  23           HG2      LYS  23   6.731  -6.600   0.496
  211    HD2  LYS  23           HD3      LYS  23   5.001  -6.416  -1.181
  212    HD3  LYS  23           HD2      LYS  23   4.390  -4.939  -0.432
  213    HE2  LYS  23           HE3      LYS  23   5.714  -4.346  -2.347
  214    HE3  LYS  23           HE2      LYS  23   6.576  -3.856  -0.889
  215    HZ1  LYS  23           HZ1      LYS  23   8.063  -4.893  -2.465
  216    HZ2  LYS  23           HZ2      LYS  23   7.119  -6.292  -2.504
  217    HZ3  LYS  23           HZ3      LYS  23   7.933  -5.862  -1.090
  218    H    VAL  24           H        VAL  24   6.142  -3.882   2.714
  219    HA   VAL  24           HA       VAL  24   7.653  -4.691   5.097
  220    HB   VAL  24           HB       VAL  24   9.830  -4.560   3.947
  221   HG11  VAL  24          HG11      VAL  24   7.942  -6.636   2.857
  222   HG12  VAL  24          HG12      VAL  24   8.890  -6.744   4.340
  223   HG13  VAL  24          HG13      VAL  24   9.701  -6.730   2.774
  224   HG21  VAL  24          HG21      VAL  24   9.155  -3.177   2.054
  225   HG22  VAL  24          HG22      VAL  24   8.195  -4.510   1.414
  226   HG23  VAL  24          HG23      VAL  24   9.950  -4.656   1.513
  227    H    LEU  25           H        LEU  25   6.076  -2.324   3.798
  228    HA   LEU  25           HA       LEU  25   6.081  -0.044   3.906
  229    HB2  LEU  25           HB3      LEU  25   6.788  -0.584   6.265
  230    HB3  LEU  25           HB2      LEU  25   8.448  -0.363   5.754
  231    HG   LEU  25           HG       LEU  25   7.992   1.985   5.235
  232   HD11  LEU  25          HD11      LEU  25   5.649   1.821   4.620
  233   HD12  LEU  25          HD12      LEU  25   5.859   2.999   5.915
  234   HD13  LEU  25          HD13      LEU  25   5.225   1.393   6.277
  235   HD21  LEU  25          HD21      LEU  25   7.702   2.772   7.522
  236   HD22  LEU  25          HD22      LEU  25   8.777   1.375   7.460
  237   HD23  LEU  25          HD23      LEU  25   7.109   1.181   8.001
  238    H    ARG  26           H        ARG  26   7.187  -1.090   1.702
  239    HA   ARG  26           HA       ARG  26   9.818   0.033   1.274
  240    HB2  ARG  26           HB3      ARG  26   9.603  -2.125   0.409
  241    HB3  ARG  26           HB2      ARG  26   8.016  -1.800  -0.268
  242    HG2  ARG  26           HG3      ARG  26  10.279  -0.234  -1.346
  243    HG3  ARG  26           HG2      ARG  26  10.219  -1.952  -1.745
  244    HD2  ARG  26           HD3      ARG  26   8.160  -1.747  -2.832
  245    HD3  ARG  26           HD2      ARG  26   7.812  -0.195  -2.059
  246    HE   ARG  26           HE       ARG  26   9.898   0.513  -3.470
  247   HH11  ARG  26          HH11      ARG  26   7.256  -1.561  -4.492
  248   HH12  ARG  26          HH12      ARG  26   7.487  -1.210  -6.174
  249   HH21  ARG  26          HH22      ARG  26  10.181   0.959  -5.687
  250   HH22  ARG  26          HH21      ARG  26   9.137   0.206  -6.852
  251    HA   PRO  27           HA       PRO  27   7.149   1.994  -2.326
  252    HB2  PRO  27           HB2      PRO  27   4.825   3.207  -1.495
  253    HB3  PRO  27           HB3      PRO  27   4.910   1.583  -2.204
  254    HG2  PRO  27           HG3      PRO  27   4.778   2.395   0.676
  255    HG3  PRO  27           HG2      PRO  27   3.925   1.082  -0.159
  256    HD2  PRO  27           HD3      PRO  27   6.082   0.599   1.350
  257    HD3  PRO  27           HD2      PRO  27   5.790  -0.298  -0.148
  258    H    GLN  28           H        GLN  28   5.805   3.877   0.353
  259    HA   GLN  28           HA       GLN  28   7.690   6.029  -0.339
  260    HB2  GLN  28           HB3      GLN  28   5.128   6.529   1.140
  261    HB3  GLN  28           HB2      GLN  28   6.051   7.627   0.128
  262    HG2  GLN  28           HG3      GLN  28   4.331   5.340  -0.802
  263    HG3  GLN  28           HG2      GLN  28   3.973   7.056  -0.942
  264   HE21  GLN  28          HE22      GLN  28   6.687   7.778  -1.705
  265   HE22  GLN  28          HE21      GLN  28   6.884   7.233  -3.334
  266    H    GLY  29           H        GLY  29   7.609   3.651   1.601
  267    HA2  GLY  29           HA3      GLY  29   7.703   4.954   4.191
  268    HA3  GLY  29           HA2      GLY  29   7.863   3.228   3.874
  Start of MODEL    4
    1    H1   ARG   1           H1       ARG   1  -7.736   5.081  -3.251
    2    H2   ARG   1           H2       ARG   1  -8.238   5.872  -1.846
    3    H3   ARG   1           H3       ARG   1  -9.094   6.089  -3.286
    4    HA   ARG   1           HA       ARG   1 -10.297   4.616  -1.847
    5    HB2  ARG   1           HB3      ARG   1  -8.981   3.226  -4.191
    6    HB3  ARG   1           HB2      ARG   1 -10.384   2.606  -3.338
    7    HG2  ARG   1           HG3      ARG   1 -10.287   5.242  -4.787
    8    HG3  ARG   1           HG2      ARG   1 -10.938   3.745  -5.453
    9    HD2  ARG   1           HD3      ARG   1 -11.946   5.130  -2.969
   10    HD3  ARG   1           HD2      ARG   1 -12.692   5.230  -4.561
   11    HE   ARG   1           HE       ARG   1 -12.394   2.528  -3.670
   12   HH11  ARG   1          HH12      ARG   1 -14.401   5.387  -3.406
   13   HH12  ARG   1          HH11      ARG   1 -15.826   4.503  -2.968
   14   HH21  ARG   1          HH21      ARG   1 -14.273   1.360  -3.098
   15   HH22  ARG   1          HH22      ARG   1 -15.757   2.209  -2.798
   16    H    LYS   2           H        LYS   2 -10.334   2.889  -0.422
   17    HA   LYS   2           HA       LYS   2  -7.694   2.029   0.478
   18    HB2  LYS   2           HB3      LYS   2 -10.389   1.763   1.820
   19    HB3  LYS   2           HB2      LYS   2  -8.871   1.204   2.502
   20    HG2  LYS   2           HG3      LYS   2  -9.022   3.203   3.555
   21    HG3  LYS   2           HG2      LYS   2  -8.183   3.727   2.098
   22    HD2  LYS   2           HD3      LYS   2  -9.949   5.269   2.494
   23    HD3  LYS   2           HD2      LYS   2 -10.414   4.280   1.111
   24    HE2  LYS   2           HE3      LYS   2 -11.837   2.920   2.528
   25    HE3  LYS   2           HE2      LYS   2 -11.322   3.822   3.953
   26    HZ1  LYS   2           HZ1      LYS   2 -12.788   4.975   1.642
   27    HZ2  LYS   2           HZ2      LYS   2 -12.346   5.795   3.053
   28    HZ3  LYS   2           HZ3      LYS   2 -13.486   4.548   3.119
   29    H    CYS   3           H        CYS   3  -7.630   0.687  -1.533
   30    HA   CYS   3           HA       CYS   3  -9.178  -1.704  -1.603
   31    HB2  CYS   3           HB3      CYS   3  -6.862  -2.231  -3.035
   32    HB3  CYS   3           HB2      CYS   3  -8.358  -1.575  -3.690
   33    H    ASN   4           H        ASN   4  -7.896  -3.891  -1.608
   34    HA   ASN   4           HA       ASN   4  -6.962  -4.042   1.129
   35    HB2  ASN   4           HB3      ASN   4  -7.709  -6.206  -0.843
   36    HB3  ASN   4           HB2      ASN   4  -7.198  -6.509   0.811
   37   HD21  ASN   4          HD22      ASN   4  -9.749  -7.044  -0.591
   38   HD22  ASN   4          HD21      ASN   4 -10.964  -6.280   0.374
   39    H    PHE   5           H        PHE   5  -5.818  -6.593  -0.796
   40    HA   PHE   5           HA       PHE   5  -3.124  -6.016  -0.090
   41    HB2  PHE   5           HB3      PHE   5  -2.623  -8.016  -1.577
   42    HB3  PHE   5           HB2      PHE   5  -3.660  -8.305  -0.189
   43    HD1  PHE   5           HD2      PHE   5  -3.563  -7.961  -3.848
   44    HD2  PHE   5           HD1      PHE   5  -5.930  -8.986  -0.467
   45    HE1  PHE   5           HE2      PHE   5  -5.261  -8.937  -5.334
   46    HE2  PHE   5           HE1      PHE   5  -7.629  -9.965  -1.950
   47    HZ   PHE   5           HZ       PHE   5  -7.295  -9.940  -4.385
   48    H    LEU   6           H        LEU   6  -1.373  -5.608  -1.477
   49    HA   LEU   6           HA       LEU   6  -0.355  -4.195  -2.898
   50    HB2  LEU   6           HB3      LEU   6  -2.272  -5.645  -4.677
   51    HB3  LEU   6           HB2      LEU   6  -1.343  -4.309  -5.329
   52    HG   LEU   6           HG       LEU   6  -0.269  -6.451  -5.813
   53   HD11  LEU   6          HD11      LEU   6   1.261  -4.793  -3.800
   54   HD12  LEU   6          HD12      LEU   6   1.155  -4.502  -5.540
   55   HD13  LEU   6          HD13      LEU   6   1.964  -5.948  -4.938
   56   HD21  LEU   6          HD21      LEU   6  -1.095  -7.698  -3.866
   57   HD22  LEU   6          HD22      LEU   6  -0.020  -6.761  -2.826
   58   HD23  LEU   6          HD23      LEU   6   0.654  -7.838  -4.052
   59    H    CYS   7           H        CYS   7  -1.515  -2.684  -1.366
   60    HA   CYS   7           HA       CYS   7  -2.369  -0.415  -2.710
   61    HB2  CYS   7           HB3      CYS   7  -4.431  -1.643  -3.209
   62    HB3  CYS   7           HB2      CYS   7  -4.685  -1.951  -1.494
   63    H    LYS   8           H        LYS   8  -4.032  -1.528   0.209
   64    HA   LYS   8           HA       LYS   8  -2.502   0.480   1.699
   65    HB2  LYS   8           HB3      LYS   8  -5.004   0.713   1.580
   66    HB3  LYS   8           HB2      LYS   8  -5.140  -0.824   2.419
   67    HG2  LYS   8           HG3      LYS   8  -4.168   0.068   4.393
   68    HG3  LYS   8           HG2      LYS   8  -3.697   1.552   3.562
   69    HD2  LYS   8           HD3      LYS   8  -5.587   2.253   4.661
   70    HD3  LYS   8           HD2      LYS   8  -6.269   1.759   3.115
   71    HE2  LYS   8           HE3      LYS   8  -6.197   0.058   5.604
   72    HE3  LYS   8           HE2      LYS   8  -7.589   0.982   5.052
   73    HZ1  LYS   8           HZ1      LYS   8  -7.577  -0.363   3.012
   74    HZ2  LYS   8           HZ2      LYS   8  -7.810  -1.300   4.399
   75    HZ3  LYS   8           HZ3      LYS   8  -6.308  -1.287   3.633
   76    H    LEU   9           H        LEU   9  -3.206  -2.805   1.279
   77    HA   LEU   9           HA       LEU   9  -2.055  -3.577   3.843
   78    HB2  LEU   9           HB3      LEU   9  -3.489  -5.145   1.719
   79    HB3  LEU   9           HB2      LEU   9  -2.785  -5.873   3.154
   80    HG   LEU   9           HG       LEU   9  -4.927  -3.747   3.229
   81   HD11  LEU   9          HD11      LEU   9  -5.147  -6.741   3.413
   82   HD12  LEU   9          HD12      LEU   9  -5.846  -5.689   2.182
   83   HD13  LEU   9          HD13      LEU   9  -6.433  -5.613   3.844
   84   HD21  LEU   9          HD21      LEU   9  -3.826  -5.585   5.352
   85   HD22  LEU   9          HD22      LEU   9  -5.183  -4.478   5.556
   86   HD23  LEU   9          HD23      LEU   9  -3.569  -3.844   5.242
   87    H    LYS  10           H        LYS  10  -1.733  -5.135   0.618
   88    HA   LYS  10           HA       LYS  10   0.989  -5.774   1.433
   89    HB2  LYS  10           HB3      LYS  10  -0.577  -7.542   0.645
   90    HB3  LYS  10           HB2      LYS  10  -0.493  -6.837  -0.960
   91    HG2  LYS  10           HG3      LYS  10   1.820  -7.317  -1.144
   92    HG3  LYS  10           HG2      LYS  10   1.914  -7.767   0.557
   93    HD2  LYS  10           HD3      LYS  10   0.400  -9.222  -1.616
   94    HD3  LYS  10           HD2      LYS  10   1.896  -9.756  -0.846
   95    HE2  LYS  10           HE3      LYS  10   0.683  -9.806   1.328
   96    HE3  LYS  10           HE2      LYS  10  -0.802  -9.429   0.453
   97    HZ1  LYS  10           HZ1      LYS  10   0.885 -11.840   0.060
   98    HZ2  LYS  10           HZ2      LYS  10  -0.520 -11.473  -0.809
   99    HZ3  LYS  10           HZ3      LYS  10  -0.610 -11.788   0.848
  100    H    GLU  11           H        GLU  11   0.706  -3.177   0.764
  101    HA   GLU  11           HA       GLU  11   1.923  -1.527  -0.166
  102    HB2  GLU  11           HB3      GLU  11   3.689  -3.383   0.190
  103    HB3  GLU  11           HB2      GLU  11   3.628  -3.570  -1.550
  104    HG2  GLU  11           HG3      GLU  11   4.398  -1.330  -1.882
  105    HG3  GLU  11           HG2      GLU  11   4.275  -0.981  -0.158
  106    H    LYS  12           H        LYS  12   2.391  -0.352  -2.082
  107    HA   LYS  12           HA       LYS  12   1.812  -1.242  -4.674
  108    HB2  LYS  12           HB3      LYS  12  -0.475  -1.456  -3.969
  109    HB3  LYS  12           HB2      LYS  12  -0.477   0.139  -3.255
  110    HG2  LYS  12           HG3      LYS  12   0.086  -0.108  -6.148
  111    HG3  LYS  12           HG2      LYS  12  -1.562  -0.402  -5.594
  112    HD2  LYS  12           HD3      LYS  12  -1.854   1.762  -4.888
  113    HD3  LYS  12           HD2      LYS  12  -0.120   2.038  -4.647
  114    HE2  LYS  12           HE3      LYS  12  -0.732   3.256  -6.587
  115    HE3  LYS  12           HE2      LYS  12   0.119   1.804  -7.123
  116    HZ1  LYS  12           HZ1      LYS  12  -2.000   0.770  -7.609
  117    HZ2  LYS  12           HZ2      LYS  12  -1.847   2.220  -8.463
  118    HZ3  LYS  12           HZ3      LYS  12  -2.829   2.146  -7.086
  119    H    LEU  13           H        LEU  13   1.868   1.360  -2.358
  120    HA   LEU  13           HA       LEU  13   3.321   3.110  -2.260
  121    HB2  LEU  13           HB3      LEU  13   4.013   2.516  -5.129
  122    HB3  LEU  13           HB2      LEU  13   4.853   3.635  -4.075
  123    HG   LEU  13           HG       LEU  13   4.668   0.670  -3.565
  124   HD11  LEU  13          HD11      LEU  13   5.864   1.117  -5.639
  125   HD12  LEU  13          HD12      LEU  13   6.957   0.557  -4.375
  126   HD13  LEU  13          HD13      LEU  13   6.902   2.268  -4.798
  127   HD21  LEU  13          HD21      LEU  13   6.391   2.833  -2.364
  128   HD22  LEU  13          HD22      LEU  13   6.512   1.109  -2.013
  129   HD23  LEU  13          HD23      LEU  13   5.056   1.999  -1.568
  130    H    ARG  14           H        ARG  14   2.666   5.090  -2.194
  131    HA   ARG  14           HA       ARG  14   1.866   6.599  -4.457
  132    HB2  ARG  14           HB3      ARG  14  -0.214   5.195  -3.847
  133    HB3  ARG  14           HB2      ARG  14  -0.322   6.201  -2.418
  134    HG2  ARG  14           HG3      ARG  14  -0.478   7.159  -5.273
  135    HG3  ARG  14           HG2      ARG  14  -1.833   6.947  -4.166
  136    HD2  ARG  14           HD3      ARG  14  -0.877   8.662  -2.691
  137    HD3  ARG  14           HD2      ARG  14   0.443   8.893  -3.834
  138    HE   ARG  14           HE       ARG  14  -1.865   9.265  -5.285
  139   HH11  ARG  14          HH11      ARG  14  -0.373  10.748  -2.476
  140   HH12  ARG  14          HH12      ARG  14  -1.087  12.305  -2.771
  141   HH21  ARG  14          HH22      ARG  14  -2.798  11.312  -5.670
  142   HH22  ARG  14          HH21      ARG  14  -2.470  12.624  -4.579
  143    H    THR  15           H        THR  15   1.014   6.544  -0.994
  144    HA   THR  15           HA       THR  15   2.923   8.633  -0.420
  145    HB   THR  15           HB       THR  15  -0.024   9.150   0.061
  146    HG1  THR  15           HG1      THR  15   1.800  10.010  -1.918
  147   HG21  THR  15          HG21      THR  15   2.400  10.882   0.551
  148   HG22  THR  15          HG22      THR  15   1.419  10.103   1.790
  149   HG23  THR  15          HG23      THR  15   0.721  11.369   0.782
  150    H    VAL  16           H        VAL  16  -0.046   7.293   1.103
  151    HA   VAL  16           HA       VAL  16   1.509   6.202   3.278
  152    HB   VAL  16           HB       VAL  16  -0.308   8.571   3.727
  153   HG11  VAL  16          HG11      VAL  16   0.586   6.475   5.693
  154   HG12  VAL  16          HG12      VAL  16  -1.060   7.005   5.340
  155   HG13  VAL  16          HG13      VAL  16   0.052   8.086   6.180
  156   HG21  VAL  16          HG21      VAL  16   2.069   9.040   3.337
  157   HG22  VAL  16          HG22      VAL  16   2.495   7.964   4.666
  158   HG23  VAL  16          HG23      VAL  16   1.588   9.442   4.984
  159    H    ILE  17           H        ILE  17  -1.734   6.856   1.919
  160    HA   ILE  17           HA       ILE  17  -2.867   4.718   3.498
  161    HB   ILE  17           HB       ILE  17  -4.303   6.586   2.845
  162   HG12  ILE  17          HG13      ILE  17  -5.218   4.218   3.158
  163   HG13  ILE  17          HG12      ILE  17  -6.258   5.380   2.348
  164   HG21  ILE  17          HG21      ILE  17  -5.103   6.829   0.527
  165   HG22  ILE  17          HG22      ILE  17  -3.884   5.662   0.016
  166   HG23  ILE  17          HG23      ILE  17  -3.393   7.200   0.725
  167   HD11  ILE  17          HD11      ILE  17  -6.445   3.304   1.211
  168   HD12  ILE  17          HD12      ILE  17  -4.695   3.128   1.095
  169   HD13  ILE  17          HD13      ILE  17  -5.524   4.385   0.171
  170    H    THR  18           H        THR  18  -1.846   5.180   0.162
  171    HA   THR  18           HA       THR  18  -2.254   2.374  -0.439
  172    HB   THR  18           HB       THR  18  -0.878   3.854  -2.499
  173    HG1  THR  18           HG1      THR  18  -3.412   4.963  -2.064
  174   HG21  THR  18          HG21      THR  18  -2.227   1.868  -2.899
  175   HG22  THR  18          HG22      THR  18  -2.899   3.242  -3.776
  176   HG23  THR  18          HG23      THR  18  -3.660   2.692  -2.284
  177    H    SER  19           H        SER  19  -0.067   4.068   1.146
  178    HA   SER  19           HA       SER  19   1.833   1.873   0.889
  179    HB2  SER  19           HB3      SER  19   2.744   3.876  -0.342
  180    HB3  SER  19           HB2      SER  19   2.695   4.766   1.182
  181    HG   SER  19           HG       SER  19   3.944   2.370   1.485
  182    H    HIS  20           H        HIS  20   0.568   1.181   2.743
  183    HA   HIS  20           HA       HIS  20   0.645   3.009   5.049
  184    HB2  HIS  20           HB3      HIS  20  -1.615   2.479   4.071
  185    HB3  HIS  20           HB2      HIS  20  -1.371   0.809   4.569
  186    HD1  HIS  20           HD1      HIS  20  -2.634   4.008   5.758
  187    HD2  HIS  20           HD2      HIS  20  -1.127   0.542   7.492
  188    HE1  HIS  20           HE1      HIS  20  -3.367   4.075   8.159
  189    HE2  HIS  20           HE2      HIS  20  -2.307   2.058   9.220
  190    H    ILE  21           H        ILE  21  -0.136  -0.470   4.929
  191    HA   ILE  21           HA       ILE  21   1.933  -0.849   6.976
  192    HB   ILE  21           HB       ILE  21  -0.102  -1.917   7.597
  193   HG12  ILE  21          HG13      ILE  21   1.869  -3.952   6.549
  194   HG13  ILE  21          HG12      ILE  21   1.891  -3.185   8.132
  195   HG21  ILE  21          HG21      ILE  21  -0.082  -3.305   4.927
  196   HG22  ILE  21          HG22      ILE  21  -1.194  -2.036   5.440
  197   HG23  ILE  21          HG23      ILE  21  -1.226  -3.610   6.236
  198   HD11  ILE  21          HD11      ILE  21  -0.202  -4.306   8.695
  199   HD12  ILE  21          HD12      ILE  21   1.067  -5.452   8.269
  200   HD13  ILE  21          HD13      ILE  21  -0.207  -5.080   7.110
  201    H    ASP  22           H        ASP  22   0.942  -2.028   3.827
  202    HA   ASP  22           HA       ASP  22   2.037  -2.855   2.069
  203    HB2  ASP  22           HB3      ASP  22   4.381  -1.468   3.374
  204    HB3  ASP  22           HB2      ASP  22   4.328  -2.043   1.714
  205    H    LYS  23           H        LYS  23   4.141  -4.167   1.436
  206    HA   LYS  23           HA       LYS  23   4.220  -6.418   3.276
  207    HB2  LYS  23           HB3      LYS  23   5.302  -7.627   1.450
  208    HB3  LYS  23           HB2      LYS  23   3.833  -6.848   0.882
  209    HG2  LYS  23           HG3      LYS  23   5.818  -4.973   0.414
  210    HG3  LYS  23           HG2      LYS  23   6.561  -6.518  -0.003
  211    HD2  LYS  23           HD3      LYS  23   4.714  -7.031  -1.493
  212    HD3  LYS  23           HD2      LYS  23   3.903  -5.533  -1.037
  213    HE2  LYS  23           HE3      LYS  23   4.949  -5.087  -3.101
  214    HE3  LYS  23           HE2      LYS  23   5.965  -4.315  -1.874
  215    HZ1  LYS  23           HZ1      LYS  23   6.469  -6.901  -3.256
  216    HZ2  LYS  23           HZ2      LYS  23   7.393  -6.324  -1.965
  217    HZ3  LYS  23           HZ3      LYS  23   7.350  -5.471  -3.424
  218    H    VAL  24           H        VAL  24   5.733  -3.623   3.013
  219    HA   VAL  24           HA       VAL  24   7.643  -2.701   3.771
  220    HB   VAL  24           HB       VAL  24   8.257  -5.338   5.115
  221   HG11  VAL  24          HG11      VAL  24  10.066  -3.716   5.181
  222   HG12  VAL  24          HG12      VAL  24   9.359  -3.910   6.785
  223   HG13  VAL  24          HG13      VAL  24   8.969  -2.489   5.817
  224   HG21  VAL  24          HG21      VAL  24   6.997  -4.522   7.046
  225   HG22  VAL  24          HG22      VAL  24   5.955  -4.706   5.636
  226   HG23  VAL  24          HG23      VAL  24   6.499  -3.102   6.128
  227    H    LEU  25           H        LEU  25   7.749  -3.514   1.224
  228    HA   LEU  25           HA       LEU  25  10.356  -4.835   0.923
  229    HB2  LEU  25           HB3      LEU  25   8.211  -5.357  -0.488
  230    HB3  LEU  25           HB2      LEU  25   8.644  -3.903  -1.360
  231    HG   LEU  25           HG       LEU  25   9.411  -5.975  -2.472
  232   HD11  LEU  25          HD11      LEU  25  11.615  -4.166  -1.509
  233   HD12  LEU  25          HD12      LEU  25  10.595  -3.924  -2.927
  234   HD13  LEU  25          HD13      LEU  25  11.728  -5.275  -2.876
  235   HD21  LEU  25          HD21      LEU  25  11.211  -7.285  -1.544
  236   HD22  LEU  25          HD22      LEU  25   9.843  -7.280  -0.432
  237   HD23  LEU  25          HD23      LEU  25  11.250  -6.269  -0.104
  238    H    ARG  26           H        ARG  26   8.655  -2.012  -0.463
  239    HA   ARG  26           HA       ARG  26  10.834  -0.323   0.389
  240    HB2  ARG  26           HB3      ARG  26  11.015   0.651  -2.004
  241    HB3  ARG  26           HB2      ARG  26  11.890  -0.815  -1.606
  242    HG2  ARG  26           HG3      ARG  26  11.017  -1.346  -3.657
  243    HG3  ARG  26           HG2      ARG  26   9.787  -2.007  -2.581
  244    HD2  ARG  26           HD3      ARG  26   8.838  -0.764  -4.487
  245    HD3  ARG  26           HD2      ARG  26   8.380  -0.080  -2.928
  246    HE   ARG  26           HE       ARG  26  10.147   1.614  -3.327
  247   HH11  ARG  26          HH11      ARG  26   8.764  -0.087  -6.065
  248   HH12  ARG  26          HH12      ARG  26   9.107   1.188  -7.185
  249   HH21  ARG  26          HH22      ARG  26  10.583   3.286  -4.795
  250   HH22  ARG  26          HH21      ARG  26  10.139   3.108  -6.465
  251    HA   PRO  27           HA       PRO  27   6.408   1.442   0.250
  252    HB2  PRO  27           HB2      PRO  27   7.053   1.874   3.118
  253    HB3  PRO  27           HB3      PRO  27   5.550   1.300   2.370
  254    HG2  PRO  27           HG3      PRO  27   7.142  -0.378   3.677
  255    HG3  PRO  27           HG2      PRO  27   6.322  -0.871   2.180
  256    HD2  PRO  27           HD3      PRO  27   9.175  -0.035   2.602
  257    HD3  PRO  27           HD2      PRO  27   8.527  -1.352   1.601
  258    H    GLN  28           H        GLN  28   5.825   3.706   0.812
  259    HA   GLN  28           HA       GLN  28   8.145   5.406   1.397
  260    HB2  GLN  28           HB3      GLN  28   7.334   7.065  -0.276
  261    HB3  GLN  28           HB2      GLN  28   7.932   5.571  -0.976
  262    HG2  GLN  28           HG3      GLN  28   5.675   4.804  -1.366
  263    HG3  GLN  28           HG2      GLN  28   5.022   6.236  -0.565
  264   HE21  GLN  28          HE22      GLN  28   4.700   5.251  -3.331
  265   HE22  GLN  28          HE21      GLN  28   5.189   6.561  -4.342
  266    H    GLY  29           H        GLY  29   5.806   4.412   2.920
  267    HA2  GLY  29           HA3      GLY  29   4.432   6.943   3.497
  268    HA3  GLY  29           HA2      GLY  29   3.907   5.349   4.019
  Start of MODEL    5
    1    H1   ARG   1           H1       ARG   1  -8.663   1.824  -3.155
    2    H2   ARG   1           H2       ARG   1  -8.205   2.845  -1.887
    3    H3   ARG   1           H3       ARG   1  -9.025   3.472  -3.222
    4    HA   ARG   1           HA       ARG   1 -10.455   3.234  -1.275
    5    HB2  ARG   1           HB3      ARG   1 -11.268   3.064  -3.668
    6    HB3  ARG   1           HB2      ARG   1 -11.228   1.318  -3.478
    7    HG2  ARG   1           HG3      ARG   1 -12.821   1.524  -1.602
    8    HG3  ARG   1           HG2      ARG   1 -12.921   3.256  -1.923
    9    HD2  ARG   1           HD3      ARG   1 -13.789   2.832  -4.135
   10    HD3  ARG   1           HD2      ARG   1 -13.582   1.094  -3.914
   11    HE   ARG   1           HE       ARG   1 -15.265   2.357  -1.943
   12   HH11  ARG   1          HH12      ARG   1 -15.155   0.841  -5.086
   13   HH12  ARG   1          HH11      ARG   1 -16.810   0.327  -5.041
   14   HH21  ARG   1          HH21      ARG   1 -17.436   1.683  -1.866
   15   HH22  ARG   1          HH22      ARG   1 -18.112   0.805  -3.202
   16    H    LYS   2           H        LYS   2  -8.178   1.418  -0.799
   17    HA   LYS   2           HA       LYS   2  -7.642  -0.319   0.552
   18    HB2  LYS   2           HB3      LYS   2 -10.511   0.057   1.411
   19    HB3  LYS   2           HB2      LYS   2  -9.377  -1.010   2.226
   20    HG2  LYS   2           HG3      LYS   2  -8.065   0.762   2.983
   21    HG3  LYS   2           HG2      LYS   2  -8.772   1.893   1.833
   22    HD2  LYS   2           HD3      LYS   2  -9.608   2.306   4.086
   23    HD3  LYS   2           HD2      LYS   2 -10.909   1.768   3.024
   24    HE2  LYS   2           HE3      LYS   2 -10.717  -0.492   3.932
   25    HE3  LYS   2           HE2      LYS   2  -9.402   0.035   4.979
   26    HZ1  LYS   2           HZ1      LYS   2 -12.195   1.034   5.072
   27    HZ2  LYS   2           HZ2      LYS   2 -10.933   1.550   6.072
   28    HZ3  LYS   2           HZ3      LYS   2 -11.493  -0.040   6.172
   29    H    CYS   3           H        CYS   3  -7.946  -1.241  -1.911
   30    HA   CYS   3           HA       CYS   3  -9.769  -3.488  -1.936
   31    HB2  CYS   3           HB3      CYS   3  -8.946  -3.922  -4.164
   32    HB3  CYS   3           HB2      CYS   3  -9.265  -2.203  -4.002
   33    H    ASN   4           H        ASN   4  -8.071  -3.612   0.223
   34    HA   ASN   4           HA       ASN   4  -6.803  -5.059   1.398
   35    HB2  ASN   4           HB3      ASN   4  -7.201  -6.797  -1.035
   36    HB3  ASN   4           HB2      ASN   4  -6.349  -7.338   0.405
   37   HD21  ASN   4          HD22      ASN   4  -8.878  -8.182  -0.912
   38   HD22  ASN   4          HD21      ASN   4 -10.067  -8.144   0.345
   39    H    PHE   5           H        PHE   5  -5.291  -6.592  -1.234
   40    HA   PHE   5           HA       PHE   5  -2.742  -5.530  -0.420
   41    HB2  PHE   5           HB3      PHE   5  -1.922  -7.145  -2.232
   42    HB3  PHE   5           HB2      PHE   5  -2.722  -7.847  -0.833
   43    HD1  PHE   5           HD1      PHE   5  -4.956  -8.813  -1.034
   44    HD2  PHE   5           HD2      PHE   5  -2.924  -7.225  -4.412
   45    HE1  PHE   5           HE1      PHE   5  -6.535  -9.969  -2.518
   46    HE2  PHE   5           HE2      PHE   5  -4.499  -8.381  -5.904
   47    HZ   PHE   5           HZ       PHE   5  -6.333  -9.747  -4.935
   48    H    LEU   6           H        LEU   6  -1.225  -4.528  -1.847
   49    HA   LEU   6           HA       LEU   6  -0.699  -2.699  -3.059
   50    HB2  LEU   6           HB3      LEU   6  -2.489  -4.079  -5.064
   51    HB3  LEU   6           HB2      LEU   6  -1.438  -2.730  -5.439
   52    HG   LEU   6           HG       LEU   6  -0.236  -4.565  -6.193
   53   HD11  LEU   6          HD11      LEU   6   0.749  -4.193  -3.375
   54   HD12  LEU   6          HD12      LEU   6   1.137  -3.158  -4.749
   55   HD13  LEU   6          HD13      LEU   6   1.670  -4.838  -4.734
   56   HD21  LEU   6          HD21      LEU   6  -1.582  -6.344  -5.370
   57   HD22  LEU   6          HD22      LEU   6  -1.095  -6.016  -3.708
   58   HD23  LEU   6          HD23      LEU   6   0.080  -6.637  -4.865
   59    H    CYS   7           H        CYS   7  -2.643  -2.203  -1.219
   60    HA   CYS   7           HA       CYS   7  -4.065   0.018  -2.370
   61    HB2  CYS   7           HB3      CYS   7  -5.407  -2.523  -1.944
   62    HB3  CYS   7           HB2      CYS   7  -6.160  -1.218  -1.036
   63    H    LYS   8           H        LYS   8  -3.696  -2.085   0.466
   64    HA   LYS   8           HA       LYS   8  -2.998   0.239   2.038
   65    HB2  LYS   8           HB3      LYS   8  -5.449   0.145   2.324
   66    HB3  LYS   8           HB2      LYS   8  -5.315  -1.521   2.875
   67    HG2  LYS   8           HG3      LYS   8  -4.097  -0.837   4.829
   68    HG3  LYS   8           HG2      LYS   8  -4.029   0.827   4.252
   69    HD2  LYS   8           HD3      LYS   8  -5.733   0.640   5.941
   70    HD3  LYS   8           HD2      LYS   8  -6.496   0.931   4.381
   71    HE2  LYS   8           HE3      LYS   8  -7.702  -0.756   5.658
   72    HE3  LYS   8           HE2      LYS   8  -7.024  -1.436   4.182
   73    HZ1  LYS   8           HZ1      LYS   8  -5.913  -1.718   6.925
   74    HZ2  LYS   8           HZ2      LYS   8  -5.188  -2.326   5.525
   75    HZ3  LYS   8           HZ3      LYS   8  -6.682  -2.927   6.031
   76    H    LEU   9           H        LEU   9  -3.444  -3.188   1.735
   77    HA   LEU   9           HA       LEU   9  -1.921  -3.907   4.048
   78    HB2  LEU   9           HB3      LEU   9  -3.088  -5.404   1.735
   79    HB3  LEU   9           HB2      LEU   9  -1.904  -6.190   2.761
   80    HG   LEU   9           HG       LEU   9  -3.376  -5.794   4.720
   81   HD11  LEU   9          HD11      LEU   9  -5.722  -5.164   4.317
   82   HD12  LEU   9          HD12      LEU   9  -5.311  -4.779   2.646
   83   HD13  LEU   9          HD13      LEU   9  -4.596  -3.853   3.966
   84   HD21  LEU   9          HD21      LEU   9  -3.431  -7.912   3.520
   85   HD22  LEU   9          HD22      LEU   9  -4.660  -7.271   2.428
   86   HD23  LEU   9          HD23      LEU   9  -5.027  -7.490   4.139
   87    H    LYS  10           H        LYS  10  -1.265  -4.844   0.684
   88    HA   LYS  10           HA       LYS  10   1.540  -4.122   1.105
   89    HB2  LYS  10           HB3      LYS  10   0.189  -5.611  -1.152
   90    HB3  LYS  10           HB2      LYS  10   1.894  -5.183  -1.140
   91    HG2  LYS  10           HG3      LYS  10   2.147  -6.501   0.946
   92    HG3  LYS  10           HG2      LYS  10   0.475  -7.010   0.762
   93    HD2  LYS  10           HD3      LYS  10   2.699  -7.511  -1.210
   94    HD3  LYS  10           HD2      LYS  10   2.028  -8.700  -0.097
   95    HE2  LYS  10           HE3      LYS  10  -0.150  -8.491  -1.195
   96    HE3  LYS  10           HE2      LYS  10   0.523  -7.300  -2.304
   97    HZ1  LYS  10           HZ1      LYS  10   1.993  -8.957  -3.192
   98    HZ2  LYS  10           HZ2      LYS  10   0.405  -9.537  -3.260
   99    HZ3  LYS  10           HZ3      LYS  10   1.462 -10.102  -2.069
  100    H    GLU  11           H        GLU  11   2.519  -3.150  -1.017
  101    HA   GLU  11           HA       GLU  11   0.710  -1.185  -2.144
  102    HB2  GLU  11           HB3      GLU  11   1.923   0.728  -1.508
  103    HB3  GLU  11           HB2      GLU  11   1.680  -0.214  -0.049
  104    HG2  GLU  11           HG3      GLU  11   3.837   0.294   0.242
  105    HG3  GLU  11           HG2      GLU  11   4.068  -1.149  -0.735
  106    H    LYS  12           H        LYS  12   2.188   0.353  -3.607
  107    HA   LYS  12           HA       LYS  12   4.014  -1.241  -5.168
  108    HB2  LYS  12           HB3      LYS  12   2.382  -0.684  -7.212
  109    HB3  LYS  12           HB2      LYS  12   2.265  -2.174  -6.286
  110    HG2  LYS  12           HG3      LYS  12   0.069  -1.246  -6.652
  111    HG3  LYS  12           HG2      LYS  12   0.470  -1.208  -4.939
  112    HD2  LYS  12           HD3      LYS  12  -0.567   0.847  -5.401
  113    HD3  LYS  12           HD2      LYS  12   1.155   1.209  -5.293
  114    HE2  LYS  12           HE3      LYS  12   0.266   2.383  -7.176
  115    HE3  LYS  12           HE2      LYS  12   1.254   1.060  -7.787
  116    HZ1  LYS  12           HZ1      LYS  12  -1.696   0.912  -7.505
  117    HZ2  LYS  12           HZ2      LYS  12  -0.689  -0.193  -8.292
  118    HZ3  LYS  12           HZ3      LYS  12  -0.914   1.353  -8.937
  119    H    LEU  13           H        LEU  13   4.775   0.931  -3.950
  120    HA   LEU  13           HA       LEU  13   5.846   2.916  -4.237
  121    HB2  LEU  13           HB3      LEU  13   6.195   1.747  -6.605
  122    HB3  LEU  13           HB2      LEU  13   5.159   3.052  -7.139
  123    HG   LEU  13           HG       LEU  13   7.769   3.447  -5.671
  124   HD11  LEU  13          HD11      LEU  13   8.671   4.116  -7.843
  125   HD12  LEU  13          HD12      LEU  13   7.150   3.661  -8.612
  126   HD13  LEU  13          HD13      LEU  13   8.152   2.430  -7.844
  127   HD21  LEU  13          HD21      LEU  13   6.204   5.300  -5.394
  128   HD22  LEU  13          HD22      LEU  13   6.001   5.396  -7.142
  129   HD23  LEU  13          HD23      LEU  13   7.565   5.764  -6.416
  130    H    ARG  14           H        ARG  14   3.758   3.452  -3.012
  131    HA   ARG  14           HA       ARG  14   2.241   5.422  -4.595
  132    HB2  ARG  14           HB3      ARG  14   1.366   3.491  -2.535
  133    HB3  ARG  14           HB2      ARG  14   0.580   5.060  -2.554
  134    HG2  ARG  14           HG3      ARG  14   0.774   3.232  -4.933
  135    HG3  ARG  14           HG2      ARG  14  -0.607   3.317  -3.838
  136    HD2  ARG  14           HD3      ARG  14  -0.808   5.738  -4.390
  137    HD3  ARG  14           HD2      ARG  14   0.452   5.518  -5.604
  138    HE   ARG  14           HE       ARG  14  -1.310   3.651  -6.328
  139   HH11  ARG  14          HH11      ARG  14  -1.762   7.020  -5.509
  140   HH12  ARG  14          HH12      ARG  14  -3.162   7.203  -6.514
  141   HH21  ARG  14          HH22      ARG  14  -3.148   3.883  -7.646
  142   HH22  ARG  14          HH21      ARG  14  -3.947   5.423  -7.737
  143    H    THR  15           H        THR  15   1.918   5.236  -1.105
  144    HA   THR  15           HA       THR  15   3.641   7.251  -0.405
  145    HB   THR  15           HB       THR  15   2.491   8.623  -2.029
  146    HG1  THR  15           HG1      THR  15   2.188  10.406  -0.664
  147   HG21  THR  15          HG21      THR  15   0.035   8.256  -0.321
  148   HG22  THR  15          HG22      THR  15   0.263   7.678  -1.972
  149   HG23  THR  15          HG23      THR  15   0.193   9.411  -1.645
  150    H    VAL  16           H        VAL  16   0.172   6.459   0.270
  151    HA   VAL  16           HA       VAL  16   0.879   6.576   3.113
  152    HB   VAL  16           HB       VAL  16  -1.435   8.125   1.944
  153   HG11  VAL  16          HG11      VAL  16  -1.833   7.074   4.173
  154   HG12  VAL  16          HG12      VAL  16  -1.916   8.837   4.176
  155   HG13  VAL  16          HG13      VAL  16  -0.482   8.022   4.802
  156   HG21  VAL  16          HG21      VAL  16   0.688   9.244   1.524
  157   HG22  VAL  16          HG22      VAL  16   1.122   9.092   3.227
  158   HG23  VAL  16          HG23      VAL  16  -0.235  10.114   2.750
  159    H    ILE  17           H        ILE  17  -2.172   6.283   1.212
  160    HA   ILE  17           HA       ILE  17  -3.227   4.496   3.167
  161    HB   ILE  17           HB       ILE  17  -4.873   5.745   2.046
  162   HG12  ILE  17          HG13      ILE  17  -6.303   4.047   0.946
  163   HG13  ILE  17          HG12      ILE  17  -4.932   2.953   0.883
  164   HG21  ILE  17          HG21      ILE  17  -5.207   5.761  -0.373
  165   HG22  ILE  17          HG22      ILE  17  -3.785   4.739  -0.573
  166   HG23  ILE  17          HG23      ILE  17  -3.614   6.371   0.071
  167   HD11  ILE  17          HD11      ILE  17  -4.877   3.230   3.440
  168   HD12  ILE  17          HD12      ILE  17  -6.132   2.221   2.715
  169   HD13  ILE  17          HD13      ILE  17  -6.513   3.862   3.248
  170    H    THR  18           H        THR  18  -2.059   4.049  -0.137
  171    HA   THR  18           HA       THR  18  -2.333   1.257  -0.203
  172    HB   THR  18           HB       THR  18  -0.170   2.751  -1.657
  173    HG1  THR  18           HG1      THR  18  -2.893   2.620  -2.493
  174   HG21  THR  18          HG21      THR  18  -2.008   0.524  -2.533
  175   HG22  THR  18          HG22      THR  18  -0.386   0.289  -1.889
  176   HG23  THR  18          HG23      THR  18  -0.611   1.155  -3.405
  177    H    SER  19           H        SER  19   0.512   3.318   0.392
  178    HA   SER  19           HA       SER  19   1.910   1.080   1.599
  179    HB2  SER  19           HB3      SER  19   3.102   2.697   0.142
  180    HB3  SER  19           HB2      SER  19   2.764   3.972   1.318
  181    HG   SER  19           HG       SER  19   4.414   1.674   1.601
  182    H    HIS  20           H        HIS  20  -0.227   1.332   3.048
  183    HA   HIS  20           HA       HIS  20   0.276   3.042   5.351
  184    HB2  HIS  20           HB3      HIS  20  -2.042   2.740   4.389
  185    HB3  HIS  20           HB2      HIS  20  -1.985   1.071   4.939
  186    HD1  HIS  20           HD1      HIS  20  -3.045   4.351   5.980
  187    HD2  HIS  20           HD2      HIS  20  -1.639   0.937   7.893
  188    HE1  HIS  20           HE1      HIS  20  -3.761   4.575   8.378
  189    HE2  HIS  20           HE2      HIS  20  -2.730   2.599   9.548
  190    H    ILE  21           H        ILE  21  -0.510  -0.405   4.859
  191    HA   ILE  21           HA       ILE  21   1.108  -1.123   7.173
  192    HB   ILE  21           HB       ILE  21  -0.380  -2.907   5.230
  193   HG12  ILE  21          HG13      ILE  21  -1.176  -2.001   8.007
  194   HG13  ILE  21          HG12      ILE  21  -1.866  -1.384   6.510
  195   HG21  ILE  21          HG21      ILE  21   1.440  -4.064   6.356
  196   HG22  ILE  21          HG22      ILE  21  -0.119  -4.636   6.949
  197   HG23  ILE  21          HG23      ILE  21   0.839  -3.518   7.921
  198   HD11  ILE  21          HD11      ILE  21  -2.737  -3.598   5.993
  199   HD12  ILE  21          HD12      ILE  21  -3.319  -3.029   7.556
  200   HD13  ILE  21          HD13      ILE  21  -2.029  -4.229   7.481
  201    H    ASP  22           H        ASP  22   0.996  -1.429   3.705
  202    HA   ASP  22           HA       ASP  22   2.569  -1.585   2.098
  203    HB2  ASP  22           HB3      ASP  22   3.924  -0.118   3.725
  204    HB3  ASP  22           HB2      ASP  22   4.729  -1.585   4.207
  205    H    LYS  23           H        LYS  23   4.199  -3.087   1.242
  206    HA   LYS  23           HA       LYS  23   3.683  -5.753   2.096
  207    HB2  LYS  23           HB3      LYS  23   5.550  -6.249   0.360
  208    HB3  LYS  23           HB2      LYS  23   3.999  -5.648  -0.195
  209    HG2  LYS  23           HG3      LYS  23   5.509  -4.417  -1.435
  210    HG3  LYS  23           HG2      LYS  23   5.125  -3.323  -0.109
  211    HD2  LYS  23           HD3      LYS  23   7.172  -4.115   1.056
  212    HD3  LYS  23           HD2      LYS  23   7.571  -5.063  -0.377
  213    HE2  LYS  23           HE3      LYS  23   7.573  -2.972  -1.700
  214    HE3  LYS  23           HE2      LYS  23   7.297  -2.058  -0.213
  215    HZ1  LYS  23           HZ1      LYS  23   9.386  -2.940   0.649
  216    HZ2  LYS  23           HZ2      LYS  23   9.640  -2.105  -0.799
  217    HZ3  LYS  23           HZ3      LYS  23   9.642  -3.793  -0.788
  218    H    VAL  24           H        VAL  24   6.273  -3.408   2.585
  219    HA   VAL  24           HA       VAL  24   7.391  -4.962   4.747
  220    HB   VAL  24           HB       VAL  24   9.369  -4.462   2.515
  221   HG11  VAL  24          HG11      VAL  24  10.292  -4.684   4.744
  222   HG12  VAL  24          HG12      VAL  24  10.739  -6.077   3.759
  223   HG13  VAL  24          HG13      VAL  24   9.457  -6.222   4.962
  224   HG21  VAL  24          HG21      VAL  24   9.352  -6.851   1.979
  225   HG22  VAL  24          HG22      VAL  24   7.810  -6.085   1.600
  226   HG23  VAL  24          HG23      VAL  24   7.969  -7.077   3.049
  227    H    LEU  25           H        LEU  25   6.335  -2.286   3.947
  228    HA   LEU  25           HA       LEU  25   6.569  -0.138   4.604
  229    HB2  LEU  25           HB3      LEU  25   7.323  -1.075   6.735
  230    HB3  LEU  25           HB2      LEU  25   8.964  -1.159   6.129
  231    HG   LEU  25           HG       LEU  25   8.997   1.315   5.952
  232   HD11  LEU  25          HD11      LEU  25   6.626   1.722   5.677
  233   HD12  LEU  25          HD12      LEU  25   7.237   2.598   7.079
  234   HD13  LEU  25          HD13      LEU  25   6.311   1.113   7.300
  235   HD21  LEU  25          HD21      LEU  25   8.301   0.222   8.675
  236   HD22  LEU  25          HD22      LEU  25   9.135   1.743   8.358
  237   HD23  LEU  25          HD23      LEU  25   9.897   0.213   7.926
  238    H    ARG  26           H        ARG  26   7.044   0.179   2.278
  239    HA   ARG  26           HA       ARG  26   9.504   1.725   2.110
  240    HB2  ARG  26           HB3      ARG  26  10.277  -0.192   1.042
  241    HB3  ARG  26           HB2      ARG  26   8.705  -0.589   0.383
  242    HG2  ARG  26           HG3      ARG  26   9.796   1.869  -0.719
  243    HG3  ARG  26           HG2      ARG  26  10.827   0.458  -0.994
  244    HD2  ARG  26           HD3      ARG  26   8.906  -0.771  -1.882
  245    HD3  ARG  26           HD2      ARG  26   7.877   0.639  -1.605
  246    HE   ARG  26           HE       ARG  26  10.076   1.362  -3.230
  247   HH11  ARG  26          HH11      ARG  26   7.005  -0.309  -3.356
  248   HH12  ARG  26          HH12      ARG  26   6.908  -0.266  -5.088
  249   HH21  ARG  26          HH22      ARG  26   9.927   1.449  -5.518
  250   HH22  ARG  26          HH21      ARG  26   8.556   0.742  -6.315
  251    HA   PRO  27           HA       PRO  27   5.462   3.697   0.809
  252    HB2  PRO  27           HB2      PRO  27   6.506   5.903   2.497
  253    HB3  PRO  27           HB3      PRO  27   4.890   5.171   2.467
  254    HG2  PRO  27           HG3      PRO  27   6.547   4.675   4.483
  255    HG3  PRO  27           HG2      PRO  27   5.533   3.380   3.797
  256    HD2  PRO  27           HD3      PRO  27   8.446   3.975   3.294
  257    HD3  PRO  27           HD2      PRO  27   7.665   2.414   3.634
  258    H    GLN  28           H        GLN  28   5.317   4.850  -0.971
  259    HA   GLN  28           HA       GLN  28   5.621   6.457  -2.541
  260    HB2  GLN  28           HB3      GLN  28   7.675   7.582  -0.630
  261    HB3  GLN  28           HB2      GLN  28   7.027   8.409  -2.042
  262    HG2  GLN  28           HG3      GLN  28   4.892   8.589  -1.092
  263    HG3  GLN  28           HG2      GLN  28   5.264   7.410   0.168
  264   HE21  GLN  28          HE22      GLN  28   4.225  10.108   0.403
  265   HE22  GLN  28          HE21      GLN  28   5.351  10.974   1.393
  266    H    GLY  29           H        GLY  29   7.506   4.021  -2.014
  267    HA2  GLY  29           HA3      GLY  29   8.644   3.006  -3.839
  268    HA3  GLY  29           HA2      GLY  29   9.089   4.605  -4.412
  Start of MODEL    6
    1    H1   ARG   1           H1       ARG   1 -11.175   0.774   4.173
    2    H2   ARG   1           H2       ARG   1 -12.580   1.319   4.935
    3    H3   ARG   1           H3       ARG   1 -11.632   2.396   4.043
    4    HA   ARG   1           HA       ARG   1 -13.103   0.077   2.941
    5    HB2  ARG   1           HB3      ARG   1 -13.661   3.047   2.838
    6    HB3  ARG   1           HB2      ARG   1 -14.451   1.873   1.797
    7    HG2  ARG   1           HG3      ARG   1 -15.478   0.805   3.676
    8    HG3  ARG   1           HG2      ARG   1 -14.559   1.806   4.801
    9    HD2  ARG   1           HD3      ARG   1 -16.837   2.624   4.586
   10    HD3  ARG   1           HD2      ARG   1 -15.688   3.798   3.954
   11    HE   ARG   1           HE       ARG   1 -16.768   2.051   1.940
   12   HH11  ARG   1          HH12      ARG   1 -17.253   5.017   3.739
   13   HH12  ARG   1          HH11      ARG   1 -18.322   5.709   2.561
   14   HH21  ARG   1          HH21      ARG   1 -18.197   2.963   0.389
   15   HH22  ARG   1          HH22      ARG   1 -18.866   4.538   0.668
   16    H    LYS   2           H        LYS   2 -11.211  -0.609   1.891
   17    HA   LYS   2           HA       LYS   2 -10.612   0.893  -0.532
   18    HB2  LYS   2           HB3      LYS   2  -8.543   0.016   1.492
   19    HB3  LYS   2           HB2      LYS   2  -8.142   0.390  -0.179
   20    HG2  LYS   2           HG3      LYS   2  -9.517   2.340   1.651
   21    HG3  LYS   2           HG2      LYS   2  -7.762   2.237   1.485
   22    HD2  LYS   2           HD3      LYS   2  -7.851   2.855  -0.801
   23    HD3  LYS   2           HD2      LYS   2  -9.597   2.626  -0.870
   24    HE2  LYS   2           HE3      LYS   2  -8.275   4.692   0.871
   25    HE3  LYS   2           HE2      LYS   2  -8.803   5.018  -0.778
   26    HZ1  LYS   2           HZ1      LYS   2 -11.049   4.487  -0.150
   27    HZ2  LYS   2           HZ2      LYS   2 -10.448   5.676   0.891
   28    HZ3  LYS   2           HZ3      LYS   2 -10.568   4.073   1.414
   29    H    CYS   3           H        CYS   3  -8.799  -0.662  -1.715
   30    HA   CYS   3           HA       CYS   3 -10.285  -2.955  -2.430
   31    HB2  CYS   3           HB3      CYS   3  -7.421  -2.989  -3.110
   32    HB3  CYS   3           HB2      CYS   3  -8.828  -3.093  -4.161
   33    H    ASN   4           H        ASN   4  -6.898  -3.140  -1.524
   34    HA   ASN   4           HA       ASN   4  -6.992  -4.562   0.820
   35    HB2  ASN   4           HB3      ASN   4  -6.470  -6.905  -0.048
   36    HB3  ASN   4           HB2      ASN   4  -8.147  -6.398  -0.156
   37   HD21  ASN   4          HD22      ASN   4  -8.483  -7.997  -1.736
   38   HD22  ASN   4          HD21      ASN   4  -7.954  -7.778  -3.369
   39    H    PHE   5           H        PHE   5  -4.994  -6.474  -0.962
   40    HA   PHE   5           HA       PHE   5  -2.629  -5.049  -0.311
   41    HB2  PHE   5           HB3      PHE   5  -1.586  -6.799  -1.879
   42    HB3  PHE   5           HB2      PHE   5  -2.357  -7.371  -0.409
   43    HD1  PHE   5           HD2      PHE   5  -2.748  -7.068  -4.066
   44    HD2  PHE   5           HD1      PHE   5  -4.260  -8.782  -0.480
   45    HE1  PHE   5           HE2      PHE   5  -4.183  -8.562  -5.389
   46    HE2  PHE   5           HE1      PHE   5  -5.697 -10.278  -1.798
   47    HZ   PHE   5           HZ       PHE   5  -5.663 -10.167  -4.254
   48    H    LEU   6           H        LEU   6  -1.063  -4.193  -1.806
   49    HA   LEU   6           HA       LEU   6  -0.437  -2.741  -3.429
   50    HB2  LEU   6           HB3      LEU   6  -2.340  -4.480  -4.976
   51    HB3  LEU   6           HB2      LEU   6  -1.588  -3.089  -5.727
   52    HG   LEU   6           HG       LEU   6  -0.360  -5.066  -6.326
   53   HD11  LEU   6          HD11      LEU   6   1.205  -3.518  -4.272
   54   HD12  LEU   6          HD12      LEU   6   0.917  -3.009  -5.937
   55   HD13  LEU   6          HD13      LEU   6   1.861  -4.461  -5.608
   56   HD21  LEU   6          HD21      LEU   6  -0.953  -6.556  -4.543
   57   HD22  LEU   6          HD22      LEU   6  -0.100  -5.557  -3.369
   58   HD23  LEU   6          HD23      LEU   6   0.803  -6.421  -4.614
   59    H    CYS   7           H        CYS   7  -2.568  -2.033  -1.607
   60    HA   CYS   7           HA       CYS   7  -3.762   0.168  -3.043
   61    HB2  CYS   7           HB3      CYS   7  -5.299  -1.635  -3.650
   62    HB3  CYS   7           HB2      CYS   7  -5.515  -2.048  -1.956
   63    H    LYS   8           H        LYS   8  -3.274  -1.648  -0.112
   64    HA   LYS   8           HA       LYS   8  -3.077   0.671   1.509
   65    HB2  LYS   8           HB3      LYS   8  -5.523   0.613   1.360
   66    HB3  LYS   8           HB2      LYS   8  -5.528  -1.066   1.884
   67    HG2  LYS   8           HG3      LYS   8  -4.453  -0.287   4.019
   68    HG3  LYS   8           HG2      LYS   8  -4.779   1.362   3.484
   69    HD2  LYS   8           HD3      LYS   8  -7.180   0.782   3.306
   70    HD3  LYS   8           HD2      LYS   8  -6.812  -0.815   3.960
   71    HE2  LYS   8           HE3      LYS   8  -5.869   0.315   5.975
   72    HE3  LYS   8           HE2      LYS   8  -6.452   1.844   5.321
   73    HZ1  LYS   8           HZ1      LYS   8  -8.704   0.954   5.370
   74    HZ2  LYS   8           HZ2      LYS   8  -8.010   0.939   6.909
   75    HZ3  LYS   8           HZ3      LYS   8  -8.135  -0.495   6.027
   76    H    LEU   9           H        LEU   9  -3.754  -2.739   1.367
   77    HA   LEU   9           HA       LEU   9  -2.619  -3.398   3.920
   78    HB2  LEU   9           HB3      LEU   9  -3.742  -4.923   1.601
   79    HB3  LEU   9           HB2      LEU   9  -2.862  -5.774   2.860
   80    HG   LEU   9           HG       LEU   9  -4.481  -4.992   4.537
   81   HD11  LEU   9          HD11      LEU   9  -6.589  -3.949   3.784
   82   HD12  LEU   9          HD12      LEU   9  -5.877  -3.730   2.186
   83   HD13  LEU   9          HD13      LEU   9  -5.185  -2.905   3.581
   84   HD21  LEU   9          HD21      LEU   9  -6.381  -6.342   3.780
   85   HD22  LEU   9          HD22      LEU   9  -4.838  -7.131   3.464
   86   HD23  LEU   9          HD23      LEU   9  -5.714  -6.350   2.148
   87    H    LYS  10           H        LYS  10  -1.759  -3.843   0.552
   88    HA   LYS  10           HA       LYS  10   1.052  -3.947   1.348
   89    HB2  LYS  10           HB3      LYS  10   0.337  -6.160   0.580
   90    HB3  LYS  10           HB2      LYS  10  -0.310  -5.463  -0.892
   91    HG2  LYS  10           HG3      LYS  10   1.772  -5.145  -1.815
   92    HG3  LYS  10           HG2      LYS  10   2.575  -5.123  -0.245
   93    HD2  LYS  10           HD3      LYS  10   2.977  -7.190  -1.622
   94    HD3  LYS  10           HD2      LYS  10   2.348  -7.480  -0.001
   95    HE2  LYS  10           HE3      LYS  10   0.104  -7.754  -0.918
   96    HE3  LYS  10           HE2      LYS  10   0.715  -7.438  -2.537
   97    HZ1  LYS  10           HZ1      LYS  10   1.349  -9.751  -0.796
   98    HZ2  LYS  10           HZ2      LYS  10   2.170  -9.416  -2.236
   99    HZ3  LYS  10           HZ3      LYS  10   0.518  -9.769  -2.267
  100    H    GLU  11           H        GLU  11   2.461  -3.030  -0.450
  101    HA   GLU  11           HA       GLU  11   0.972  -0.934  -1.869
  102    HB2  GLU  11           HB3      GLU  11   1.955  -0.214   0.370
  103    HB3  GLU  11           HB2      GLU  11   3.534  -0.454  -0.349
  104    HG2  GLU  11           HG3      GLU  11   2.145   1.195  -2.131
  105    HG3  GLU  11           HG2      GLU  11   1.771   1.801  -0.521
  106    H    LYS  12           H        LYS  12   3.316   0.377  -2.832
  107    HA   LYS  12           HA       LYS  12   4.998  -1.238  -4.345
  108    HB2  LYS  12           HB3      LYS  12   3.919  -1.331  -6.492
  109    HB3  LYS  12           HB2      LYS  12   2.807  -2.013  -5.327
  110    HG2  LYS  12           HG3      LYS  12   2.638   0.818  -6.242
  111    HG3  LYS  12           HG2      LYS  12   1.882  -0.509  -7.115
  112    HD2  LYS  12           HD3      LYS  12   0.681  -1.089  -4.981
  113    HD3  LYS  12           HD2      LYS  12   1.289   0.443  -4.314
  114    HE2  LYS  12           HE3      LYS  12  -0.822   0.968  -5.207
  115    HE3  LYS  12           HE2      LYS  12   0.377   1.512  -6.381
  116    HZ1  LYS  12           HZ1      LYS  12  -1.139  -1.024  -6.585
  117    HZ2  LYS  12           HZ2      LYS  12  -0.033  -0.426  -7.715
  118    HZ3  LYS  12           HZ3      LYS  12  -1.490   0.386  -7.446
  119    H    LEU  13           H        LEU  13   4.989   1.150  -2.902
  120    HA   LEU  13           HA       LEU  13   5.463   3.306  -2.817
  121    HB2  LEU  13           HB3      LEU  13   6.987   4.297  -4.344
  122    HB3  LEU  13           HB2      LEU  13   7.451   2.632  -4.096
  123    HG   LEU  13           HG       LEU  13   6.067   2.349  -6.381
  124   HD11  LEU  13          HD11      LEU  13   7.231   5.126  -6.529
  125   HD12  LEU  13          HD12      LEU  13   5.516   4.716  -6.571
  126   HD13  LEU  13          HD13      LEU  13   6.577   4.203  -7.882
  127   HD21  LEU  13          HD21      LEU  13   8.356   1.621  -5.941
  128   HD22  LEU  13          HD22      LEU  13   8.926   3.272  -6.176
  129   HD23  LEU  13          HD23      LEU  13   8.211   2.386  -7.522
  130    H    ARG  14           H        ARG  14   3.844   4.602  -2.601
  131    HA   ARG  14           HA       ARG  14   2.649   5.716  -5.013
  132    HB2  ARG  14           HB3      ARG  14   1.104   3.941  -4.356
  133    HB3  ARG  14           HB2      ARG  14   0.987   4.625  -2.739
  134    HG2  ARG  14           HG3      ARG  14  -0.957   5.245  -4.016
  135    HG3  ARG  14           HG2      ARG  14   0.020   6.679  -3.704
  136    HD2  ARG  14           HD3      ARG  14  -0.592   6.878  -5.951
  137    HD3  ARG  14           HD2      ARG  14   1.051   6.251  -6.007
  138    HE   ARG  14           HE       ARG  14  -1.304   4.503  -6.286
  139   HH11  ARG  14          HH11      ARG  14   1.855   5.574  -7.386
  140   HH12  ARG  14          HH12      ARG  14   1.908   4.445  -8.698
  141   HH21  ARG  14          HH22      ARG  14  -1.225   3.037  -8.014
  142   HH22  ARG  14          HH21      ARG  14   0.166   2.990  -9.049
  143    H    THR  15           H        THR  15   1.663   6.088  -1.573
  144    HA   THR  15           HA       THR  15   2.714   8.753  -1.450
  145    HB   THR  15           HB       THR  15  -0.264   8.456  -1.864
  146    HG1  THR  15           HG1      THR  15   1.807   8.962  -3.552
  147   HG21  THR  15          HG21      THR  15   1.392  10.901  -1.248
  148   HG22  THR  15          HG22      THR  15   0.183  10.158  -0.204
  149   HG23  THR  15          HG23      THR  15  -0.308  10.919  -1.714
  150    H    VAL  16           H        VAL  16  -0.028   6.822  -0.070
  151    HA   VAL  16           HA       VAL  16   0.779   7.390   2.617
  152    HB   VAL  16           HB       VAL  16  -1.500   8.995   1.465
  153   HG11  VAL  16          HG11      VAL  16  -2.386   7.853   3.431
  154   HG12  VAL  16          HG12      VAL  16  -2.158   9.569   3.762
  155   HG13  VAL  16          HG13      VAL  16  -1.002   8.392   4.382
  156   HG21  VAL  16          HG21      VAL  16   0.790   9.979   1.578
  157   HG22  VAL  16          HG22      VAL  16   0.736   9.785   3.328
  158   HG23  VAL  16          HG23      VAL  16  -0.410  10.857   2.523
  159    H    ILE  17           H        ILE  17  -2.381   6.849   0.940
  160    HA   ILE  17           HA       ILE  17  -3.277   5.143   3.038
  161    HB   ILE  17           HB       ILE  17  -5.033   6.205   1.933
  162   HG12  ILE  17          HG13      ILE  17  -6.360   4.375   0.850
  163   HG13  ILE  17          HG12      ILE  17  -4.922   3.367   0.896
  164   HG21  ILE  17          HG21      ILE  17  -3.932   5.222  -0.688
  165   HG22  ILE  17          HG22      ILE  17  -3.898   6.878  -0.084
  166   HG23  ILE  17          HG23      ILE  17  -5.436   6.118  -0.482
  167   HD11  ILE  17          HD11      ILE  17  -4.932   3.726   3.404
  168   HD12  ILE  17          HD12      ILE  17  -6.214   2.712   2.732
  169   HD13  ILE  17          HD13      ILE  17  -6.554   4.384   3.193
  170    H    THR  18           H        THR  18  -2.415   4.401  -0.347
  171    HA   THR  18           HA       THR  18  -2.328   1.607  -0.025
  172    HB   THR  18           HB       THR  18  -0.625   3.301  -1.874
  173    HG1  THR  18           HG1      THR  18  -3.343   2.655  -1.858
  174   HG21  THR  18          HG21      THR  18  -1.629   0.465  -2.163
  175   HG22  THR  18          HG22      THR  18   0.016   0.921  -1.722
  176   HG23  THR  18          HG23      THR  18  -0.619   1.342  -3.310
  177    H    SER  19           H        SER  19  -0.099   4.173   0.398
  178    HA   SER  19           HA       SER  19   2.198   2.700   1.163
  179    HB2  SER  19           HB3      SER  19   1.426   5.601   1.491
  180    HB3  SER  19           HB2      SER  19   3.053   4.966   1.603
  181    HG   SER  19           HG       SER  19   2.806   4.215  -0.572
  182    H    HIS  20           H        HIS  20  -0.309   2.248   2.798
  183    HA   HIS  20           HA       HIS  20   0.308   3.382   5.392
  184    HB2  HIS  20           HB3      HIS  20  -2.042   3.065   4.765
  185    HB3  HIS  20           HB2      HIS  20  -1.771   1.340   4.552
  186    HD1  HIS  20           HD1      HIS  20  -2.750   0.082   6.430
  187    HD2  HIS  20           HD2      HIS  20  -1.179   3.727   7.673
  188    HE1  HIS  20           HE1      HIS  20  -3.146   0.180   8.912
  189    HE2  HIS  20           HE2      HIS  20  -2.285   2.439   9.625
  190    H    ILE  21           H        ILE  21  -0.116   0.089   4.171
  191    HA   ILE  21           HA       ILE  21   2.384  -0.673   5.475
  192    HB   ILE  21           HB       ILE  21   0.769  -1.511   7.027
  193   HG12  ILE  21          HG13      ILE  21   1.014  -3.985   6.796
  194   HG13  ILE  21          HG12      ILE  21   1.659  -3.730   5.179
  195   HG21  ILE  21          HG21      ILE  21  -1.107  -2.947   6.394
  196   HG22  ILE  21          HG22      ILE  21  -0.710  -2.694   4.693
  197   HG23  ILE  21          HG23      ILE  21  -1.228  -1.333   5.689
  198   HD11  ILE  21          HD11      ILE  21   3.430  -4.098   6.790
  199   HD12  ILE  21          HD12      ILE  21   2.868  -2.724   7.742
  200   HD13  ILE  21          HD13      ILE  21   3.517  -2.470   6.123
  201    H    ASP  22           H        ASP  22   3.579  -2.129   4.238
  202    HA   ASP  22           HA       ASP  22   2.432  -2.588   1.567
  203    HB2  ASP  22           HB3      ASP  22   4.516  -2.023   0.563
  204    HB3  ASP  22           HB2      ASP  22   4.217  -0.783   1.764
  205    H    LYS  23           H        LYS  23   4.697  -3.984   0.598
  206    HA   LYS  23           HA       LYS  23   4.282  -6.589   1.693
  207    HB2  LYS  23           HB3      LYS  23   6.015  -7.296   0.032
  208    HB3  LYS  23           HB2      LYS  23   4.647  -6.454  -0.672
  209    HG2  LYS  23           HG3      LYS  23   7.189  -4.998  -0.026
  210    HG3  LYS  23           HG2      LYS  23   7.013  -5.915  -1.521
  211    HD2  LYS  23           HD3      LYS  23   4.894  -4.551  -1.919
  212    HD3  LYS  23           HD2      LYS  23   5.444  -3.513  -0.610
  213    HE2  LYS  23           HE3      LYS  23   6.116  -2.557  -2.702
  214    HE3  LYS  23           HE2      LYS  23   7.540  -3.118  -1.830
  215    HZ1  LYS  23           HZ1      LYS  23   7.598  -3.691  -4.197
  216    HZ2  LYS  23           HZ2      LYS  23   6.187  -4.604  -4.019
  217    HZ3  LYS  23           HZ3      LYS  23   7.603  -5.073  -3.226
  218    H    VAL  24           H        VAL  24   5.618  -4.259   3.172
  219    HA   VAL  24           HA       VAL  24   7.114  -3.992   4.831
  220    HB   VAL  24           HB       VAL  24   7.636  -6.966   4.721
  221   HG11  VAL  24          HG11      VAL  24   7.892  -4.913   6.916
  222   HG12  VAL  24          HG12      VAL  24   9.206  -5.774   6.112
  223   HG13  VAL  24          HG13      VAL  24   8.078  -6.652   7.144
  224   HG21  VAL  24          HG21      VAL  24   5.851  -7.181   6.403
  225   HG22  VAL  24          HG22      VAL  24   5.236  -6.613   4.852
  226   HG23  VAL  24          HG23      VAL  24   5.455  -5.479   6.183
  227    H    LEU  25           H        LEU  25   7.900  -3.376   2.386
  228    HA   LEU  25           HA       LEU  25  10.769  -4.031   2.448
  229    HB2  LEU  25           HB3      LEU  25   9.564  -5.025   0.489
  230    HB3  LEU  25           HB2      LEU  25   9.137  -3.402  -0.014
  231    HG   LEU  25           HG       LEU  25  11.553  -2.879  -0.254
  232   HD11  LEU  25          HD11      LEU  25  12.473  -4.475   1.311
  233   HD12  LEU  25          HD12      LEU  25  13.150  -4.745  -0.295
  234   HD13  LEU  25          HD13      LEU  25  11.892  -5.814   0.323
  235   HD21  LEU  25          HD21      LEU  25  10.234  -3.564  -2.182
  236   HD22  LEU  25          HD22      LEU  25  10.570  -5.258  -1.826
  237   HD23  LEU  25          HD23      LEU  25  11.882  -4.179  -2.301
  238    H    ARG  26           H        ARG  26   8.334  -1.675   1.325
  239    HA   ARG  26           HA       ARG  26   9.320   0.477   2.763
  240    HB2  ARG  26           HB3      ARG  26  10.615   1.795   1.300
  241    HB3  ARG  26           HB2      ARG  26  11.297   0.186   1.193
  242    HG2  ARG  26           HG3      ARG  26   9.557   1.570  -0.836
  243    HG3  ARG  26           HG2      ARG  26  11.263   1.160  -0.987
  244    HD2  ARG  26           HD3      ARG  26  10.659  -1.232  -0.888
  245    HD3  ARG  26           HD2      ARG  26   8.955  -0.777  -0.815
  246    HE   ARG  26           HE       ARG  26  10.701  -0.693  -3.134
  247   HH11  ARG  26          HH11      ARG  26   7.665   0.350  -1.717
  248   HH12  ARG  26          HH12      ARG  26   6.867   0.505  -3.249
  249   HH21  ARG  26          HH22      ARG  26   9.641  -0.519  -5.146
  250   HH22  ARG  26          HH21      ARG  26   7.984  -0.013  -5.205
  251    HA   PRO  27           HA       PRO  27   5.582   1.976   0.754
  252    HB2  PRO  27           HB2      PRO  27   4.375   2.908   2.964
  253    HB3  PRO  27           HB3      PRO  27   4.364   1.182   2.556
  254    HG2  PRO  27           HG3      PRO  27   5.878   2.617   4.651
  255    HG3  PRO  27           HG2      PRO  27   5.358   0.927   4.589
  256    HD2  PRO  27           HD3      PRO  27   7.945   2.000   3.962
  257    HD3  PRO  27           HD2      PRO  27   7.413   0.314   3.850
  258    H    GLN  28           H        GLN  28   4.897   4.140   0.366
  259    HA   GLN  28           HA       GLN  28   6.981   6.100   0.765
  260    HB2  GLN  28           HB3      GLN  28   4.319   6.258  -0.645
  261    HB3  GLN  28           HB2      GLN  28   5.483   7.574  -0.591
  262    HG2  GLN  28           HG3      GLN  28   6.033   4.854  -1.740
  263    HG3  GLN  28           HG2      GLN  28   5.542   6.260  -2.680
  264   HE21  GLN  28          HE22      GLN  28   7.407   6.301  -3.889
  265   HE22  GLN  28          HE21      GLN  28   8.945   6.756  -3.236
  266    H    GLY  29           H        GLY  29   4.778   5.106   2.863
  267    HA2  GLY  29           HA3      GLY  29   4.715   7.662   4.225
  268    HA3  GLY  29           HA2      GLY  29   3.142   7.024   3.761
  Start of MODEL    7
    1    H1   ARG   1           H1       ARG   1 -10.074   5.606  -1.074
    2    H2   ARG   1           H2       ARG   1  -8.649   5.002  -0.403
    3    H3   ARG   1           H3       ARG   1 -10.122   4.761   0.388
    4    HA   ARG   1           HA       ARG   1 -10.908   3.354  -1.373
    5    HB2  ARG   1           HB3      ARG   1  -8.158   3.764  -2.575
    6    HB3  ARG   1           HB2      ARG   1  -9.412   2.705  -3.202
    7    HG2  ARG   1           HG3      ARG   1  -9.594   5.705  -3.012
    8    HG3  ARG   1           HG2      ARG   1  -9.234   4.785  -4.472
    9    HD2  ARG   1           HD3      ARG   1 -11.767   4.541  -2.860
   10    HD3  ARG   1           HD2      ARG   1 -11.596   5.511  -4.320
   11    HE   ARG   1           HE       ARG   1 -10.790   2.955  -4.996
   12   HH11  ARG   1          HH12      ARG   1 -13.701   4.456  -3.766
   13   HH12  ARG   1          HH11      ARG   1 -14.769   3.366  -4.589
   14   HH21  ARG   1          HH21      ARG   1 -12.198   1.482  -6.055
   15   HH22  ARG   1          HH22      ARG   1 -13.915   1.667  -5.879
   16    H    LYS   2           H        LYS   2 -10.891   1.318  -0.609
   17    HA   LYS   2           HA       LYS   2  -8.404   0.361   0.654
   18    HB2  LYS   2           HB3      LYS   2 -11.222  -0.391   1.460
   19    HB3  LYS   2           HB2      LYS   2  -9.742  -0.985   2.189
   20    HG2  LYS   2           HG3      LYS   2 -10.523   0.617   3.682
   21    HG3  LYS   2           HG2      LYS   2  -9.250   1.443   2.786
   22    HD2  LYS   2           HD3      LYS   2 -11.138   2.923   3.013
   23    HD3  LYS   2           HD2      LYS   2 -11.000   2.436   1.325
   24    HE2  LYS   2           HE3      LYS   2 -12.740   0.721   1.723
   25    HE3  LYS   2           HE2      LYS   2 -12.914   1.321   3.371
   26    HZ1  LYS   2           HZ1      LYS   2 -13.457   2.827   0.873
   27    HZ2  LYS   2           HZ2      LYS   2 -13.528   3.488   2.428
   28    HZ3  LYS   2           HZ3      LYS   2 -14.601   2.262   1.985
   29    H    CYS   3           H        CYS   3  -7.954  -0.367  -1.539
   30    HA   CYS   3           HA       CYS   3  -9.546  -2.477  -2.678
   31    HB2  CYS   3           HB3      CYS   3  -6.807  -2.170  -3.676
   32    HB3  CYS   3           HB2      CYS   3  -8.335  -2.078  -4.541
   33    H    ASN   4           H        ASN   4  -8.411  -2.876   0.019
   34    HA   ASN   4           HA       ASN   4  -7.385  -4.435   1.292
   35    HB2  ASN   4           HB3      ASN   4  -7.765  -6.043  -1.233
   36    HB3  ASN   4           HB2      ASN   4  -7.091  -6.735   0.237
   37   HD21  ASN   4          HD22      ASN   4  -9.588  -7.254  -1.274
   38   HD22  ASN   4          HD21      ASN   4 -10.854  -7.119  -0.105
   39    H    PHE   5           H        PHE   5  -5.800  -6.100  -1.219
   40    HA   PHE   5           HA       PHE   5  -3.242  -5.348  -0.130
   41    HB2  PHE   5           HB3      PHE   5  -2.400  -7.026  -1.829
   42    HB3  PHE   5           HB2      PHE   5  -3.492  -7.656  -0.604
   43    HD1  PHE   5           HD2      PHE   5  -3.255  -6.638  -4.148
   44    HD2  PHE   5           HD1      PHE   5  -5.572  -8.611  -1.174
   45    HE1  PHE   5           HE2      PHE   5  -4.720  -7.549  -5.899
   46    HE2  PHE   5           HE1      PHE   5  -7.039  -9.526  -2.921
   47    HZ   PHE   5           HZ       PHE   5  -6.616  -8.994  -5.288
   48    H    LEU   6           H        LEU   6  -1.492  -4.544  -1.363
   49    HA   LEU   6           HA       LEU   6  -0.556  -2.892  -2.584
   50    HB2  LEU   6           HB3      LEU   6  -2.326  -4.184  -4.646
   51    HB3  LEU   6           HB2      LEU   6  -1.258  -2.856  -5.045
   52    HG   LEU   6           HG       LEU   6  -0.142  -4.839  -5.691
   53   HD11  LEU   6          HD11      LEU   6   1.012  -4.036  -3.030
   54   HD12  LEU   6          HD12      LEU   6   1.254  -3.181  -4.552
   55   HD13  LEU   6          HD13      LEU   6   1.863  -4.823  -4.358
   56   HD21  LEU   6          HD21      LEU   6  -1.381  -6.508  -4.512
   57   HD22  LEU   6          HD22      LEU   6  -0.787  -5.923  -2.958
   58   HD23  LEU   6          HD23      LEU   6   0.322  -6.685  -4.097
   59    H    CYS   7           H        CYS   7  -2.729  -2.124  -0.959
   60    HA   CYS   7           HA       CYS   7  -3.446   0.340  -2.258
   61    HB2  CYS   7           HB3      CYS   7  -5.154  -1.275  -3.090
   62    HB3  CYS   7           HB2      CYS   7  -5.673  -1.521  -1.428
   63    H    LYS   8           H        LYS   8  -3.941  -1.788   0.586
   64    HA   LYS   8           HA       LYS   8  -3.141   0.482   2.230
   65    HB2  LYS   8           HB3      LYS   8  -5.585   0.688   2.208
   66    HB3  LYS   8           HB2      LYS   8  -5.745  -0.986   2.722
   67    HG2  LYS   8           HG3      LYS   8  -4.620  -0.449   4.828
   68    HG3  LYS   8           HG2      LYS   8  -4.470   1.231   4.315
   69    HD2  LYS   8           HD3      LYS   8  -6.351   0.927   5.847
   70    HD3  LYS   8           HD2      LYS   8  -6.899   1.438   4.253
   71    HE2  LYS   8           HE3      LYS   8  -7.661  -0.734   3.715
   72    HE3  LYS   8           HE2      LYS   8  -6.831  -1.444   5.096
   73    HZ1  LYS   8           HZ1      LYS   8  -8.334  -0.303   6.570
   74    HZ2  LYS   8           HZ2      LYS   8  -9.222  -1.217   5.462
   75    HZ3  LYS   8           HZ3      LYS   8  -9.101   0.459   5.274
   76    H    LEU   9           H        LEU   9  -3.991  -2.908   2.002
   77    HA   LEU   9           HA       LEU   9  -2.826  -3.675   4.505
   78    HB2  LEU   9           HB3      LEU   9  -3.667  -5.246   2.074
   79    HB3  LEU   9           HB2      LEU   9  -3.121  -5.981   3.576
   80    HG   LEU   9           HG       LEU   9  -5.524  -4.165   3.390
   81   HD11  LEU   9          HD11      LEU   9  -5.396  -7.174   3.366
   82   HD12  LEU   9          HD12      LEU   9  -5.891  -6.130   2.029
   83   HD13  LEU   9          HD13      LEU   9  -6.864  -6.206   3.500
   84   HD21  LEU   9          HD21      LEU   9  -4.569  -6.063   5.529
   85   HD22  LEU   9          HD22      LEU   9  -6.077  -5.151   5.565
   86   HD23  LEU   9          HD23      LEU   9  -4.532  -4.302   5.606
   87    H    LYS  10           H        LYS  10  -1.926  -4.873   1.267
   88    HA   LYS  10           HA       LYS  10   0.816  -4.021   1.800
   89    HB2  LYS  10           HB3      LYS  10  -0.433  -5.694  -0.370
   90    HB3  LYS  10           HB2      LYS  10   1.165  -4.987  -0.580
   91    HG2  LYS  10           HG3      LYS  10   1.953  -6.156   1.401
   92    HG3  LYS  10           HG2      LYS  10   0.352  -6.840   1.633
   93    HD2  LYS  10           HD3      LYS  10   2.077  -7.292  -0.794
   94    HD3  LYS  10           HD2      LYS  10   1.950  -8.408   0.563
   95    HE2  LYS  10           HE3      LYS  10  -0.479  -8.595   0.121
   96    HE3  LYS  10           HE2      LYS  10  -0.266  -7.570  -1.299
   97    HZ1  LYS  10           HZ1      LYS  10  -0.278  -9.915  -1.877
   98    HZ2  LYS  10           HZ2      LYS  10   1.042 -10.200  -0.860
   99    HZ3  LYS  10           HZ3      LYS  10   1.220  -9.221  -2.229
  100    H    GLU  11           H        GLU  11   1.815  -2.753  -0.119
  101    HA   GLU  11           HA       GLU  11  -0.214  -1.102  -1.422
  102    HB2  GLU  11           HB3      GLU  11   0.830   0.988  -0.727
  103    HB3  GLU  11           HB2      GLU  11   0.235   0.077   0.653
  104    HG2  GLU  11           HG3      GLU  11   2.289  -0.244   1.496
  105    HG3  GLU  11           HG2      GLU  11   3.037  -0.384  -0.097
  106    H    LYS  12           H        LYS  12   1.197   0.781  -2.602
  107    HA   LYS  12           HA       LYS  12   3.230  -0.614  -4.158
  108    HB2  LYS  12           HB3      LYS  12   1.947   0.276  -6.241
  109    HB3  LYS  12           HB2      LYS  12   1.416  -1.208  -5.465
  110    HG2  LYS  12           HG3      LYS  12  -0.526   0.044  -5.957
  111    HG3  LYS  12           HG2      LYS  12  -0.281   0.149  -4.218
  112    HD2  LYS  12           HD3      LYS  12  -0.899   2.316  -4.966
  113    HD3  LYS  12           HD2      LYS  12   0.828   2.378  -4.611
  114    HE2  LYS  12           HE3      LYS  12   0.369   3.539  -6.686
  115    HE3  LYS  12           HE2      LYS  12   1.296   2.077  -7.019
  116    HZ1  LYS  12           HZ1      LYS  12  -0.732   0.969  -7.692
  117    HZ2  LYS  12           HZ2      LYS  12  -0.522   2.384  -8.592
  118    HZ3  LYS  12           HZ3      LYS  12  -1.645   2.345  -7.331
  119    H    LEU  13           H        LEU  13   3.114   1.744  -2.314
  120    HA   LEU  13           HA       LEU  13   4.209   3.718  -2.106
  121    HB2  LEU  13           HB3      LEU  13   5.870   2.497  -3.618
  122    HB3  LEU  13           HB2      LEU  13   5.171   3.396  -4.946
  123    HG   LEU  13           HG       LEU  13   6.375   4.791  -2.561
  124   HD11  LEU  13          HD11      LEU  13   8.440   4.993  -3.860
  125   HD12  LEU  13          HD12      LEU  13   7.762   3.938  -5.100
  126   HD13  LEU  13          HD13      LEU  13   8.076   3.309  -3.482
  127   HD21  LEU  13          HD21      LEU  13   4.941   6.118  -4.059
  128   HD22  LEU  13          HD22      LEU  13   5.959   5.654  -5.423
  129   HD23  LEU  13          HD23      LEU  13   6.625   6.639  -4.119
  130    H    ARG  14           H        ARG  14   2.323   4.892  -1.928
  131    HA   ARG  14           HA       ARG  14   1.825   6.672  -4.201
  132    HB2  ARG  14           HB3      ARG  14   0.132   4.812  -4.234
  133    HB3  ARG  14           HB2      ARG  14  -0.435   5.379  -2.675
  134    HG2  ARG  14           HG3      ARG  14  -1.893   6.213  -4.367
  135    HG3  ARG  14           HG2      ARG  14  -0.972   7.564  -3.705
  136    HD2  ARG  14           HD3      ARG  14  -0.282   6.103  -6.257
  137    HD3  ARG  14           HD2      ARG  14  -1.200   7.602  -6.186
  138    HE   ARG  14           HE       ARG  14   0.959   8.407  -4.955
  139   HH11  ARG  14          HH11      ARG  14   0.731   6.334  -7.771
  140   HH12  ARG  14          HH12      ARG  14   2.282   6.800  -8.391
  141   HH21  ARG  14          HH22      ARG  14   3.004   9.015  -5.780
  142   HH22  ARG  14          HH21      ARG  14   3.573   8.319  -7.264
  143    H    THR  15           H        THR  15   2.530   6.269  -1.020
  144    HA   THR  15           HA       THR  15   2.642   7.605   0.791
  145    HB   THR  15           HB       THR  15   4.338   8.651  -0.523
  146    HG1  THR  15           HG1      THR  15   3.807  10.994   0.231
  147   HG21  THR  15          HG21      THR  15   2.968   9.167  -2.536
  148   HG22  THR  15          HG22      THR  15   3.997  10.498  -2.017
  149   HG23  THR  15          HG23      THR  15   2.272  10.532  -1.662
  150    H    VAL  16           H        VAL  16   0.538   7.241   1.426
  151    HA   VAL  16           HA       VAL  16  -1.115   9.330   2.086
  152    HB   VAL  16           HB       VAL  16  -1.342   9.474  -0.447
  153   HG11  VAL  16          HG11      VAL  16  -2.634   6.818  -0.041
  154   HG12  VAL  16          HG12      VAL  16  -1.411   7.302  -1.216
  155   HG13  VAL  16          HG13      VAL  16  -3.077   7.857  -1.394
  156   HG21  VAL  16          HG21      VAL  16  -3.670  10.019  -0.433
  157   HG22  VAL  16          HG22      VAL  16  -2.974  10.481   1.117
  158   HG23  VAL  16          HG23      VAL  16  -3.954   9.023   0.986
  159    H    ILE  17           H        ILE  17  -3.657   7.727   1.703
  160    HA   ILE  17           HA       ILE  17  -3.477   5.986   3.875
  161    HB   ILE  17           HB       ILE  17  -5.609   6.867   3.167
  162   HG12  ILE  17          HG13      ILE  17  -5.349   4.453   4.195
  163   HG13  ILE  17          HG12      ILE  17  -6.922   5.048   3.686
  164   HG21  ILE  17          HG21      ILE  17  -5.253   5.244   0.663
  165   HG22  ILE  17          HG22      ILE  17  -5.273   7.002   0.798
  166   HG23  ILE  17          HG23      ILE  17  -6.737   6.076   1.127
  167   HD11  ILE  17          HD11      ILE  17  -6.786   2.838   2.915
  168   HD12  ILE  17          HD12      ILE  17  -5.147   3.056   2.300
  169   HD13  ILE  17          HD13      ILE  17  -6.506   3.841   1.495
  170    H    THR  18           H        THR  18  -3.062   5.411   0.427
  171    HA   THR  18           HA       THR  18  -2.816   2.689   0.270
  172    HB   THR  18           HB       THR  18  -0.834   4.551  -1.045
  173    HG1  THR  18           HG1      THR  18  -3.613   4.173  -1.588
  174   HG21  THR  18          HG21      THR  18  -2.250   2.062  -2.024
  175   HG22  THR  18          HG22      THR  18  -0.602   2.124  -1.405
  176   HG23  THR  18          HG23      THR  18  -1.014   2.976  -2.890
  177    H    SER  19           H        SER  19  -0.151   4.963   0.796
  178    HA   SER  19           HA       SER  19   1.615   2.936   1.731
  179    HB2  SER  19           HB3      SER  19   1.852   5.949   1.757
  180    HB3  SER  19           HB2      SER  19   3.158   4.832   2.157
  181    HG   SER  19           HG       SER  19   2.713   3.892  -0.004
  182    H    HIS  20           H        HIS  20  -0.189   2.326   3.297
  183    HA   HIS  20           HA       HIS  20   0.168   3.769   5.843
  184    HB2  HIS  20           HB3      HIS  20  -2.172   3.381   5.057
  185    HB3  HIS  20           HB2      HIS  20  -1.882   1.648   5.162
  186    HD1  HIS  20           HD1      HIS  20  -2.264   4.707   7.335
  187    HD2  HIS  20           HD2      HIS  20  -2.072   0.568   7.701
  188    HE1  HIS  20           HE1      HIS  20  -2.918   4.204   9.712
  189    HE2  HIS  20           HE2      HIS  20  -2.659   1.709   9.945
  190    H    ILE  21           H        ILE  21  -0.108   0.431   4.643
  191    HA   ILE  21           HA       ILE  21   2.301  -0.259   6.101
  192    HB   ILE  21           HB       ILE  21   0.508  -0.770   7.721
  193   HG12  ILE  21          HG13      ILE  21   1.781  -3.238   6.515
  194   HG13  ILE  21          HG12      ILE  21   2.531  -2.160   7.686
  195   HG21  ILE  21          HG21      ILE  21  -1.326  -1.162   6.188
  196   HG22  ILE  21          HG22      ILE  21  -1.112  -2.549   7.257
  197   HG23  ILE  21          HG23      ILE  21  -0.541  -2.623   5.591
  198   HD11  ILE  21          HD11      ILE  21   0.094  -3.859   8.158
  199   HD12  ILE  21          HD12      ILE  21   0.843  -2.780   9.334
  200   HD13  ILE  21          HD13      ILE  21   1.725  -4.187   8.742
  201    H    ASP  22           H        ASP  22   3.275  -2.203   5.253
  202    HA   ASP  22           HA       ASP  22   2.099  -3.141   2.733
  203    HB2  ASP  22           HB3      ASP  22   3.769  -1.361   2.241
  204    HB3  ASP  22           HB2      ASP  22   4.991  -2.299   3.071
  205    H    LYS  23           H        LYS  23   3.636  -5.004   1.863
  206    HA   LYS  23           HA       LYS  23   3.830  -7.052   3.780
  207    HB2  LYS  23           HB3      LYS  23   5.064  -8.300   2.068
  208    HB3  LYS  23           HB2      LYS  23   3.648  -7.527   1.378
  209    HG2  LYS  23           HG3      LYS  23   6.069  -5.910   1.186
  210    HG3  LYS  23           HG2      LYS  23   6.175  -7.450   0.337
  211    HD2  LYS  23           HD3      LYS  23   4.196  -6.927  -0.939
  212    HD3  LYS  23           HD2      LYS  23   3.942  -5.450  -0.007
  213    HE2  LYS  23           HE3      LYS  23   4.929  -4.927  -2.163
  214    HE3  LYS  23           HE2      LYS  23   6.072  -4.544  -0.871
  215    HZ1  LYS  23           HZ1      LYS  23   6.108  -6.959  -2.612
  216    HZ2  LYS  23           HZ2      LYS  23   7.178  -6.680  -1.336
  217    HZ3  LYS  23           HZ3      LYS  23   7.183  -5.661  -2.683
  218    H    VAL  24           H        VAL  24   6.138  -4.662   2.559
  219    HA   VAL  24           HA       VAL  24   7.955  -5.182   4.754
  220    HB   VAL  24           HB       VAL  24   9.955  -5.547   3.281
  221   HG11  VAL  24          HG11      VAL  24   9.589  -7.945   2.914
  222   HG12  VAL  24          HG12      VAL  24   7.866  -7.713   3.207
  223   HG13  VAL  24          HG13      VAL  24   9.030  -7.417   4.500
  224   HG21  VAL  24          HG21      VAL  24   7.922  -6.198   1.159
  225   HG22  VAL  24          HG22      VAL  24   9.670  -6.356   1.025
  226   HG23  VAL  24          HG23      VAL  24   8.937  -4.759   1.185
  227    H    LEU  25           H        LEU  25  10.202  -3.944   3.816
  228    HA   LEU  25           HA       LEU  25   9.369  -1.193   3.543
  229    HB2  LEU  25           HB3      LEU  25  11.975  -0.920   3.486
  230    HB3  LEU  25           HB2      LEU  25  11.137  -1.274   4.981
  231    HG   LEU  25           HG       LEU  25  11.717  -3.697   4.641
  232   HD11  LEU  25          HD11      LEU  25  13.550  -4.237   3.121
  233   HD12  LEU  25          HD12      LEU  25  13.503  -2.594   2.480
  234   HD13  LEU  25          HD13      LEU  25  12.126  -3.673   2.246
  235   HD21  LEU  25          HD21      LEU  25  14.011  -3.444   5.400
  236   HD22  LEU  25          HD22      LEU  25  12.960  -2.256   6.165
  237   HD23  LEU  25          HD23      LEU  25  14.022  -1.772   4.845
  238    H    ARG  26           H        ARG  26   8.517  -2.487   1.309
  239    HA   ARG  26           HA       ARG  26  10.468  -2.021  -0.779
  240    HB2  ARG  26           HB3      ARG  26   9.243  -3.980  -1.156
  241    HB3  ARG  26           HB2      ARG  26   7.724  -3.235  -0.692
  242    HG2  ARG  26           HG3      ARG  26   9.047  -2.076  -3.052
  243    HG3  ARG  26           HG2      ARG  26   8.442  -3.725  -3.229
  244    HD2  ARG  26           HD3      ARG  26   6.239  -3.079  -2.675
  245    HD3  ARG  26           HD2      ARG  26   6.773  -1.500  -2.090
  246    HE   ARG  26           HE       ARG  26   7.443  -1.171  -4.553
  247   HH11  ARG  26          HH11      ARG  26   4.640  -2.975  -3.473
  248   HH12  ARG  26          HH12      ARG  26   3.772  -2.753  -4.956
  249   HH21  ARG  26          HH22      ARG  26   6.285  -0.862  -6.500
  250   HH22  ARG  26          HH21      ARG  26   4.703  -1.560  -6.676
  251    HA   PRO  27           HA       PRO  27   7.364   1.413  -1.840
  252    HB2  PRO  27           HB2      PRO  27   5.276   1.987  -0.328
  253    HB3  PRO  27           HB3      PRO  27   5.244   0.543  -1.368
  254    HG2  PRO  27           HG3      PRO  27   5.897   0.741   1.563
  255    HG3  PRO  27           HG2      PRO  27   4.750  -0.353   0.762
  256    HD2  PRO  27           HD3      PRO  27   7.299  -1.074   1.401
  257    HD3  PRO  27           HD2      PRO  27   6.434  -1.739   0.000
  258    H    GLN  28           H        GLN  28   8.275   3.388  -1.516
  259    HA   GLN  28           HA       GLN  28   9.265   5.179  -0.509
  260    HB2  GLN  28           HB3      GLN  28   7.496   4.389   1.820
  261    HB3  GLN  28           HB2      GLN  28   8.363   5.910   1.686
  262    HG2  GLN  28           HG3      GLN  28   6.273   4.998  -0.273
  263    HG3  GLN  28           HG2      GLN  28   5.931   6.012   1.126
  264   HE21  GLN  28          HE22      GLN  28   8.501   7.434   0.863
  265   HE22  GLN  28          HE21      GLN  28   8.283   8.523  -0.462
  266    H    GLY  29           H        GLY  29  10.371   2.452  -0.265
  267    HA2  GLY  29           HA3      GLY  29  11.935   2.785   2.216
  268    HA3  GLY  29           HA2      GLY  29  11.450   1.207   1.595
  Start of MODEL    8
    1    H1   ARG   1           H1       ARG   1  -6.316  -0.531   7.038
    2    H2   ARG   1           H2       ARG   1  -5.584  -0.833   5.545
    3    H3   ARG   1           H3       ARG   1  -5.619  -2.042   6.732
    4    HA   ARG   1           HA       ARG   1  -7.236  -2.472   5.007
    5    HB2  ARG   1           HB3      ARG   1  -9.193  -2.783   6.433
    6    HB3  ARG   1           HB2      ARG   1  -7.730  -3.209   7.305
    7    HG2  ARG   1           HG3      ARG   1  -7.795  -1.137   8.527
    8    HG3  ARG   1           HG2      ARG   1  -9.173  -0.582   7.574
    9    HD2  ARG   1           HD3      ARG   1  -9.156  -3.001   9.375
   10    HD3  ARG   1           HD2      ARG   1  -9.831  -1.427   9.790
   11    HE   ARG   1           HE       ARG   1 -11.039  -2.232   7.421
   12   HH11  ARG   1          HH12      ARG   1 -10.871  -3.288  10.752
   13   HH12  ARG   1          HH11      ARG   1 -12.442  -4.023  10.732
   14   HH21  ARG   1          HH21      ARG   1 -13.118  -3.182   7.392
   15   HH22  ARG   1          HH22      ARG   1 -13.725  -3.955   8.823
   16    H    LYS   2           H        LYS   2  -8.930  -1.823   3.751
   17    HA   LYS   2           HA       LYS   2 -10.485   0.431   3.837
   18    HB2  LYS   2           HB3      LYS   2  -8.170   1.556   3.864
   19    HB3  LYS   2           HB2      LYS   2  -8.016   1.033   2.198
   20    HG2  LYS   2           HG3      LYS   2 -10.361   2.678   3.059
   21    HG3  LYS   2           HG2      LYS   2  -8.799   3.434   2.733
   22    HD2  LYS   2           HD3      LYS   2  -8.838   2.363   0.477
   23    HD3  LYS   2           HD2      LYS   2 -10.477   1.805   0.823
   24    HE2  LYS   2           HE3      LYS   2 -11.229   4.101   1.076
   25    HE3  LYS   2           HE2      LYS   2  -9.586   4.687   0.820
   26    HZ1  LYS   2           HZ1      LYS   2 -10.912   4.872  -1.185
   27    HZ2  LYS   2           HZ2      LYS   2 -11.222   3.210  -1.170
   28    HZ3  LYS   2           HZ3      LYS   2  -9.648   3.776  -1.416
   29    H    CYS   3           H        CYS   3  -8.460  -1.681   1.964
   30    HA   CYS   3           HA       CYS   3 -10.587  -2.399   0.194
   31    HB2  CYS   3           HB3      CYS   3  -9.100  -1.761  -1.848
   32    HB3  CYS   3           HB2      CYS   3 -10.063  -0.512  -1.070
   33    H    ASN   4           H        ASN   4  -8.502  -3.263  -1.853
   34    HA   ASN   4           HA       ASN   4  -7.697  -5.669  -0.390
   35    HB2  ASN   4           HB3      ASN   4  -8.230  -5.088  -3.288
   36    HB3  ASN   4           HB2      ASN   4  -7.300  -6.505  -2.820
   37   HD21  ASN   4          HD22      ASN   4  -8.936  -7.789  -3.741
   38   HD22  ASN   4          HD21      ASN   4 -10.413  -8.093  -2.894
   39    H    PHE   5           H        PHE   5  -5.753  -6.670  -2.010
   40    HA   PHE   5           HA       PHE   5  -3.424  -5.369  -1.151
   41    HB2  PHE   5           HB3      PHE   5  -2.300  -6.916  -2.851
   42    HB3  PHE   5           HB2      PHE   5  -3.219  -7.669  -1.557
   43    HD1  PHE   5           HD2      PHE   5  -3.454  -6.621  -5.109
   44    HD2  PHE   5           HD1      PHE   5  -4.895  -9.209  -2.059
   45    HE1  PHE   5           HE2      PHE   5  -4.773  -7.852  -6.782
   46    HE2  PHE   5           HE1      PHE   5  -6.220 -10.440  -3.722
   47    HZ   PHE   5           HZ       PHE   5  -6.089  -9.839  -6.087
   48    H    LEU   6           H        LEU   6  -1.693  -4.474  -2.493
   49    HA   LEU   6           HA       LEU   6  -1.009  -2.644  -3.650
   50    HB2  LEU   6           HB3      LEU   6  -2.711  -3.991  -5.749
   51    HB3  LEU   6           HB2      LEU   6  -1.683  -2.614  -6.082
   52    HG   LEU   6           HG       LEU   6  -0.464  -4.466  -6.822
   53   HD11  LEU   6          HD11      LEU   6   0.562  -3.920  -4.045
   54   HD12  LEU   6          HD12      LEU   6   0.874  -2.943  -5.480
   55   HD13  LEU   6          HD13      LEU   6   1.476  -4.596  -5.394
   56   HD21  LEU   6          HD21      LEU   6  -1.718  -6.271  -5.902
   57   HD22  LEU   6          HD22      LEU   6  -1.216  -5.853  -4.264
   58   HD23  LEU   6          HD23      LEU   6  -0.035  -6.468  -5.419
   59    H    CYS   7           H        CYS   7  -2.684  -1.744  -1.949
   60    HA   CYS   7           HA       CYS   7  -4.122   0.373  -3.124
   61    HB2  CYS   7           HB3      CYS   7  -5.682  -1.468  -3.700
   62    HB3  CYS   7           HB2      CYS   7  -5.833  -1.851  -1.989
   63    H    LYS   8           H        LYS   8  -4.078  -1.776  -0.255
   64    HA   LYS   8           HA       LYS   8  -2.784   0.242   1.287
   65    HB2  LYS   8           HB3      LYS   8  -5.292   0.907   1.334
   66    HB3  LYS   8           HB2      LYS   8  -5.496  -0.500   2.370
   67    HG2  LYS   8           HG3      LYS   8  -3.755   0.463   3.889
   68    HG3  LYS   8           HG2      LYS   8  -3.792   1.927   2.906
   69    HD2  LYS   8           HD3      LYS   8  -6.315   1.931   3.359
   70    HD3  LYS   8           HD2      LYS   8  -5.954   0.770   4.638
   71    HE2  LYS   8           HE3      LYS   8  -4.344   2.411   5.587
   72    HE3  LYS   8           HE2      LYS   8  -4.867   3.563   4.361
   73    HZ1  LYS   8           HZ1      LYS   8  -5.975   3.884   6.507
   74    HZ2  LYS   8           HZ2      LYS   8  -6.660   2.344   6.386
   75    HZ3  LYS   8           HZ3      LYS   8  -7.070   3.546   5.267
   76    H    LEU   9           H        LEU   9  -2.491  -2.512   0.494
   77    HA   LEU   9           HA       LEU   9  -2.345  -3.827   3.095
   78    HB2  LEU   9           HB3      LEU   9  -3.899  -4.818   0.739
   79    HB3  LEU   9           HB2      LEU   9  -3.108  -5.978   1.784
   80    HG   LEU   9           HG       LEU   9  -4.396  -4.887   3.708
   81   HD11  LEU   9          HD11      LEU   9  -6.448  -3.737   3.118
   82   HD12  LEU   9          HD12      LEU   9  -6.018  -3.808   1.411
   83   HD13  LEU   9          HD13      LEU   9  -5.047  -2.848   2.526
   84   HD21  LEU   9          HD21      LEU   9  -6.394  -6.209   3.237
   85   HD22  LEU   9          HD22      LEU   9  -4.927  -7.085   2.805
   86   HD23  LEU   9          HD23      LEU   9  -5.911  -6.340   1.546
   87    H    LYS  10           H        LYS  10  -1.756  -4.466  -0.372
   88    HA   LYS  10           HA       LYS  10   0.692  -5.861   0.303
   89    HB2  LYS  10           HB3      LYS  10  -0.861  -6.601  -1.542
   90    HB3  LYS  10           HB2      LYS  10  -0.329  -5.197  -2.450
   91    HG2  LYS  10           HG3      LYS  10   0.880  -7.112  -3.205
   92    HG3  LYS  10           HG2      LYS  10   1.984  -6.038  -2.347
   93    HD2  LYS  10           HD3      LYS  10   2.290  -8.445  -1.799
   94    HD3  LYS  10           HD2      LYS  10   1.926  -7.438  -0.397
   95    HE2  LYS  10           HE3      LYS  10  -0.312  -8.197  -0.316
   96    HE3  LYS  10           HE2      LYS  10  -0.194  -8.946  -1.905
   97    HZ1  LYS  10           HZ1      LYS  10   1.322 -10.568  -1.010
   98    HZ2  LYS  10           HZ2      LYS  10  -0.089 -10.559  -0.081
   99    HZ3  LYS  10           HZ3      LYS  10   1.314  -9.816   0.502
  100    H    GLU  11           H        GLU  11  -0.276  -2.816  -1.177
  101    HA   GLU  11           HA       GLU  11   0.826  -0.839  -1.415
  102    HB2  GLU  11           HB3      GLU  11   1.902  -1.875   0.807
  103    HB3  GLU  11           HB2      GLU  11   3.329  -1.894  -0.210
  104    HG2  GLU  11           HG3      GLU  11   1.681   0.544   0.412
  105    HG3  GLU  11           HG2      GLU  11   3.172   0.092   1.232
  106    H    LYS  12           H        LYS  12   2.782   0.120  -2.520
  107    HA   LYS  12           HA       LYS  12   4.392  -1.517  -4.176
  108    HB2  LYS  12           HB3      LYS  12   3.280  -0.377  -6.318
  109    HB3  LYS  12           HB2      LYS  12   2.771  -1.942  -5.713
  110    HG2  LYS  12           HG3      LYS  12   0.733  -0.999  -5.967
  111    HG3  LYS  12           HG2      LYS  12   1.071  -0.449  -4.330
  112    HD2  LYS  12           HD3      LYS  12   0.160   1.349  -5.686
  113    HD3  LYS  12           HD2      LYS  12   1.819   1.715  -5.225
  114    HE2  LYS  12           HE3      LYS  12   1.407   2.284  -7.563
  115    HE3  LYS  12           HE2      LYS  12   2.586   0.983  -7.439
  116    HZ1  LYS  12           HZ1      LYS  12  -0.295   0.640  -8.056
  117    HZ2  LYS  12           HZ2      LYS  12   0.844  -0.604  -7.959
  118    HZ3  LYS  12           HZ3      LYS  12   0.962   0.560  -9.176
  119    H    LEU  13           H        LEU  13   2.827   1.644  -4.040
  120    HA   LEU  13           HA       LEU  13   4.572   3.306  -3.049
  121    HB2  LEU  13           HB3      LEU  13   6.173   4.143  -4.518
  122    HB3  LEU  13           HB2      LEU  13   6.267   2.417  -4.772
  123    HG   LEU  13           HG       LEU  13   4.718   4.244  -6.603
  124   HD11  LEU  13          HD11      LEU  13   6.667   4.144  -8.091
  125   HD12  LEU  13          HD12      LEU  13   7.576   3.315  -6.828
  126   HD13  LEU  13          HD13      LEU  13   7.030   4.973  -6.577
  127   HD21  LEU  13          HD21      LEU  13   5.863   1.488  -7.029
  128   HD22  LEU  13          HD22      LEU  13   4.903   2.420  -8.176
  129   HD23  LEU  13          HD23      LEU  13   4.172   1.839  -6.682
  130    H    ARG  14           H        ARG  14   3.563   5.267  -2.971
  131    HA   ARG  14           HA       ARG  14   2.344   6.430  -5.249
  132    HB2  ARG  14           HB3      ARG  14   0.648   4.697  -4.775
  133    HB3  ARG  14           HB2      ARG  14   0.425   5.376  -3.170
  134    HG2  ARG  14           HG3      ARG  14  -1.341   6.087  -4.681
  135    HG3  ARG  14           HG2      ARG  14  -0.373   7.461  -4.144
  136    HD2  ARG  14           HD3      ARG  14   0.896   7.346  -6.261
  137    HD3  ARG  14           HD2      ARG  14  -0.155   6.037  -6.794
  138    HE   ARG  14           HE       ARG  14  -1.753   8.222  -6.084
  139   HH11  ARG  14          HH11      ARG  14   0.593   7.317  -8.512
  140   HH12  ARG  14          HH12      ARG  14  -0.055   8.370  -9.725
  141   HH21  ARG  14          HH22      ARG  14  -2.620   9.619  -7.676
  142   HH22  ARG  14          HH21      ARG  14  -1.882   9.692  -9.244
  143    H    THR  15           H        THR  15   1.082   6.626  -1.936
  144    HA   THR  15           HA       THR  15   2.192   9.274  -1.600
  145    HB   THR  15           HB       THR  15  -0.219  10.104  -1.167
  146    HG1  THR  15           HG1      THR  15  -1.713   9.028  -2.670
  147   HG21  THR  15          HG21      THR  15  -0.463  10.860  -3.468
  148   HG22  THR  15          HG22      THR  15   0.675   9.625  -4.008
  149   HG23  THR  15          HG23      THR  15   1.228  10.942  -2.976
  150    H    VAL  16           H        VAL  16  -0.570   7.374  -0.401
  151    HA   VAL  16           HA       VAL  16   0.552   7.157   2.252
  152    HB   VAL  16           HB       VAL  16  -2.031   8.709   1.936
  153   HG11  VAL  16          HG11      VAL  16  -1.817   7.140   3.884
  154   HG12  VAL  16          HG12      VAL  16  -2.097   8.833   4.301
  155   HG13  VAL  16          HG13      VAL  16  -0.479   8.144   4.448
  156   HG21  VAL  16          HG21      VAL  16  -0.131  10.134   1.389
  157   HG22  VAL  16          HG22      VAL  16   0.665   9.667   2.892
  158   HG23  VAL  16          HG23      VAL  16  -0.831  10.598   2.940
  159    H    ILE  17           H        ILE  17  -2.671   7.095   0.684
  160    HA   ILE  17           HA       ILE  17  -3.603   4.905   2.189
  161    HB   ILE  17           HB       ILE  17  -5.288   6.232   1.261
  162   HG12  ILE  17          HG13      ILE  17  -6.597   4.732  -0.223
  163   HG13  ILE  17          HG12      ILE  17  -5.167   3.732  -0.441
  164   HG21  ILE  17          HG21      ILE  17  -5.542   6.752  -1.100
  165   HG22  ILE  17          HG22      ILE  17  -4.094   5.819  -1.473
  166   HG23  ILE  17          HG23      ILE  17  -3.972   7.283  -0.502
  167   HD11  ILE  17          HD11      ILE  17  -6.219   4.239   2.299
  168   HD12  ILE  17          HD12      ILE  17  -5.281   2.864   1.699
  169   HD13  ILE  17          HD13      ILE  17  -6.988   3.043   1.260
  170    H    THR  18           H        THR  18  -2.564   4.984  -1.224
  171    HA   THR  18           HA       THR  18  -2.805   2.175  -1.575
  172    HB   THR  18           HB       THR  18  -1.085   4.025  -3.231
  173    HG1  THR  18           HG1      THR  18  -3.912   3.770  -3.112
  174   HG21  THR  18          HG21      THR  18  -1.734   2.550  -5.064
  175   HG22  THR  18          HG22      THR  18  -2.751   1.613  -3.971
  176   HG23  THR  18          HG23      THR  18  -1.001   1.617  -3.760
  177    H    SER  19           H        SER  19  -0.578   4.226  -0.174
  178    HA   SER  19           HA       SER  19   1.604   2.290  -0.326
  179    HB2  SER  19           HB3      SER  19   3.098   4.127  -0.514
  180    HB3  SER  19           HB2      SER  19   1.738   4.509  -1.580
  181    HG   SER  19           HG       SER  19   1.894   5.409   1.087
  182    H    HIS  20           H        HIS  20  -0.029   1.765   1.676
  183    HA   HIS  20           HA       HIS  20   0.966   3.211   4.029
  184    HB2  HIS  20           HB3      HIS  20  -1.526   3.291   3.484
  185    HB3  HIS  20           HB2      HIS  20  -1.572   1.586   3.916
  186    HD1  HIS  20           HD1      HIS  20  -2.074   4.816   5.337
  187    HD2  HIS  20           HD2      HIS  20  -0.506   1.222   6.715
  188    HE1  HIS  20           HE1      HIS  20  -2.154   4.956   7.848
  189    HE2  HIS  20           HE2      HIS  20  -1.096   2.823   8.656
  190    H    ILE  21           H        ILE  21  -0.602   0.036   3.643
  191    HA   ILE  21           HA       ILE  21   1.353  -1.133   5.440
  192    HB   ILE  21           HB       ILE  21  -1.007  -2.423   4.047
  193   HG12  ILE  21          HG13      ILE  21  -0.692  -1.441   6.893
  194   HG13  ILE  21          HG12      ILE  21  -1.671  -0.674   5.648
  195   HG21  ILE  21          HG21      ILE  21  -0.694  -4.248   5.655
  196   HG22  ILE  21          HG22      ILE  21   0.747  -3.445   6.280
  197   HG23  ILE  21          HG23      ILE  21   0.721  -4.043   4.622
  198   HD11  ILE  21          HD11      ILE  21  -2.117  -3.420   6.793
  199   HD12  ILE  21          HD12      ILE  21  -3.107  -2.637   5.561
  200   HD13  ILE  21          HD13      ILE  21  -3.033  -1.965   7.190
  201    H    ASP  22           H        ASP  22   3.249  -1.621   4.571
  202    HA   ASP  22           HA       ASP  22   3.500  -2.143   1.758
  203    HB2  ASP  22           HB3      ASP  22   5.921  -2.262   2.215
  204    HB3  ASP  22           HB2      ASP  22   5.201  -0.800   2.860
  205    H    LYS  23           H        LYS  23   4.258  -3.937   0.775
  206    HA   LYS  23           HA       LYS  23   3.662  -6.464   1.774
  207    HB2  LYS  23           HB3      LYS  23   4.981  -7.331  -0.148
  208    HB3  LYS  23           HB2      LYS  23   3.799  -6.118  -0.601
  209    HG2  LYS  23           HG3      LYS  23   6.635  -5.312  -0.107
  210    HG3  LYS  23           HG2      LYS  23   6.185  -6.074  -1.631
  211    HD2  LYS  23           HD3      LYS  23   4.452  -4.311  -1.935
  212    HD3  LYS  23           HD2      LYS  23   5.053  -3.523  -0.480
  213    HE2  LYS  23           HE3      LYS  23   5.963  -2.474  -2.473
  214    HE3  LYS  23           HE2      LYS  23   7.233  -3.232  -1.516
  215    HZ1  LYS  23           HZ1      LYS  23   5.975  -4.407  -3.940
  216    HZ2  LYS  23           HZ2      LYS  23   7.230  -5.100  -3.044
  217    HZ3  LYS  23           HZ3      LYS  23   7.489  -3.662  -3.893
  218    H    VAL  24           H        VAL  24   6.542  -4.520   2.153
  219    HA   VAL  24           HA       VAL  24   7.704  -5.934   4.172
  220    HB   VAL  24           HB       VAL  24   7.836  -7.894   2.699
  221   HG11  VAL  24          HG11      VAL  24   8.072  -6.803   0.545
  222   HG12  VAL  24          HG12      VAL  24   9.382  -7.955   0.803
  223   HG13  VAL  24          HG13      VAL  24   9.678  -6.226   0.994
  224   HG21  VAL  24          HG21      VAL  24   9.471  -7.694   4.457
  225   HG22  VAL  24          HG22      VAL  24  10.514  -6.719   3.421
  226   HG23  VAL  24          HG23      VAL  24  10.221  -8.415   3.034
  227    H    LEU  25           H        LEU  25   8.438  -4.269   1.148
  228    HA   LEU  25           HA       LEU  25  11.037  -3.433   1.941
  229    HB2  LEU  25           HB3      LEU  25   9.227  -2.347  -0.214
  230    HB3  LEU  25           HB2      LEU  25  10.923  -1.950  -0.028
  231    HG   LEU  25           HG       LEU  25   9.871  -4.718  -0.609
  232   HD11  LEU  25          HD11      LEU  25   9.436  -3.245  -2.478
  233   HD12  LEU  25          HD12      LEU  25  10.766  -4.334  -2.869
  234   HD13  LEU  25          HD13      LEU  25  11.097  -2.659  -2.436
  235   HD21  LEU  25          HD21      LEU  25  12.214  -5.223  -1.116
  236   HD22  LEU  25          HD22      LEU  25  12.007  -4.724   0.563
  237   HD23  LEU  25          HD23      LEU  25  12.671  -3.594  -0.616
  238    H    ARG  26           H        ARG  26   8.265  -1.356   1.183
  239    HA   ARG  26           HA       ARG  26   8.419   0.251   3.509
  240    HB2  ARG  26           HB3      ARG  26   9.566   2.158   2.751
  241    HB3  ARG  26           HB2      ARG  26  10.569   0.844   2.163
  242    HG2  ARG  26           HG3      ARG  26   8.625   2.507   0.570
  243    HG3  ARG  26           HG2      ARG  26  10.383   2.503   0.445
  244    HD2  ARG  26           HD3      ARG  26  10.284   0.151  -0.315
  245    HD3  ARG  26           HD2      ARG  26   8.520   0.228  -0.249
  246    HE   ARG  26           HE       ARG  26  10.232   1.703  -2.133
  247   HH11  ARG  26          HH11      ARG  26   7.050   0.638  -1.103
  248   HH12  ARG  26          HH12      ARG  26   6.349   0.813  -2.680
  249   HH21  ARG  26          HH22      ARG  26   9.295   1.937  -4.207
  250   HH22  ARG  26          HH21      ARG  26   7.627   1.527  -4.448
  251    HA   PRO  27           HA       PRO  27   4.775   1.543   1.258
  252    HB2  PRO  27           HB2      PRO  27   3.920   3.532   2.972
  253    HB3  PRO  27           HB3      PRO  27   3.678   1.796   3.227
  254    HG2  PRO  27           HG3      PRO  27   5.343   3.599   4.726
  255    HG3  PRO  27           HG2      PRO  27   5.049   1.877   5.006
  256    HD2  PRO  27           HD3      PRO  27   7.334   3.201   3.683
  257    HD3  PRO  27           HD2      PRO  27   7.234   1.587   4.416
  258    H    GLN  28           H        GLN  28   5.381   4.699   2.659
  259    HA   GLN  28           HA       GLN  28   6.701   6.110   0.740
  260    HB2  GLN  28           HB3      GLN  28   5.031   5.241  -0.884
  261    HB3  GLN  28           HB2      GLN  28   3.752   5.996   0.051
  262    HG2  GLN  28           HG3      GLN  28   4.350   7.257  -1.961
  263    HG3  GLN  28           HG2      GLN  28   4.575   8.185  -0.484
  264   HE21  GLN  28          HE22      GLN  28   6.651   8.762   0.136
  265   HE22  GLN  28          HE21      GLN  28   8.019   8.592  -0.912
  266    H    GLY  29           H        GLY  29   3.786   5.994   2.695
  267    HA2  GLY  29           HA3      GLY  29   4.440   8.688   3.704
  268    HA3  GLY  29           HA2      GLY  29   2.795   8.075   3.583
  Start of MODEL    9
    1    H1   ARG   1           H1       ARG   1 -11.060   2.996   2.699
    2    H2   ARG   1           H2       ARG   1  -9.727   2.262   1.974
    3    H3   ARG   1           H3       ARG   1 -10.106   1.921   3.587
    4    HA   ARG   1           HA       ARG   1 -12.208   0.936   2.886
    5    HB2  ARG   1           HB3      ARG   1 -11.049   1.335   0.119
    6    HB3  ARG   1           HB2      ARG   1 -12.498   0.412   0.489
    7    HG2  ARG   1           HG3      ARG   1 -13.576   2.431   1.331
    8    HG3  ARG   1           HG2      ARG   1 -12.123   3.359   0.970
    9    HD2  ARG   1           HD3      ARG   1 -12.371   2.760  -1.409
   10    HD3  ARG   1           HD2      ARG   1 -13.866   1.913  -1.018
   11    HE   ARG   1           HE       ARG   1 -13.993   4.573  -0.077
   12   HH11  ARG   1          HH12      ARG   1 -14.083   2.732  -3.048
   13   HH12  ARG   1          HH11      ARG   1 -15.053   3.893  -3.891
   14   HH21  ARG   1          HH21      ARG   1 -15.258   6.119  -1.186
   15   HH22  ARG   1          HH22      ARG   1 -15.716   5.829  -2.832
   16    H    LYS   2           H        LYS   2  -8.863   0.636   2.134
   17    HA   LYS   2           HA       LYS   2  -7.393  -1.026   2.499
   18    HB2  LYS   2           HB3      LYS   2  -9.811  -2.301   3.685
   19    HB3  LYS   2           HB2      LYS   2  -8.359  -3.256   3.419
   20    HG2  LYS   2           HG3      LYS   2  -7.132  -2.082   4.976
   21    HG3  LYS   2           HG2      LYS   2  -8.177  -0.662   4.894
   22    HD2  LYS   2           HD3      LYS   2  -9.946  -1.871   6.040
   23    HD3  LYS   2           HD2      LYS   2  -8.981  -3.346   6.030
   24    HE2  LYS   2           HE3      LYS   2  -8.131  -0.800   7.389
   25    HE3  LYS   2           HE2      LYS   2  -9.009  -2.091   8.205
   26    HZ1  LYS   2           HZ1      LYS   2  -7.189  -3.599   7.665
   27    HZ2  LYS   2           HZ2      LYS   2  -6.644  -2.287   8.581
   28    HZ3  LYS   2           HZ3      LYS   2  -6.341  -2.340   6.921
   29    H    CYS   3           H        CYS   3 -10.353  -2.579   1.259
   30    HA   CYS   3           HA       CYS   3 -10.692  -4.088  -0.419
   31    HB2  CYS   3           HB3      CYS   3  -8.126  -3.194  -1.710
   32    HB3  CYS   3           HB2      CYS   3  -9.577  -3.797  -2.481
   33    H    ASN   4           H        ASN   4  -8.582  -5.374  -1.987
   34    HA   ASN   4           HA       ASN   4  -7.382  -7.097   0.048
   35    HB2  ASN   4           HB3      ASN   4  -7.730  -7.350  -2.943
   36    HB3  ASN   4           HB2      ASN   4  -6.658  -8.417  -2.045
   37   HD21  ASN   4          HD22      ASN   4  -9.969  -7.451  -2.552
   38   HD22  ASN   4          HD21      ASN   4 -10.690  -8.849  -1.838
   39    H    PHE   5           H        PHE   5  -5.115  -7.883  -1.447
   40    HA   PHE   5           HA       PHE   5  -3.205  -5.926  -0.976
   41    HB2  PHE   5           HB3      PHE   5  -1.836  -7.251  -2.693
   42    HB3  PHE   5           HB2      PHE   5  -2.444  -8.143  -1.306
   43    HD1  PHE   5           HD2      PHE   5  -2.936  -7.502  -4.903
   44    HD2  PHE   5           HD1      PHE   5  -3.955  -9.948  -1.578
   45    HE1  PHE   5           HE2      PHE   5  -3.999  -9.117  -6.420
   46    HE2  PHE   5           HE1      PHE   5  -5.022 -11.567  -3.089
   47    HZ   PHE   5           HZ       PHE   5  -5.022 -11.177  -5.502
   48    H    LEU   6           H        LEU   6  -2.075  -4.479  -2.387
   49    HA   LEU   6           HA       LEU   6  -2.056  -2.698  -3.755
   50    HB2  LEU   6           HB3      LEU   6  -3.428  -4.655  -5.587
   51    HB3  LEU   6           HB2      LEU   6  -2.954  -3.048  -6.093
   52    HG   LEU   6           HG       LEU   6  -1.209  -4.353  -6.868
   53   HD11  LEU   6          HD11      LEU   6  -0.131  -3.700  -4.136
   54   HD12  LEU   6          HD12      LEU   6  -0.474  -2.477  -5.363
   55   HD13  LEU   6          HD13      LEU   6   0.718  -3.734  -5.686
   56   HD21  LEU   6          HD21      LEU   6  -1.778  -6.468  -5.954
   57   HD22  LEU   6          HD22      LEU   6  -1.394  -5.930  -4.317
   58   HD23  LEU   6          HD23      LEU   6  -0.107  -6.126  -5.507
   59    H    CYS   7           H        CYS   7  -3.455  -1.784  -2.133
   60    HA   CYS   7           HA       CYS   7  -5.330  -0.074  -3.273
   61    HB2  CYS   7           HB3      CYS   7  -6.925  -1.915  -3.324
   62    HB3  CYS   7           HB2      CYS   7  -6.594  -2.280  -1.633
   63    H    LYS   8           H        LYS   8  -3.999  -1.676  -0.539
   64    HA   LYS   8           HA       LYS   8  -3.315   0.643   0.883
   65    HB2  LYS   8           HB3      LYS   8  -5.726   0.760   1.351
   66    HB3  LYS   8           HB2      LYS   8  -5.694  -0.885   1.958
   67    HG2  LYS   8           HG3      LYS   8  -4.405  -0.240   3.856
   68    HG3  LYS   8           HG2      LYS   8  -4.160   1.377   3.202
   69    HD2  LYS   8           HD3      LYS   8  -6.518   1.865   3.406
   70    HD3  LYS   8           HD2      LYS   8  -6.835   0.218   3.947
   71    HE2  LYS   8           HE3      LYS   8  -5.582   0.571   5.956
   72    HE3  LYS   8           HE2      LYS   8  -5.037   2.145   5.391
   73    HZ1  LYS   8           HZ1      LYS   8  -6.852   2.273   7.019
   74    HZ2  LYS   8           HZ2      LYS   8  -7.870   1.455   5.943
   75    HZ3  LYS   8           HZ3      LYS   8  -7.262   2.980   5.538
   76    H    LEU   9           H        LEU   9  -3.719  -2.749   0.585
   77    HA   LEU   9           HA       LEU   9  -2.394  -3.429   3.053
   78    HB2  LEU   9           HB3      LEU   9  -3.765  -4.968   0.896
   79    HB3  LEU   9           HB2      LEU   9  -2.684  -5.804   1.994
   80    HG   LEU   9           HG       LEU   9  -4.074  -4.971   3.900
   81   HD11  LEU   9          HD11      LEU   9  -6.310  -4.133   3.440
   82   HD12  LEU   9          HD12      LEU   9  -5.958  -4.115   1.713
   83   HD13  LEU   9          HD13      LEU   9  -5.081  -3.042   2.804
   84   HD21  LEU   9          HD21      LEU   9  -4.345  -7.221   3.018
   85   HD22  LEU   9          HD22      LEU   9  -5.499  -6.626   1.825
   86   HD23  LEU   9          HD23      LEU   9  -5.893  -6.559   3.543
   87    H    LYS  10           H        LYS  10  -1.815  -5.113  -0.001
   88    HA   LYS  10           HA       LYS  10   0.890  -5.573   0.660
   89    HB2  LYS  10           HB3      LYS  10  -0.458  -7.046  -0.821
   90    HB3  LYS  10           HB2      LYS  10  -0.407  -5.803  -2.061
   91    HG2  LYS  10           HG3      LYS  10   1.224  -7.511  -2.543
   92    HG3  LYS  10           HG2      LYS  10   2.043  -6.002  -2.142
   93    HD2  LYS  10           HD3      LYS  10   3.205  -7.773  -1.040
   94    HD3  LYS  10           HD2      LYS  10   2.322  -6.872   0.191
   95    HE2  LYS  10           HE3      LYS  10   1.970  -9.136   0.716
   96    HE3  LYS  10           HE2      LYS  10   0.487  -8.612  -0.078
   97    HZ1  LYS  10           HZ1      LYS  10   2.688 -10.171  -1.314
   98    HZ2  LYS  10           HZ2      LYS  10   1.334  -9.593  -2.149
   99    HZ3  LYS  10           HZ3      LYS  10   1.144 -10.737  -0.923
  100    H    GLU  11           H        GLU  11  -0.648  -3.290  -1.509
  101    HA   GLU  11           HA       GLU  11   0.108  -1.585  -2.762
  102    HB2  GLU  11           HB3      GLU  11   1.533  -1.175  -0.153
  103    HB3  GLU  11           HB2      GLU  11   1.532   0.029  -1.436
  104    HG2  GLU  11           HG3      GLU  11  -0.613  -0.776   0.390
  105    HG3  GLU  11           HG2      GLU  11  -0.324   0.768  -0.424
  106    H    LYS  12           H        LYS  12   2.681  -0.225  -2.547
  107    HA   LYS  12           HA       LYS  12   4.573  -1.874  -3.802
  108    HB2  LYS  12           HB3      LYS  12   4.130  -1.327  -6.161
  109    HB3  LYS  12           HB2      LYS  12   2.795  -2.213  -5.440
  110    HG2  LYS  12           HG3      LYS  12   2.821   0.772  -5.846
  111    HG3  LYS  12           HG2      LYS  12   2.130  -0.385  -6.982
  112    HD2  LYS  12           HD3      LYS  12   0.798  -1.214  -4.915
  113    HD3  LYS  12           HD2      LYS  12   1.211   0.358  -4.236
  114    HE2  LYS  12           HE3      LYS  12   0.082   1.504  -5.948
  115    HE3  LYS  12           HE2      LYS  12  -0.041   0.045  -6.933
  116    HZ1  LYS  12           HZ1      LYS  12  -2.127   0.722  -5.758
  117    HZ2  LYS  12           HZ2      LYS  12  -1.372   0.341  -4.286
  118    HZ3  LYS  12           HZ3      LYS  12  -1.631  -0.861  -5.455
  119    H    LEU  13           H        LEU  13   3.100   1.356  -4.268
  120    HA   LEU  13           HA       LEU  13   5.084   2.851  -3.056
  121    HB2  LEU  13           HB3      LEU  13   6.471   1.862  -4.945
  122    HB3  LEU  13           HB2      LEU  13   5.487   2.797  -6.051
  123    HG   LEU  13           HG       LEU  13   7.014   4.156  -3.844
  124   HD11  LEU  13          HD11      LEU  13   8.059   3.438  -6.578
  125   HD12  LEU  13          HD12      LEU  13   8.627   2.781  -5.042
  126   HD13  LEU  13          HD13      LEU  13   8.859   4.491  -5.410
  127   HD21  LEU  13          HD21      LEU  13   6.114   5.055  -6.580
  128   HD22  LEU  13          HD22      LEU  13   6.971   6.040  -5.395
  129   HD23  LEU  13          HD23      LEU  13   5.339   5.468  -5.050
  130    H    ARG  14           H        ARG  14   3.997   4.664  -2.595
  131    HA   ARG  14           HA       ARG  14   3.170   6.374  -4.681
  132    HB2  ARG  14           HB3      ARG  14   1.204   4.836  -4.625
  133    HB3  ARG  14           HB2      ARG  14   0.918   5.330  -2.963
  134    HG2  ARG  14           HG3      ARG  14  -0.541   6.498  -4.546
  135    HG3  ARG  14           HG2      ARG  14   0.514   7.610  -3.673
  136    HD2  ARG  14           HD3      ARG  14   2.012   7.705  -5.595
  137    HD3  ARG  14           HD2      ARG  14   0.987   6.566  -6.464
  138    HE   ARG  14           HE       ARG  14  -0.763   8.484  -5.974
  139   HH11  ARG  14          HH11      ARG  14   2.561   8.756  -7.030
  140   HH12  ARG  14          HH12      ARG  14   2.288  10.200  -7.949
  141   HH21  ARG  14          HH22      ARG  14  -1.128  10.397  -7.173
  142   HH22  ARG  14          HH21      ARG  14   0.187  11.136  -8.031
  143    H    THR  15           H        THR  15   1.431   6.336  -1.630
  144    HA   THR  15           HA       THR  15   3.206   8.358  -0.531
  145    HB   THR  15           HB       THR  15   0.270   8.973  -0.835
  146    HG1  THR  15           HG1      THR  15   2.428   9.934  -2.444
  147   HG21  THR  15          HG21      THR  15   2.645  10.741  -0.250
  148   HG22  THR  15          HG22      THR  15   1.518  10.125   0.954
  149   HG23  THR  15          HG23      THR  15   0.952  11.234  -0.291
  150    H    VAL  16           H        VAL  16  -0.145   7.181   0.101
  151    HA   VAL  16           HA       VAL  16   0.712   6.286   2.732
  152    HB   VAL  16           HB       VAL  16  -1.425   8.400   2.401
  153   HG11  VAL  16          HG11      VAL  16  -0.651   6.778   4.823
  154   HG12  VAL  16          HG12      VAL  16  -2.203   6.762   3.986
  155   HG13  VAL  16          HG13      VAL  16  -1.689   8.205   4.861
  156   HG21  VAL  16          HG21      VAL  16  -0.051   9.728   3.902
  157   HG22  VAL  16          HG22      VAL  16   0.872   9.264   2.476
  158   HG23  VAL  16          HG23      VAL  16   1.132   8.425   4.001
  159    H    ILE  17           H        ILE  17  -2.423   6.957   1.081
  160    HA   ILE  17           HA       ILE  17  -3.558   4.587   2.160
  161    HB   ILE  17           HB       ILE  17  -4.980   6.473   1.551
  162   HG12  ILE  17          HG13      ILE  17  -6.784   5.256   0.484
  163   HG13  ILE  17          HG12      ILE  17  -5.652   4.075  -0.162
  164   HG21  ILE  17          HG21      ILE  17  -5.501   6.959  -0.802
  165   HG22  ILE  17          HG22      ILE  17  -4.241   5.829  -1.298
  166   HG23  ILE  17          HG23      ILE  17  -3.816   7.287  -0.403
  167   HD11  ILE  17          HD11      ILE  17  -5.878   4.472   2.786
  168   HD12  ILE  17          HD12      ILE  17  -5.349   3.046   1.884
  169   HD13  ILE  17          HD13      ILE  17  -7.061   3.493   1.920
  170    H    THR  18           H        THR  18  -1.800   5.277  -0.746
  171    HA   THR  18           HA       THR  18  -2.308   2.564  -1.738
  172    HB   THR  18           HB       THR  18  -0.833   4.659  -3.295
  173    HG1  THR  18           HG1      THR  18  -3.572   4.615  -2.645
  174   HG21  THR  18          HG21      THR  18  -2.777   2.509  -4.120
  175   HG22  THR  18          HG22      THR  18  -1.023   2.345  -4.120
  176   HG23  THR  18          HG23      THR  18  -1.797   3.513  -5.189
  177    H    SER  19           H        SER  19  -0.439   3.862   0.384
  178    HA   SER  19           HA       SER  19   1.746   2.024  -0.069
  179    HB2  SER  19           HB3      SER  19   2.460   4.017  -1.323
  180    HB3  SER  19           HB2      SER  19   2.202   5.017   0.104
  181    HG   SER  19           HG       SER  19   3.828   3.631   1.130
  182    H    HIS  20           H        HIS  20   0.060   1.577   1.869
  183    HA   HIS  20           HA       HIS  20   0.908   3.098   4.240
  184    HB2  HIS  20           HB3      HIS  20  -1.565   2.992   3.530
  185    HB3  HIS  20           HB2      HIS  20  -1.531   1.344   4.153
  186    HD1  HIS  20           HD1      HIS  20  -0.220   4.640   5.560
  187    HD2  HIS  20           HD2      HIS  20  -2.609   1.409   6.632
  188    HE1  HIS  20           HE1      HIS  20  -0.930   5.079   7.932
  189    HE2  HIS  20           HE2      HIS  20  -2.314   3.077   8.588
  190    H    ILE  21           H        ILE  21  -0.478  -0.173   3.941
  191    HA   ILE  21           HA       ILE  21   1.224  -1.161   6.013
  192    HB   ILE  21           HB       ILE  21  -0.624  -2.565   4.074
  193   HG12  ILE  21          HG13      ILE  21  -1.798  -3.138   6.273
  194   HG13  ILE  21          HG12      ILE  21  -0.751  -1.941   7.024
  195   HG21  ILE  21          HG21      ILE  21  -0.254  -4.622   5.382
  196   HG22  ILE  21          HG22      ILE  21   1.044  -3.807   6.255
  197   HG23  ILE  21          HG23      ILE  21   1.189  -4.090   4.520
  198   HD11  ILE  21          HD11      ILE  21  -1.684  -0.217   5.587
  199   HD12  ILE  21          HD12      ILE  21  -2.941  -1.028   6.521
  200   HD13  ILE  21          HD13      ILE  21  -2.720  -1.415   4.814
  201    H    ASP  22           H        ASP  22   0.926  -2.000   2.600
  202    HA   ASP  22           HA       ASP  22   2.404  -2.388   0.962
  203    HB2  ASP  22           HB3      ASP  22   3.547  -0.342   1.704
  204    HB3  ASP  22           HB2      ASP  22   4.465  -1.262   2.874
  205    H    LYS  23           H        LYS  23   4.129  -3.805   0.294
  206    HA   LYS  23           HA       LYS  23   4.453  -6.274   1.302
  207    HB2  LYS  23           HB3      LYS  23   6.730  -4.590   0.229
  208    HB3  LYS  23           HB2      LYS  23   6.711  -6.342   0.320
  209    HG2  LYS  23           HG3      LYS  23   6.153  -6.093  -1.857
  210    HG3  LYS  23           HG2      LYS  23   4.538  -6.033  -1.157
  211    HD2  LYS  23           HD3      LYS  23   4.712  -4.262  -2.751
  212    HD3  LYS  23           HD2      LYS  23   4.717  -3.537  -1.148
  213    HE2  LYS  23           HE3      LYS  23   6.368  -2.556  -2.739
  214    HE3  LYS  23           HE2      LYS  23   7.085  -3.157  -1.247
  215    HZ1  LYS  23           HZ1      LYS  23   7.681  -5.200  -2.459
  216    HZ2  LYS  23           HZ2      LYS  23   8.401  -3.829  -3.132
  217    HZ3  LYS  23           HZ3      LYS  23   7.062  -4.531  -3.882
  218    H    VAL  24           H        VAL  24   6.216  -3.377   2.384
  219    HA   VAL  24           HA       VAL  24   6.604  -4.292   5.017
  220    HB   VAL  24           HB       VAL  24   8.034  -5.976   3.879
  221   HG11  VAL  24          HG11      VAL  24   9.749  -3.615   3.135
  222   HG12  VAL  24          HG12      VAL  24   8.831  -4.632   2.025
  223   HG13  VAL  24          HG13      VAL  24  10.184  -5.311   2.928
  224   HG21  VAL  24          HG21      VAL  24   8.471  -5.418   6.193
  225   HG22  VAL  24          HG22      VAL  24   9.504  -4.077   5.699
  226   HG23  VAL  24          HG23      VAL  24   9.985  -5.736   5.347
  227    H    LEU  25           H        LEU  25   5.910  -1.920   3.632
  228    HA   LEU  25           HA       LEU  25   6.325   0.303   3.436
  229    HB2  LEU  25           HB3      LEU  25   7.950  -0.331   5.892
  230    HB3  LEU  25           HB2      LEU  25   7.789   1.299   5.273
  231    HG   LEU  25           HG       LEU  25   5.260   0.960   5.507
  232   HD11  LEU  25          HD11      LEU  25   4.566  -0.671   7.185
  233   HD12  LEU  25          HD12      LEU  25   6.210  -1.302   7.252
  234   HD13  LEU  25          HD13      LEU  25   5.267  -1.456   5.770
  235   HD21  LEU  25          HD21      LEU  25   5.314   1.570   7.869
  236   HD22  LEU  25          HD22      LEU  25   6.570   2.410   6.960
  237   HD23  LEU  25          HD23      LEU  25   6.989   1.029   7.974
  238    H    ARG  26           H        ARG  26   7.564  -0.957   1.559
  239    HA   ARG  26           HA       ARG  26  10.391  -0.413   1.547
  240    HB2  ARG  26           HB3      ARG  26   9.883  -2.387   0.433
  241    HB3  ARG  26           HB2      ARG  26   8.457  -1.708  -0.337
  242    HG2  ARG  26           HG3      ARG  26  11.035  -0.502  -1.098
  243    HG3  ARG  26           HG2      ARG  26  10.767  -2.167  -1.613
  244    HD2  ARG  26           HD3      ARG  26   8.832  -1.592  -2.825
  245    HD3  ARG  26           HD2      ARG  26   8.719  -0.011  -2.046
  246    HE   ARG  26           HE       ARG  26  11.152  -0.091  -3.391
  247   HH11  ARG  26          HH11      ARG  26   7.745  -0.206  -4.229
  248   HH12  ARG  26          HH12      ARG  26   7.989   0.473  -5.806
  249   HH21  ARG  26          HH22      ARG  26  11.460   0.802  -5.462
  250   HH22  ARG  26          HH21      ARG  26  10.098   1.043  -6.509
  251    HA   PRO  27           HA       PRO  27   8.990   2.665  -1.904
  252    HB2  PRO  27           HB2      PRO  27   6.488   3.731  -1.661
  253    HB3  PRO  27           HB3      PRO  27   6.875   2.321  -2.668
  254    HG2  PRO  27           HG3      PRO  27   5.721   2.419   0.093
  255    HG3  PRO  27           HG2      PRO  27   5.238   1.409  -1.281
  256    HD2  PRO  27           HD3      PRO  27   6.770   0.456   0.704
  257    HD3  PRO  27           HD2      PRO  27   6.999  -0.059  -0.978
  258    H    GLN  28           H        GLN  28   6.836   3.619   0.774
  259    HA   GLN  28           HA       GLN  28   8.475   6.040   1.127
  260    HB2  GLN  28           HB3      GLN  28   5.551   5.568   1.762
  261    HB3  GLN  28           HB2      GLN  28   6.423   7.059   2.081
  262    HG2  GLN  28           HG3      GLN  28   6.109   5.884  -0.668
  263    HG3  GLN  28           HG2      GLN  28   4.987   7.053   0.025
  264   HE21  GLN  28          HE22      GLN  28   5.447   8.548  -1.590
  265   HE22  GLN  28          HE21      GLN  28   6.933   9.435  -1.625
  266    H    GLY  29           H        GLY  29   9.540   3.954   2.317
  267    HA2  GLY  29           HA3      GLY  29   9.115   4.432   5.145
  268    HA3  GLY  29           HA2      GLY  29   8.761   2.800   4.587
  Start of MODEL   10
    1    H1   ARG   1           H1       ARG   1 -11.743   1.353   0.638
    2    H2   ARG   1           H2       ARG   1 -10.300   1.938   1.289
    3    H3   ARG   1           H3       ARG   1 -11.542   1.424   2.314
    4    HA   ARG   1           HA       ARG   1  -9.792  -0.194   2.224
    5    HB2  ARG   1           HB3      ARG   1 -11.148  -2.158   1.629
    6    HB3  ARG   1           HB2      ARG   1 -12.056  -1.002   2.588
    7    HG2  ARG   1           HG3      ARG   1 -13.124  -0.175   0.531
    8    HG3  ARG   1           HG2      ARG   1 -12.254  -1.402  -0.388
    9    HD2  ARG   1           HD3      ARG   1 -14.158  -1.983   1.875
   10    HD3  ARG   1           HD2      ARG   1 -14.589  -2.033   0.168
   11    HE   ARG   1           HE       ARG   1 -12.413  -3.697   0.435
   12   HH11  ARG   1          HH12      ARG   1 -15.631  -3.510   1.786
   13   HH12  ARG   1          HH11      ARG   1 -15.802  -5.227   1.962
   14   HH21  ARG   1          HH21      ARG   1 -12.635  -5.972   0.643
   15   HH22  ARG   1          HH22      ARG   1 -14.096  -6.629   1.310
   16    H    LYS   2           H        LYS   2 -11.124   0.600  -0.943
   17    HA   LYS   2           HA       LYS   2 -10.181   0.663  -2.990
   18    HB2  LYS   2           HB3      LYS   2  -7.641   0.089  -1.472
   19    HB3  LYS   2           HB2      LYS   2  -7.705   0.503  -3.181
   20    HG2  LYS   2           HG3      LYS   2  -8.807   2.294  -1.039
   21    HG3  LYS   2           HG2      LYS   2  -7.124   2.360  -1.558
   22    HD2  LYS   2           HD3      LYS   2  -9.483   2.671  -3.414
   23    HD3  LYS   2           HD2      LYS   2  -8.620   4.022  -2.676
   24    HE2  LYS   2           HE3      LYS   2  -6.558   3.316  -3.765
   25    HE3  LYS   2           HE2      LYS   2  -7.389   1.934  -4.474
   26    HZ1  LYS   2           HZ1      LYS   2  -7.981   4.789  -5.020
   27    HZ2  LYS   2           HZ2      LYS   2  -8.823   3.476  -5.673
   28    HZ3  LYS   2           HZ3      LYS   2  -7.196   3.715  -6.063
   29    H    CYS   3           H        CYS   3  -7.998  -1.819  -1.699
   30    HA   CYS   3           HA       CYS   3  -9.503  -4.036  -2.606
   31    HB2  CYS   3           HB3      CYS   3  -8.411  -4.688  -4.576
   32    HB3  CYS   3           HB2      CYS   3  -8.619  -2.956  -4.788
   33    H    ASN   4           H        ASN   4  -7.802  -2.952  -0.394
   34    HA   ASN   4           HA       ASN   4  -6.149  -3.512   1.060
   35    HB2  ASN   4           HB3      ASN   4  -7.061  -6.214   0.120
   36    HB3  ASN   4           HB2      ASN   4  -5.758  -6.052   1.293
   37   HD21  ASN   4          HD22      ASN   4  -6.860  -6.940   2.995
   38   HD22  ASN   4          HD21      ASN   4  -8.224  -6.179   3.740
   39    H    PHE   5           H        PHE   5  -5.051  -6.286  -0.702
   40    HA   PHE   5           HA       PHE   5  -2.447  -5.172  -0.601
   41    HB2  PHE   5           HB3      PHE   5  -1.712  -7.244  -1.724
   42    HB3  PHE   5           HB2      PHE   5  -2.699  -7.538  -0.305
   43    HD1  PHE   5           HD1      PHE   5  -5.152  -8.135  -0.653
   44    HD2  PHE   5           HD2      PHE   5  -2.275  -8.186  -3.782
   45    HE1  PHE   5           HE1      PHE   5  -6.614  -9.612  -1.967
   46    HE2  PHE   5           HE2      PHE   5  -3.733  -9.656  -5.107
   47    HZ   PHE   5           HZ       PHE   5  -5.904 -10.372  -4.198
   48    H    LEU   6           H        LEU   6  -1.273  -4.168  -2.002
   49    HA   LEU   6           HA       LEU   6  -0.629  -2.944  -3.780
   50    HB2  LEU   6           HB3      LEU   6  -2.561  -4.696  -5.289
   51    HB3  LEU   6           HB2      LEU   6  -1.626  -3.430  -6.055
   52    HG   LEU   6           HG       LEU   6  -0.462  -5.410  -6.504
   53   HD11  LEU   6          HD11      LEU   6   0.878  -4.150  -4.115
   54   HD12  LEU   6          HD12      LEU   6   1.015  -3.636  -5.796
   55   HD13  LEU   6          HD13      LEU   6   1.653  -5.201  -5.301
   56   HD21  LEU   6          HD21      LEU   6  -1.602  -6.863  -4.933
   57   HD22  LEU   6          HD22      LEU   6  -0.704  -6.149  -3.588
   58   HD23  LEU   6          HD23      LEU   6   0.145  -7.075  -4.834
   59    H    CYS   7           H        CYS   7  -2.685  -2.138  -1.988
   60    HA   CYS   7           HA       CYS   7  -3.820   0.050  -3.511
   61    HB2  CYS   7           HB3      CYS   7  -5.511  -2.104  -2.283
   62    HB3  CYS   7           HB2      CYS   7  -6.108  -0.465  -2.433
   63    H    LYS   8           H        LYS   8  -3.790  -1.671  -0.443
   64    HA   LYS   8           HA       LYS   8  -3.045   0.792   0.950
   65    HB2  LYS   8           HB3      LYS   8  -5.456   0.571   1.355
   66    HB3  LYS   8           HB2      LYS   8  -5.234  -1.097   1.864
   67    HG2  LYS   8           HG3      LYS   8  -3.880  -0.324   3.762
   68    HG3  LYS   8           HG2      LYS   8  -4.155   1.345   3.262
   69    HD2  LYS   8           HD3      LYS   8  -6.322  -0.612   4.015
   70    HD3  LYS   8           HD2      LYS   8  -5.653   0.614   5.091
   71    HE2  LYS   8           HE3      LYS   8  -6.391   2.361   3.528
   72    HE3  LYS   8           HE2      LYS   8  -7.087   1.122   2.484
   73    HZ1  LYS   8           HZ1      LYS   8  -8.571   0.495   4.287
   74    HZ2  LYS   8           HZ2      LYS   8  -8.762   2.130   3.898
   75    HZ3  LYS   8           HZ3      LYS   8  -7.903   1.686   5.284
   76    H    LEU   9           H        LEU   9  -3.470  -2.646   0.892
   77    HA   LEU   9           HA       LEU   9  -1.102  -3.091   2.531
   78    HB2  LEU   9           HB3      LEU   9  -3.117  -4.981   1.295
   79    HB3  LEU   9           HB2      LEU   9  -1.665  -5.528   2.105
   80    HG   LEU   9           HG       LEU   9  -2.519  -4.386   4.188
   81   HD11  LEU   9          HD11      LEU   9  -5.118  -4.321   2.676
   82   HD12  LEU   9          HD12      LEU   9  -4.114  -2.908   2.998
   83   HD13  LEU   9          HD13      LEU   9  -4.832  -3.804   4.339
   84   HD21  LEU   9          HD21      LEU   9  -4.201  -6.591   3.020
   85   HD22  LEU   9          HD22      LEU   9  -4.059  -6.192   4.730
   86   HD23  LEU   9          HD23      LEU   9  -2.659  -6.798   3.847
   87    H    LYS  10           H        LYS  10  -0.142  -5.313   1.233
   88    HA   LYS  10           HA       LYS  10   1.884  -5.448   0.176
   89    HB2  LYS  10           HB3      LYS  10  -0.006  -6.369  -1.282
   90    HB3  LYS  10           HB2      LYS  10   0.273  -4.959  -2.292
   91    HG2  LYS  10           HG3      LYS  10   1.544  -6.692  -3.244
   92    HG3  LYS  10           HG2      LYS  10   2.689  -5.657  -2.391
   93    HD2  LYS  10           HD3      LYS  10   3.274  -7.919  -1.906
   94    HD3  LYS  10           HD2      LYS  10   2.546  -7.235  -0.453
   95    HE2  LYS  10           HE3      LYS  10   1.623  -9.399  -0.708
   96    HE3  LYS  10           HE2      LYS  10   0.370  -8.258  -1.193
   97    HZ1  LYS  10           HZ1      LYS  10   2.113  -9.848  -2.991
   98    HZ2  LYS  10           HZ2      LYS  10   1.037  -8.658  -3.522
   99    HZ3  LYS  10           HZ3      LYS  10   0.451 -10.045  -2.756
  100    H    GLU  11           H        GLU  11   0.203  -2.881  -1.603
  101    HA   GLU  11           HA       GLU  11   0.728  -0.816  -2.214
  102    HB2  GLU  11           HB3      GLU  11   2.178   0.479  -1.066
  103    HB3  GLU  11           HB2      GLU  11   2.060  -0.863   0.052
  104    HG2  GLU  11           HG3      GLU  11   4.298  -0.439   0.005
  105    HG3  GLU  11           HG2      GLU  11   4.155  -1.750  -1.157
  106    H    LYS  12           H        LYS  12   2.458   0.430  -3.532
  107    HA   LYS  12           HA       LYS  12   3.983  -1.111  -5.350
  108    HB2  LYS  12           HB3      LYS  12   2.347  -0.652  -7.318
  109    HB3  LYS  12           HB2      LYS  12   2.080  -2.045  -6.288
  110    HG2  LYS  12           HG3      LYS  12  -0.031  -1.025  -6.697
  111    HG3  LYS  12           HG2      LYS  12   0.398  -0.710  -5.019
  112    HD2  LYS  12           HD3      LYS  12  -0.553   1.282  -5.994
  113    HD3  LYS  12           HD2      LYS  12   1.162   1.556  -5.678
  114    HE2  LYS  12           HE3      LYS  12   1.605   0.996  -8.076
  115    HE3  LYS  12           HE2      LYS  12  -0.136   0.927  -8.334
  116    HZ1  LYS  12           HZ1      LYS  12  -0.305   3.239  -7.722
  117    HZ2  LYS  12           HZ2      LYS  12   0.829   3.068  -8.963
  118    HZ3  LYS  12           HZ3      LYS  12   1.352   3.314  -7.374
  119    H    LEU  13           H        LEU  13   4.157   1.351  -3.864
  120    HA   LEU  13           HA       LEU  13   4.925   3.467  -4.066
  121    HB2  LEU  13           HB3      LEU  13   6.331   2.708  -5.892
  122    HB3  LEU  13           HB2      LEU  13   5.000   2.857  -7.021
  123    HG   LEU  13           HG       LEU  13   5.002   5.323  -6.602
  124   HD11  LEU  13          HD11      LEU  13   7.004   6.306  -5.576
  125   HD12  LEU  13          HD12      LEU  13   7.544   4.691  -5.113
  126   HD13  LEU  13          HD13      LEU  13   6.062   5.356  -4.426
  127   HD21  LEU  13          HD21      LEU  13   6.083   4.376  -8.557
  128   HD22  LEU  13          HD22      LEU  13   7.561   4.111  -7.633
  129   HD23  LEU  13          HD23      LEU  13   7.001   5.753  -7.949
  130    H    ARG  14           H        ARG  14   3.563   4.994  -3.518
  131    HA   ARG  14           HA       ARG  14   1.708   6.107  -5.404
  132    HB2  ARG  14           HB3      ARG  14   0.777   4.023  -3.718
  133    HB3  ARG  14           HB2      ARG  14   0.072   5.523  -3.133
  134    HG2  ARG  14           HG3      ARG  14  -0.122   4.432  -5.933
  135    HG3  ARG  14           HG2      ARG  14  -1.400   4.445  -4.717
  136    HD2  ARG  14           HD3      ARG  14  -1.302   6.913  -4.696
  137    HD3  ARG  14           HD2      ARG  14  -0.101   6.851  -5.984
  138    HE   ARG  14           HE       ARG  14  -2.279   5.407  -6.886
  139   HH11  ARG  14          HH11      ARG  14  -1.575   8.701  -5.935
  140   HH12  ARG  14          HH12      ARG  14  -2.824   9.391  -6.916
  141   HH21  ARG  14          HH22      ARG  14  -3.923   6.319  -8.196
  142   HH22  ARG  14          HH21      ARG  14  -4.165   8.036  -8.196
  143    H    THR  15           H        THR  15   1.447   5.964  -1.862
  144    HA   THR  15           HA       THR  15   2.750   8.447  -1.448
  145    HB   THR  15           HB       THR  15   0.873   9.480  -2.429
  146    HG1  THR  15           HG1      THR  15  -0.065  10.570  -0.543
  147   HG21  THR  15          HG21      THR  15  -1.430   9.106  -1.826
  148   HG22  THR  15          HG22      THR  15  -0.953   7.951  -0.583
  149   HG23  THR  15          HG23      THR  15  -0.697   7.569  -2.284
  150    H    VAL  16           H        VAL  16  -0.053   6.777   0.060
  151    HA   VAL  16           HA       VAL  16   1.430   5.763   2.216
  152    HB   VAL  16           HB       VAL  16   1.472   8.286   2.698
  153   HG11  VAL  16          HG11      VAL  16  -1.405   7.652   3.266
  154   HG12  VAL  16          HG12      VAL  16  -0.755   8.913   2.210
  155   HG13  VAL  16          HG13      VAL  16  -0.573   9.047   3.961
  156   HG21  VAL  16          HG21      VAL  16   1.188   7.922   5.109
  157   HG22  VAL  16          HG22      VAL  16   2.084   6.607   4.349
  158   HG23  VAL  16          HG23      VAL  16   0.388   6.385   4.778
  159    H    ILE  17           H        ILE  17  -1.671   6.742   0.853
  160    HA   ILE  17           HA       ILE  17  -3.253   5.121   2.563
  161    HB   ILE  17           HB       ILE  17  -4.166   6.931   1.099
  162   HG12  ILE  17          HG13      ILE  17  -5.566   5.020   2.073
  163   HG13  ILE  17          HG12      ILE  17  -6.276   5.961   0.774
  164   HG21  ILE  17          HG21      ILE  17  -3.741   4.957  -1.131
  165   HG22  ILE  17          HG22      ILE  17  -2.933   6.512  -0.926
  166   HG23  ILE  17          HG23      ILE  17  -4.666   6.454  -1.252
  167   HD11  ILE  17          HD11      ILE  17  -6.843   3.792   0.233
  168   HD12  ILE  17          HD12      ILE  17  -5.284   3.138   0.740
  169   HD13  ILE  17          HD13      ILE  17  -5.410   4.069  -0.755
  170    H    THR  18           H        THR  18  -1.550   4.585  -0.446
  171    HA   THR  18           HA       THR  18  -2.218   1.773  -0.498
  172    HB   THR  18           HB       THR  18  -0.327   3.362  -2.239
  173    HG1  THR  18           HG1      THR  18  -3.086   2.835  -2.327
  174   HG21  THR  18          HG21      THR  18  -1.474   0.589  -2.566
  175   HG22  THR  18          HG22      THR  18   0.219   1.007  -2.302
  176   HG23  THR  18          HG23      THR  18  -0.576   1.460  -3.808
  177    H    SER  19           H        SER  19   0.622   3.831  -0.048
  178    HA   SER  19           HA       SER  19   2.220   1.643   0.953
  179    HB2  SER  19           HB3      SER  19   3.161   3.554  -0.357
  180    HB3  SER  19           HB2      SER  19   2.773   4.622   0.990
  181    HG   SER  19           HG       SER  19   4.287   2.324   1.541
  182    H    HIS  20           H        HIS  20  -0.030   1.700   2.400
  183    HA   HIS  20           HA       HIS  20   0.409   3.151   4.884
  184    HB2  HIS  20           HB3      HIS  20  -1.863   3.013   3.822
  185    HB3  HIS  20           HB2      HIS  20  -1.851   1.281   4.135
  186    HD1  HIS  20           HD1      HIS  20  -2.076   4.592   5.903
  187    HD2  HIS  20           HD2      HIS  20  -2.473   0.538   6.737
  188    HE1  HIS  20           HE1      HIS  20  -3.074   4.469   8.207
  189    HE2  HIS  20           HE2      HIS  20  -3.209   2.009   8.732
  190    H    ILE  21           H        ILE  21  -0.335  -0.205   3.952
  191    HA   ILE  21           HA       ILE  21   1.636  -1.085   5.933
  192    HB   ILE  21           HB       ILE  21   0.135  -3.170   6.211
  193   HG12  ILE  21          HG13      ILE  21  -1.910  -1.126   5.318
  194   HG13  ILE  21          HG12      ILE  21  -1.514  -2.629   4.493
  195   HG21  ILE  21          HG21      ILE  21  -1.013  -2.119   8.102
  196   HG22  ILE  21          HG22      ILE  21  -0.604  -0.530   7.459
  197   HG23  ILE  21          HG23      ILE  21   0.674  -1.619   7.996
  198   HD11  ILE  21          HD11      ILE  21  -3.590  -2.815   5.740
  199   HD12  ILE  21          HD12      ILE  21  -2.745  -2.395   7.228
  200   HD13  ILE  21          HD13      ILE  21  -2.362  -3.899   6.391
  201    H    ASP  22           H        ASP  22   3.024  -1.101   4.213
  202    HA   ASP  22           HA       ASP  22   2.569  -2.269   1.710
  203    HB2  ASP  22           HB3      ASP  22   5.322  -2.071   2.890
  204    HB3  ASP  22           HB2      ASP  22   4.799  -1.739   1.248
  205    H    LYS  23           H        LYS  23   4.039  -4.001   0.794
  206    HA   LYS  23           HA       LYS  23   3.830  -6.495   1.978
  207    HB2  LYS  23           HB3      LYS  23   6.070  -6.851   0.501
  208    HB3  LYS  23           HB2      LYS  23   4.454  -6.808  -0.180
  209    HG2  LYS  23           HG3      LYS  23   5.950  -5.459  -1.509
  210    HG3  LYS  23           HG2      LYS  23   4.763  -4.422  -0.720
  211    HD2  LYS  23           HD3      LYS  23   6.581  -4.159   1.102
  212    HD3  LYS  23           HD2      LYS  23   7.680  -4.755  -0.134
  213    HE2  LYS  23           HE3      LYS  23   5.822  -2.472  -0.669
  214    HE3  LYS  23           HE2      LYS  23   7.367  -2.207   0.135
  215    HZ1  LYS  23           HZ1      LYS  23   6.991  -3.461  -2.539
  216    HZ2  LYS  23           HZ2      LYS  23   8.478  -3.179  -1.784
  217    HZ3  LYS  23           HZ3      LYS  23   7.510  -1.878  -2.266
  218    H    VAL  24           H        VAL  24   6.151  -4.000   2.558
  219    HA   VAL  24           HA       VAL  24   7.382  -5.509   4.708
  220    HB   VAL  24           HB       VAL  24   9.655  -5.064   4.022
  221   HG11  VAL  24          HG11      VAL  24   8.135  -6.351   1.769
  222   HG12  VAL  24          HG12      VAL  24   8.774  -7.149   3.205
  223   HG13  VAL  24          HG13      VAL  24   9.876  -6.461   2.014
  224   HG21  VAL  24          HG21      VAL  24   9.360  -2.955   2.880
  225   HG22  VAL  24          HG22      VAL  24   8.508  -3.759   1.563
  226   HG23  VAL  24          HG23      VAL  24  10.218  -4.089   1.837
  227    H    LEU  25           H        LEU  25   9.271  -3.735   5.517
  228    HA   LEU  25           HA       LEU  25   7.639  -1.455   6.239
  229    HB2  LEU  25           HB3      LEU  25  10.403  -2.307   7.099
  230    HB3  LEU  25           HB2      LEU  25   9.632  -0.838   7.657
  231    HG   LEU  25           HG       LEU  25   9.341  -2.414   9.381
  232   HD11  LEU  25          HD11      LEU  25   7.335  -1.116   8.873
  233   HD12  LEU  25          HD12      LEU  25   6.938  -2.706   9.525
  234   HD13  LEU  25          HD13      LEU  25   6.780  -2.399   7.797
  235   HD21  LEU  25          HD21      LEU  25   8.423  -4.647   9.068
  236   HD22  LEU  25          HD22      LEU  25   9.898  -4.429   8.126
  237   HD23  LEU  25          HD23      LEU  25   8.326  -4.373   7.328
  238    H    ARG  26           H        ARG  26   7.704  -0.908   3.804
  239    HA   ARG  26           HA       ARG  26   9.975   0.898   3.344
  240    HB2  ARG  26           HB3      ARG  26  10.166  -0.906   1.838
  241    HB3  ARG  26           HB2      ARG  26   8.445  -0.944   1.521
  242    HG2  ARG  26           HG3      ARG  26   9.713   1.544   0.694
  243    HG3  ARG  26           HG2      ARG  26  10.358   0.110  -0.112
  244    HD2  ARG  26           HD3      ARG  26   8.294  -0.469  -1.010
  245    HD3  ARG  26           HD2      ARG  26   7.397   0.503   0.161
  246    HE   ARG  26           HE       ARG  26   9.009   1.645  -2.042
  247   HH11  ARG  26          HH11      ARG  26   6.241   1.724   0.101
  248   HH12  ARG  26          HH12      ARG  26   5.483   3.039  -0.723
  249   HH21  ARG  26          HH22      ARG  26   8.035   3.418  -3.099
  250   HH22  ARG  26          HH21      ARG  26   6.508   4.022  -2.533
  251    HA   PRO  27           HA       PRO  27   5.506   2.865   2.937
  252    HB2  PRO  27           HB2      PRO  27   6.088   4.220   5.517
  253    HB3  PRO  27           HB3      PRO  27   4.571   3.508   4.928
  254    HG2  PRO  27           HG3      PRO  27   5.976   2.274   6.808
  255    HG3  PRO  27           HG2      PRO  27   5.218   1.351   5.488
  256    HD2  PRO  27           HD3      PRO  27   8.083   2.215   5.786
  257    HD3  PRO  27           HD2      PRO  27   7.437   0.628   5.314
  258    H    GLN  28           H        GLN  28   5.452   4.682   1.790
  259    HA   GLN  28           HA       GLN  28   7.823   6.402   1.844
  260    HB2  GLN  28           HB3      GLN  28   7.128   7.160  -0.354
  261    HB3  GLN  28           HB2      GLN  28   7.167   5.404  -0.310
  262    HG2  GLN  28           HG3      GLN  28   4.726   5.390   0.015
  263    HG3  GLN  28           HG2      GLN  28   4.723   7.147  -0.136
  264   HE21  GLN  28          HE22      GLN  28   5.203   8.077  -2.138
  265   HE22  GLN  28          HE21      GLN  28   5.089   7.177  -3.610
  266    H    GLY  29           H        GLY  29   5.271   6.417   3.602
  267    HA2  GLY  29           HA3      GLY  29   4.642   9.272   3.218
  268    HA3  GLY  29           HA2      GLY  29   3.560   8.111   3.979
  Start of MODEL   11
    1    H1   ARG   1           H1       ARG   1 -11.417   0.039   2.968
    2    H2   ARG   1           H2       ARG   1 -11.600   0.993   4.348
    3    H3   ARG   1           H3       ARG   1 -10.328   1.295   3.275
    4    HA   ARG   1           HA       ARG   1 -13.220   1.643   2.741
    5    HB2  ARG   1           HB3      ARG   1 -12.154   3.397   4.144
    6    HB3  ARG   1           HB2      ARG   1 -10.974   3.666   2.870
    7    HG2  ARG   1           HG3      ARG   1 -12.830   4.301   1.356
    8    HG3  ARG   1           HG2      ARG   1 -13.939   4.150   2.721
    9    HD2  ARG   1           HD3      ARG   1 -12.581   5.841   3.934
   10    HD3  ARG   1           HD2      ARG   1 -11.608   6.046   2.479
   11    HE   ARG   1           HE       ARG   1 -14.370   6.402   1.922
   12   HH11  ARG   1          HH12      ARG   1 -11.601   7.994   3.353
   13   HH12  ARG   1          HH11      ARG   1 -12.201   9.592   3.053
   14   HH21  ARG   1          HH21      ARG   1 -15.165   8.502   1.521
   15   HH22  ARG   1          HH22      ARG   1 -14.227   9.883   2.001
   16    H    LYS   2           H        LYS   2  -9.932   1.651   1.505
   17    HA   LYS   2           HA       LYS   2 -10.802   2.234  -1.196
   18    HB2  LYS   2           HB3      LYS   2  -8.495   2.718   0.199
   19    HB3  LYS   2           HB2      LYS   2  -8.048   1.293  -0.722
   20    HG2  LYS   2           HG3      LYS   2  -9.065   3.893  -1.846
   21    HG3  LYS   2           HG2      LYS   2  -7.400   3.316  -1.878
   22    HD2  LYS   2           HD3      LYS   2  -8.116   1.397  -3.247
   23    HD3  LYS   2           HD2      LYS   2  -9.761   2.041  -3.254
   24    HE2  LYS   2           HE3      LYS   2  -8.962   4.066  -4.360
   25    HE3  LYS   2           HE2      LYS   2  -7.318   3.436  -4.337
   26    HZ1  LYS   2           HZ1      LYS   2  -8.036   1.614  -5.749
   27    HZ2  LYS   2           HZ2      LYS   2  -8.358   3.104  -6.482
   28    HZ3  LYS   2           HZ3      LYS   2  -9.611   2.222  -5.774
   29    H    CYS   3           H        CYS   3  -8.613  -0.263   0.017
   30    HA   CYS   3           HA       CYS   3 -10.195  -2.494  -0.570
   31    HB2  CYS   3           HB3      CYS   3  -8.349  -3.182  -2.471
   32    HB3  CYS   3           HB2      CYS   3  -9.968  -2.600  -2.819
   33    H    ASN   4           H        ASN   4  -8.089  -4.338  -1.175
   34    HA   ASN   4           HA       ASN   4  -6.764  -4.226   1.438
   35    HB2  ASN   4           HB3      ASN   4  -7.259  -6.539  -0.437
   36    HB3  ASN   4           HB2      ASN   4  -6.308  -6.662   1.038
   37   HD21  ASN   4          HD22      ASN   4  -9.474  -6.336  -0.310
   38   HD22  ASN   4          HD21      ASN   4 -10.350  -6.585   1.159
   39    H    PHE   5           H        PHE   5  -5.434  -6.264  -1.001
   40    HA   PHE   5           HA       PHE   5  -2.876  -5.143  -0.487
   41    HB2  PHE   5           HB3      PHE   5  -2.166  -6.774  -2.321
   42    HB3  PHE   5           HB2      PHE   5  -2.875  -7.448  -0.865
   43    HD1  PHE   5           HD2      PHE   5  -3.708  -6.496  -4.359
   44    HD2  PHE   5           HD1      PHE   5  -4.727  -8.836  -0.960
   45    HE1  PHE   5           HE2      PHE   5  -5.389  -7.688  -5.693
   46    HE2  PHE   5           HE1      PHE   5  -6.412 -10.034  -2.288
   47    HZ   PHE   5           HZ       PHE   5  -6.746  -9.463  -4.658
   48    H    LEU   6           H        LEU   6  -1.496  -4.047  -1.838
   49    HA   LEU   6           HA       LEU   6  -0.947  -2.298  -3.178
   50    HB2  LEU   6           HB3      LEU   6  -2.961  -3.588  -5.018
   51    HB3  LEU   6           HB2      LEU   6  -1.911  -2.266  -5.483
   52    HG   LEU   6           HG       LEU   6  -0.885  -4.170  -6.368
   53   HD11  LEU   6          HD11      LEU   6   0.493  -3.752  -3.718
   54   HD12  LEU   6          HD12      LEU   6   0.672  -2.722  -5.142
   55   HD13  LEU   6          HD13      LEU   6   1.203  -4.401  -5.199
   56   HD21  LEU   6          HD21      LEU   6  -2.205  -5.846  -5.207
   57   HD22  LEU   6          HD22      LEU   6  -1.292  -5.559  -3.721
   58   HD23  LEU   6          HD23      LEU   6  -0.489  -6.234  -5.146
   59    H    CYS   7           H        CYS   7  -2.821  -1.804  -1.188
   60    HA   CYS   7           HA       CYS   7  -4.466   0.335  -2.265
   61    HB2  CYS   7           HB3      CYS   7  -5.580  -2.316  -1.447
   62    HB3  CYS   7           HB2      CYS   7  -6.544  -0.868  -1.188
   63    H    LYS   8           H        LYS   8  -3.575  -1.733   0.354
   64    HA   LYS   8           HA       LYS   8  -3.202   0.355   2.241
   65    HB2  LYS   8           HB3      LYS   8  -5.631   0.233   2.475
   66    HB3  LYS   8           HB2      LYS   8  -5.573  -1.513   2.593
   67    HG2  LYS   8           HG3      LYS   8  -4.325  -1.291   4.713
   68    HG3  LYS   8           HG2      LYS   8  -4.560   0.460   4.612
   69    HD2  LYS   8           HD3      LYS   8  -6.950   0.191   4.652
   70    HD3  LYS   8           HD2      LYS   8  -6.796  -1.562   4.563
   71    HE2  LYS   8           HE3      LYS   8  -5.866   0.182   6.836
   72    HE3  LYS   8           HE2      LYS   8  -7.320  -0.808   6.808
   73    HZ1  LYS   8           HZ1      LYS   8  -4.524  -1.787   6.695
   74    HZ2  LYS   8           HZ2      LYS   8  -5.890  -2.769   6.524
   75    HZ3  LYS   8           HZ3      LYS   8  -5.608  -1.962   7.977
   76    H    LEU   9           H        LEU   9  -4.012  -2.988   1.720
   77    HA   LEU   9           HA       LEU   9  -1.634  -3.961   3.054
   78    HB2  LEU   9           HB3      LEU   9  -3.817  -5.285   1.445
   79    HB3  LEU   9           HB2      LEU   9  -2.382  -6.153   1.957
   80    HG   LEU   9           HG       LEU   9  -2.998  -5.672   4.331
   81   HD11  LEU   9          HD11      LEU   9  -5.638  -4.783   3.199
   82   HD12  LEU   9          HD12      LEU   9  -4.395  -3.686   3.796
   83   HD13  LEU   9          HD13      LEU   9  -5.155  -4.838   4.895
   84   HD21  LEU   9          HD21      LEU   9  -5.064  -7.145   2.703
   85   HD22  LEU   9          HD22      LEU   9  -4.792  -7.324   4.437
   86   HD23  LEU   9          HD23      LEU   9  -3.540  -7.808   3.292
   87    H    LYS  10           H        LYS  10  -0.746  -5.820   1.160
   88    HA   LYS  10           HA       LYS  10   1.474  -5.312   0.445
   89    HB2  LYS  10           HB3      LYS  10  -0.220  -6.337  -1.305
   90    HB3  LYS  10           HB2      LYS  10   0.055  -4.808  -2.131
   91    HG2  LYS  10           HG3      LYS  10   2.435  -5.225  -2.200
   92    HG3  LYS  10           HG2      LYS  10   2.226  -6.698  -1.261
   93    HD2  LYS  10           HD3      LYS  10   1.119  -6.204  -4.018
   94    HD3  LYS  10           HD2      LYS  10   2.546  -7.169  -3.639
   95    HE2  LYS  10           HE3      LYS  10   1.079  -8.620  -2.223
   96    HE3  LYS  10           HE2      LYS  10  -0.306  -7.724  -2.849
   97    HZ1  LYS  10           HZ1      LYS  10   1.627  -9.303  -4.462
   98    HZ2  LYS  10           HZ2      LYS  10   0.329  -8.417  -5.089
   99    HZ3  LYS  10           HZ3      LYS  10   0.040  -9.751  -4.092
  100    H    GLU  11           H        GLU  11   1.748  -3.568  -2.111
  101    HA   GLU  11           HA       GLU  11   0.855  -0.978  -1.461
  102    HB2  GLU  11           HB3      GLU  11   2.766   0.114  -0.630
  103    HB3  GLU  11           HB2      GLU  11   2.588  -1.337   0.344
  104    HG2  GLU  11           HG3      GLU  11   4.448  -1.097  -1.999
  105    HG3  GLU  11           HG2      GLU  11   4.899  -0.806  -0.331
  106    H    LYS  12           H        LYS  12   1.947   0.728  -2.729
  107    HA   LYS  12           HA       LYS  12   3.637  -0.078  -4.911
  108    HB2  LYS  12           HB3      LYS  12   2.196   0.563  -6.700
  109    HB3  LYS  12           HB2      LYS  12   1.273  -0.544  -5.699
  110    HG2  LYS  12           HG3      LYS  12   0.704   1.995  -4.697
  111    HG3  LYS  12           HG2      LYS  12   0.690   2.164  -6.452
  112    HD2  LYS  12           HD3      LYS  12  -0.771   0.079  -6.488
  113    HD3  LYS  12           HD2      LYS  12  -0.943   0.309  -4.744
  114    HE2  LYS  12           HE3      LYS  12  -1.906   2.498  -5.089
  115    HE3  LYS  12           HE2      LYS  12  -1.642   2.368  -6.827
  116    HZ1  LYS  12           HZ1      LYS  12  -3.215   0.592  -6.945
  117    HZ2  LYS  12           HZ2      LYS  12  -3.948   1.884  -6.135
  118    HZ3  LYS  12           HZ3      LYS  12  -3.387   0.543  -5.264
  119    H    LEU  13           H        LEU  13   4.388   1.852  -6.106
  120    HA   LEU  13           HA       LEU  13   5.090   3.903  -4.302
  121    HB2  LEU  13           HB3      LEU  13   5.291   3.925  -7.313
  122    HB3  LEU  13           HB2      LEU  13   6.166   4.969  -6.209
  123    HG   LEU  13           HG       LEU  13   6.506   1.983  -6.497
  124   HD11  LEU  13          HD11      LEU  13   8.335   4.285  -7.158
  125   HD12  LEU  13          HD12      LEU  13   7.493   3.256  -8.316
  126   HD13  LEU  13          HD13      LEU  13   8.745   2.574  -7.279
  127   HD21  LEU  13          HD21      LEU  13   6.788   2.624  -4.176
  128   HD22  LEU  13          HD22      LEU  13   7.887   3.922  -4.648
  129   HD23  LEU  13          HD23      LEU  13   8.351   2.239  -4.897
  130    H    ARG  14           H        ARG  14   3.317   4.916  -3.487
  131    HA   ARG  14           HA       ARG  14   2.009   6.836  -5.230
  132    HB2  ARG  14           HB3      ARG  14   0.492   4.925  -5.316
  133    HB3  ARG  14           HB2      ARG  14   0.459   4.851  -3.558
  134    HG2  ARG  14           HG3      ARG  14  -1.551   5.912  -4.395
  135    HG3  ARG  14           HG2      ARG  14  -0.571   7.074  -3.489
  136    HD2  ARG  14           HD3      ARG  14   0.370   7.862  -5.651
  137    HD3  ARG  14           HD2      ARG  14  -0.767   6.806  -6.484
  138    HE   ARG  14           HE       ARG  14  -2.497   8.189  -5.153
  139   HH11  ARG  14          HH11      ARG  14   0.502   9.393  -6.498
  140   HH12  ARG  14          HH12      ARG  14  -0.089  11.009  -6.712
  141   HH21  ARG  14          HH22      ARG  14  -3.293  10.311  -5.462
  142   HH22  ARG  14          HH21      ARG  14  -2.257  11.530  -6.135
  143    H    THR  15           H        THR  15   2.213   5.513  -1.934
  144    HA   THR  15           HA       THR  15   2.614   6.544   0.069
  145    HB   THR  15           HB       THR  15   2.693   9.133  -1.420
  146    HG1  THR  15           HG1      THR  15   5.096   8.648  -1.226
  147   HG21  THR  15          HG21      THR  15   4.139   9.868   0.430
  148   HG22  THR  15          HG22      THR  15   3.955   8.286   1.186
  149   HG23  THR  15          HG23      THR  15   2.558   9.347   1.011
  150    H    VAL  16           H        VAL  16   0.514   6.018   0.705
  151    HA   VAL  16           HA       VAL  16  -1.167   8.035   1.592
  152    HB   VAL  16           HB       VAL  16  -1.496   8.275  -0.937
  153   HG11  VAL  16          HG11      VAL  16  -2.975   5.694  -0.564
  154   HG12  VAL  16          HG12      VAL  16  -1.625   6.027  -1.649
  155   HG13  VAL  16          HG13      VAL  16  -3.196   6.769  -1.944
  156   HG21  VAL  16          HG21      VAL  16  -2.986   9.383   0.550
  157   HG22  VAL  16          HG22      VAL  16  -3.894   7.905   0.846
  158   HG23  VAL  16          HG23      VAL  16  -3.940   8.659  -0.742
  159    H    ILE  17           H        ILE  17  -3.686   6.463   1.252
  160    HA   ILE  17           HA       ILE  17  -3.530   4.634   3.301
  161    HB   ILE  17           HB       ILE  17  -5.672   5.414   2.542
  162   HG12  ILE  17          HG13      ILE  17  -6.926   3.287   2.309
  163   HG13  ILE  17          HG12      ILE  17  -5.407   2.444   2.030
  164   HG21  ILE  17          HG21      ILE  17  -5.125   3.968  -0.045
  165   HG22  ILE  17          HG22      ILE  17  -5.185   5.714   0.188
  166   HG23  ILE  17          HG23      ILE  17  -6.646   4.749   0.391
  167   HD11  ILE  17          HD11      ILE  17  -4.665   3.177   4.283
  168   HD12  ILE  17          HD12      ILE  17  -6.063   2.101   4.289
  169   HD13  ILE  17          HD13      ILE  17  -6.280   3.833   4.547
  170    H    THR  18           H        THR  18  -2.811   4.197  -0.104
  171    HA   THR  18           HA       THR  18  -2.631   1.454  -0.298
  172    HB   THR  18           HB       THR  18  -0.758   3.459  -1.566
  173    HG1  THR  18           HG1      THR  18  -3.453   3.011  -1.897
  174   HG21  THR  18          HG21      THR  18  -0.038   1.175  -1.863
  175   HG22  THR  18          HG22      THR  18  -0.693   1.798  -3.373
  176   HG23  THR  18          HG23      THR  18  -1.655   0.700  -2.388
  177    H    SER  19           H        SER  19   0.117   3.679   0.242
  178    HA   SER  19           HA       SER  19   1.724   1.538   1.300
  179    HB2  SER  19           HB3      SER  19   3.375   3.420   1.646
  180    HB3  SER  19           HB2      SER  19   2.807   3.231  -0.012
  181    HG   SER  19           HG       SER  19   2.169   5.210   1.879
  182    H    HIS  20           H        HIS  20  -0.358   1.432   2.910
  183    HA   HIS  20           HA       HIS  20   0.117   3.117   5.234
  184    HB2  HIS  20           HB3      HIS  20  -2.210   2.491   4.340
  185    HB3  HIS  20           HB2      HIS  20  -1.926   0.919   5.081
  186    HD1  HIS  20           HD1      HIS  20  -0.885   4.184   6.669
  187    HD2  HIS  20           HD2      HIS  20  -3.745   1.199   7.133
  188    HE1  HIS  20           HE1      HIS  20  -2.005   4.652   8.871
  189    HE2  HIS  20           HE2      HIS  20  -3.669   2.786   9.172
  190    H    ILE  21           H        ILE  21  -0.443  -0.413   4.955
  191    HA   ILE  21           HA       ILE  21   1.566  -0.746   7.077
  192    HB   ILE  21           HB       ILE  21  -0.661  -1.696   7.566
  193   HG12  ILE  21          HG13      ILE  21   0.088  -3.960   8.223
  194   HG13  ILE  21          HG12      ILE  21   1.507  -3.771   7.198
  195   HG21  ILE  21          HG21      ILE  21  -1.416  -3.711   6.364
  196   HG22  ILE  21          HG22      ILE  21  -0.114  -3.472   5.197
  197   HG23  ILE  21          HG23      ILE  21  -1.398  -2.271   5.347
  198   HD11  ILE  21          HD11      ILE  21   0.843  -2.064   9.582
  199   HD12  ILE  21          HD12      ILE  21   2.291  -1.948   8.583
  200   HD13  ILE  21          HD13      ILE  21   2.005  -3.389   9.557
  201    H    ASP  22           H        ASP  22   0.921  -1.265   3.797
  202    HA   ASP  22           HA       ASP  22   2.029  -2.149   2.055
  203    HB2  ASP  22           HB3      ASP  22   4.540  -2.380   3.678
  204    HB3  ASP  22           HB2      ASP  22   4.342  -1.922   1.997
  205    H    LYS  23           H        LYS  23   3.684  -4.076   1.453
  206    HA   LYS  23           HA       LYS  23   3.032  -6.351   3.203
  207    HB2  LYS  23           HB3      LYS  23   4.105  -7.743   1.414
  208    HB3  LYS  23           HB2      LYS  23   2.679  -6.867   0.892
  209    HG2  LYS  23           HG3      LYS  23   4.079  -6.544  -0.880
  210    HG3  LYS  23           HG2      LYS  23   4.406  -5.100   0.074
  211    HD2  LYS  23           HD3      LYS  23   6.360  -6.299   1.062
  212    HD3  LYS  23           HD2      LYS  23   6.063  -7.609  -0.083
  213    HE2  LYS  23           HE3      LYS  23   6.207  -5.847  -1.906
  214    HE3  LYS  23           HE2      LYS  23   6.848  -4.752  -0.664
  215    HZ1  LYS  23           HZ1      LYS  23   8.634  -5.830  -1.882
  216    HZ2  LYS  23           HZ2      LYS  23   8.029  -7.362  -1.498
  217    HZ3  LYS  23           HZ3      LYS  23   8.640  -6.366  -0.279
  218    H    VAL  24           H        VAL  24   5.403  -4.090   2.507
  219    HA   VAL  24           HA       VAL  24   6.905  -4.638   4.784
  220    HB   VAL  24           HB       VAL  24   7.664  -6.546   3.152
  221   HG11  VAL  24          HG11      VAL  24   9.545  -5.946   1.717
  222   HG12  VAL  24          HG12      VAL  24   9.277  -4.241   2.084
  223   HG13  VAL  24          HG13      VAL  24   8.054  -5.157   1.205
  224   HG21  VAL  24          HG21      VAL  24   9.651  -4.803   4.594
  225   HG22  VAL  24          HG22      VAL  24   9.937  -6.462   4.072
  226   HG23  VAL  24          HG23      VAL  24   8.708  -6.121   5.288
  227    H    LEU  25           H        LEU  25   8.930  -3.153   4.746
  228    HA   LEU  25           HA       LEU  25   7.942  -0.653   3.752
  229    HB2  LEU  25           HB3      LEU  25  10.217   0.154   4.840
  230    HB3  LEU  25           HB2      LEU  25   8.782  -0.172   5.780
  231    HG   LEU  25           HG       LEU  25  10.962  -0.991   6.741
  232   HD11  LEU  25          HD11      LEU  25   8.917  -1.824   7.627
  233   HD12  LEU  25          HD12      LEU  25  10.036  -3.177   7.462
  234   HD13  LEU  25          HD13      LEU  25   8.732  -2.960   6.296
  235   HD21  LEU  25          HD21      LEU  25  11.828  -3.138   5.911
  236   HD22  LEU  25          HD22      LEU  25  12.032  -1.827   4.750
  237   HD23  LEU  25          HD23      LEU  25  10.750  -3.014   4.521
  238    H    ARG  26           H        ARG  26   8.313  -1.835   1.509
  239    HA   ARG  26           HA       ARG  26  10.849  -0.800   0.472
  240    HB2  ARG  26           HB3      ARG  26  10.295  -2.084  -1.599
  241    HB3  ARG  26           HB2      ARG  26  10.575  -3.054  -0.165
  242    HG2  ARG  26           HG3      ARG  26   8.753  -4.048  -1.216
  243    HG3  ARG  26           HG2      ARG  26   8.053  -3.116   0.104
  244    HD2  ARG  26           HD3      ARG  26   6.718  -2.858  -1.893
  245    HD3  ARG  26           HD2      ARG  26   7.486  -1.326  -1.486
  246    HE   ARG  26           HE       ARG  26   9.209  -2.365  -3.265
  247   HH11  ARG  26          HH11      ARG  26   5.719  -2.061  -3.338
  248   HH12  ARG  26          HH12      ARG  26   5.651  -1.817  -5.056
  249   HH21  ARG  26          HH22      ARG  26   9.111  -2.078  -5.534
  250   HH22  ARG  26          HH21      ARG  26   7.573  -1.860  -6.305
  251    HA   PRO  27           HA       PRO  27   7.340   1.197  -2.233
  252    HB2  PRO  27           HB2      PRO  27   5.506   2.599  -0.780
  253    HB3  PRO  27           HB3      PRO  27   5.240   0.939  -1.345
  254    HG2  PRO  27           HG3      PRO  27   6.108   1.912   1.349
  255    HG3  PRO  27           HG2      PRO  27   4.949   0.637   0.942
  256    HD2  PRO  27           HD3      PRO  27   7.486   0.101   1.701
  257    HD3  PRO  27           HD2      PRO  27   6.608  -0.917   0.545
  258    H    GLN  28           H        GLN  28   7.287   3.000   0.820
  259    HA   GLN  28           HA       GLN  28   8.967   5.067  -0.424
  260    HB2  GLN  28           HB3      GLN  28   6.913   5.566   1.733
  261    HB3  GLN  28           HB2      GLN  28   7.740   6.754   0.739
  262    HG2  GLN  28           HG3      GLN  28   5.641   4.793  -0.163
  263    HG3  GLN  28           HG2      GLN  28   5.451   6.536   0.024
  264   HE21  GLN  28          HE22      GLN  28   8.053   7.147  -1.129
  265   HE22  GLN  28          HE21      GLN  28   7.904   6.874  -2.829
  266    H    GLY  29           H        GLY  29   9.435   2.626   1.311
  267    HA2  GLY  29           HA3      GLY  29  10.473   3.839   3.764
  268    HA3  GLY  29           HA2      GLY  29  10.299   2.115   3.450
  Start of MODEL   12
    1    H1   ARG   1           H1       ARG   1 -11.951   3.067   1.398
    2    H2   ARG   1           H2       ARG   1 -12.625   3.922   0.106
    3    H3   ARG   1           H3       ARG   1 -11.023   3.394   0.023
    4    HA   ARG   1           HA       ARG   1 -13.425   1.670   0.131
    5    HB2  ARG   1           HB3      ARG   1 -12.958   1.113  -2.171
    6    HB3  ARG   1           HB2      ARG   1 -13.083   2.859  -2.029
    7    HG2  ARG   1           HG3      ARG   1 -10.590   2.948  -1.956
    8    HG3  ARG   1           HG2      ARG   1 -10.577   1.222  -2.317
    9    HD2  ARG   1           HD3      ARG   1 -10.276   2.392  -4.367
   10    HD3  ARG   1           HD2      ARG   1 -11.913   1.733  -4.367
   11    HE   ARG   1           HE       ARG   1 -12.237   4.240  -3.382
   12   HH11  ARG   1          HH12      ARG   1 -10.757   2.933  -6.273
   13   HH12  ARG   1          HH11      ARG   1 -11.054   4.358  -7.223
   14   HH21  ARG   1          HH21      ARG   1 -12.634   6.113  -4.622
   15   HH22  ARG   1          HH22      ARG   1 -12.118   6.170  -6.277
   16    H    LYS   2           H        LYS   2  -9.897   1.914   0.039
   17    HA   LYS   2           HA       LYS   2  -8.236   0.470   0.569
   18    HB2  LYS   2           HB3      LYS   2 -10.352  -0.917   2.223
   19    HB3  LYS   2           HB2      LYS   2  -8.607  -1.057   2.417
   20    HG2  LYS   2           HG3      LYS   2  -8.438   1.209   3.148
   21    HG3  LYS   2           HG2      LYS   2 -10.124   1.519   2.755
   22    HD2  LYS   2           HD3      LYS   2 -10.799  -0.134   4.454
   23    HD3  LYS   2           HD2      LYS   2  -9.101  -0.362   4.876
   24    HE2  LYS   2           HE3      LYS   2 -10.153   1.157   6.444
   25    HE3  LYS   2           HE2      LYS   2  -8.949   2.013   5.485
   26    HZ1  LYS   2           HZ1      LYS   2 -11.883   2.065   5.025
   27    HZ2  LYS   2           HZ2      LYS   2 -10.729   2.886   4.100
   28    HZ3  LYS   2           HZ3      LYS   2 -10.970   3.306   5.719
   29    H    CYS   3           H        CYS   3  -7.980  -0.393  -1.518
   30    HA   CYS   3           HA       CYS   3  -9.418  -2.679  -2.439
   31    HB2  CYS   3           HB3      CYS   3  -6.738  -2.374  -3.554
   32    HB3  CYS   3           HB2      CYS   3  -8.300  -2.308  -4.360
   33    H    ASN   4           H        ASN   4  -7.346  -2.353   0.030
   34    HA   ASN   4           HA       ASN   4  -6.245  -3.739   1.396
   35    HB2  ASN   4           HB3      ASN   4  -7.428  -5.885  -0.365
   36    HB3  ASN   4           HB2      ASN   4  -6.468  -6.228   1.070
   37   HD21  ASN   4          HD22      ASN   4  -9.217  -6.920   0.560
   38   HD22  ASN   4          HD21      ASN   4 -10.158  -6.158   1.801
   39    H    PHE   5           H        PHE   5  -5.534  -6.186  -0.903
   40    HA   PHE   5           HA       PHE   5  -2.768  -5.736  -0.599
   41    HB2  PHE   5           HB3      PHE   5  -2.518  -7.478  -2.365
   42    HB3  PHE   5           HB2      PHE   5  -3.517  -7.957  -1.002
   43    HD1  PHE   5           HD1      PHE   5  -5.979  -8.109  -1.272
   44    HD2  PHE   5           HD2      PHE   5  -3.404  -7.324  -4.566
   45    HE1  PHE   5           HE1      PHE   5  -7.790  -8.700  -2.827
   46    HE2  PHE   5           HE2      PHE   5  -5.209  -7.913  -6.125
   47    HZ   PHE   5           HZ       PHE   5  -7.407  -8.601  -5.256
   48    H    LEU   6           H        LEU   6  -1.258  -4.958  -1.945
   49    HA   LEU   6           HA       LEU   6  -0.390  -3.315  -3.244
   50    HB2  LEU   6           HB3      LEU   6  -2.273  -4.635  -5.191
   51    HB3  LEU   6           HB2      LEU   6  -1.121  -3.406  -5.664
   52    HG   LEU   6           HG       LEU   6  -0.197  -5.508  -6.253
   53   HD11  LEU   6          HD11      LEU   6   1.112  -4.398  -3.778
   54   HD12  LEU   6          HD12      LEU   6   1.503  -4.087  -5.473
   55   HD13  LEU   6          HD13      LEU   6   1.826  -5.672  -4.772
   56   HD21  LEU   6          HD21      LEU   6  -1.514  -6.996  -4.929
   57   HD22  LEU   6          HD22      LEU   6  -0.779  -6.403  -3.441
   58   HD23  LEU   6          HD23      LEU   6   0.189  -7.308  -4.602
   59    H    CYS   7           H        CYS   7  -1.954  -2.049  -1.590
   60    HA   CYS   7           HA       CYS   7  -2.984   0.188  -2.940
   61    HB2  CYS   7           HB3      CYS   7  -4.768  -1.221  -3.767
   62    HB3  CYS   7           HB2      CYS   7  -5.102  -1.822  -2.147
   63    H    LYS   8           H        LYS   8  -3.120  -1.860  -0.124
   64    HA   LYS   8           HA       LYS   8  -2.632   0.409   1.595
   65    HB2  LYS   8           HB3      LYS   8  -5.053   0.456   1.509
   66    HB3  LYS   8           HB2      LYS   8  -5.139  -1.266   1.843
   67    HG2  LYS   8           HG3      LYS   8  -4.336  -0.928   4.080
   68    HG3  LYS   8           HG2      LYS   8  -4.047   0.784   3.757
   69    HD2  LYS   8           HD3      LYS   8  -6.399   1.173   3.452
   70    HD3  LYS   8           HD2      LYS   8  -6.743  -0.549   3.592
   71    HE2  LYS   8           HE3      LYS   8  -5.501   1.097   5.780
   72    HE3  LYS   8           HE2      LYS   8  -7.237   0.817   5.629
   73    HZ1  LYS   8           HZ1      LYS   8  -6.238  -0.734   7.171
   74    HZ2  LYS   8           HZ2      LYS   8  -5.157  -1.275   5.990
   75    HZ3  LYS   8           HZ3      LYS   8  -6.812  -1.563   5.813
   76    H    LEU   9           H        LEU   9  -3.019  -2.979   1.037
   77    HA   LEU   9           HA       LEU   9  -1.722  -3.705   3.540
   78    HB2  LEU   9           HB3      LEU   9  -3.375  -5.059   1.517
   79    HB3  LEU   9           HB2      LEU   9  -2.151  -6.049   2.296
   80    HG   LEU   9           HG       LEU   9  -3.099  -5.528   4.499
   81   HD11  LEU   9          HD11      LEU   9  -5.235  -4.377   4.694
   82   HD12  LEU   9          HD12      LEU   9  -5.217  -4.036   2.966
   83   HD13  LEU   9          HD13      LEU   9  -3.998  -3.318   4.017
   84   HD21  LEU   9          HD21      LEU   9  -5.109  -6.565   2.509
   85   HD22  LEU   9          HD22      LEU   9  -5.190  -6.785   4.257
   86   HD23  LEU   9          HD23      LEU   9  -3.870  -7.508   3.337
   87    H    LYS  10           H        LYS  10  -1.329  -4.980   0.190
   88    HA   LYS  10           HA       LYS  10   1.327  -5.762   0.735
   89    HB2  LYS  10           HB3      LYS  10  -0.236  -6.658  -1.088
   90    HB3  LYS  10           HB2      LYS  10   0.317  -5.300  -2.048
   91    HG2  LYS  10           HG3      LYS  10   1.637  -7.163  -2.650
   92    HG3  LYS  10           HG2      LYS  10   2.654  -6.084  -1.695
   93    HD2  LYS  10           HD3      LYS  10   3.041  -8.354  -0.989
   94    HD3  LYS  10           HD2      LYS  10   2.192  -7.493   0.297
   95    HE2  LYS  10           HE3      LYS  10   1.172  -9.632   0.089
   96    HE3  LYS  10           HE2      LYS  10   0.057  -8.449  -0.596
   97    HZ1  LYS  10           HZ1      LYS  10   0.153 -10.320  -2.037
   98    HZ2  LYS  10           HZ2      LYS  10   1.843 -10.289  -2.087
   99    HZ3  LYS  10           HZ3      LYS  10   0.956  -9.051  -2.813
  100    H    GLU  11           H        GLU  11   0.623  -3.496  -1.956
  101    HA   GLU  11           HA       GLU  11   1.806  -1.218  -0.991
  102    HB2  GLU  11           HB3      GLU  11   4.098  -1.272  -1.822
  103    HB3  GLU  11           HB2      GLU  11   3.863  -2.641  -0.740
  104    HG2  GLU  11           HG3      GLU  11   3.449  -4.061  -2.751
  105    HG3  GLU  11           HG2      GLU  11   3.903  -2.685  -3.749
  106    H    LYS  12           H        LYS  12   2.737   0.192  -2.784
  107    HA   LYS  12           HA       LYS  12   2.989  -0.263  -5.393
  108    HB2  LYS  12           HB3      LYS  12   0.970   0.356  -6.579
  109    HB3  LYS  12           HB2      LYS  12   0.668  -1.045  -5.578
  110    HG2  LYS  12           HG3      LYS  12  -1.240   0.164  -5.255
  111    HG3  LYS  12           HG2      LYS  12  -0.267   0.699  -3.888
  112    HD2  LYS  12           HD3      LYS  12  -1.418   2.561  -5.022
  113    HD3  LYS  12           HD2      LYS  12   0.337   2.730  -5.061
  114    HE2  LYS  12           HE3      LYS  12  -0.751   3.306  -7.210
  115    HE3  LYS  12           HE2      LYS  12   0.399   1.983  -7.358
  116    HZ1  LYS  12           HZ1      LYS  12  -1.415   0.419  -7.383
  117    HZ2  LYS  12           HZ2      LYS  12  -1.670   1.584  -8.579
  118    HZ3  LYS  12           HZ3      LYS  12  -2.545   1.652  -7.137
  119    H    LEU  13           H        LEU  13   3.121   1.654  -6.714
  120    HA   LEU  13           HA       LEU  13   4.321   3.752  -5.286
  121    HB2  LEU  13           HB3      LEU  13   3.481   3.448  -8.157
  122    HB3  LEU  13           HB2      LEU  13   4.196   4.934  -7.574
  123    HG   LEU  13           HG       LEU  13   5.871   3.594  -8.676
  124   HD11  LEU  13          HD11      LEU  13   6.624   4.924  -6.812
  125   HD12  LEU  13          HD12      LEU  13   7.531   3.413  -6.879
  126   HD13  LEU  13          HD13      LEU  13   6.246   3.619  -5.692
  127   HD21  LEU  13          HD21      LEU  13   5.201   1.440  -6.677
  128   HD22  LEU  13          HD22      LEU  13   6.551   1.403  -7.812
  129   HD23  LEU  13          HD23      LEU  13   4.894   1.393  -8.414
  130    H    ARG  14           H        ARG  14   3.077   4.919  -3.898
  131    HA   ARG  14           HA       ARG  14   1.370   6.886  -5.069
  132    HB2  ARG  14           HB3      ARG  14  -0.182   4.948  -4.949
  133    HB3  ARG  14           HB2      ARG  14   0.050   4.906  -3.207
  134    HG2  ARG  14           HG3      ARG  14  -2.039   6.024  -3.882
  135    HG3  ARG  14           HG2      ARG  14  -0.959   7.074  -2.965
  136    HD2  ARG  14           HD3      ARG  14  -1.978   8.221  -4.889
  137    HD3  ARG  14           HD2      ARG  14  -0.222   8.157  -4.995
  138    HE   ARG  14           HE       ARG  14  -1.723   6.087  -6.396
  139   HH11  ARG  14          HH11      ARG  14   0.065   9.094  -6.555
  140   HH12  ARG  14          HH12      ARG  14   0.355   8.980  -8.262
  141   HH21  ARG  14          HH22      ARG  14  -1.362   5.935  -8.643
  142   HH22  ARG  14          HH21      ARG  14  -0.452   7.171  -9.452
  143    H    THR  15           H        THR  15   2.255   5.265  -2.034
  144    HA   THR  15           HA       THR  15   2.674   6.009   0.044
  145    HB   THR  15           HB       THR  15   3.682   8.415  -1.471
  146    HG1  THR  15           HG1      THR  15   5.706   7.318  -1.018
  147   HG21  THR  15          HG21      THR  15   4.463   7.613   1.316
  148   HG22  THR  15          HG22      THR  15   3.128   8.721   1.005
  149   HG23  THR  15          HG23      THR  15   4.757   9.139   0.482
  150    H    VAL  16           H        VAL  16   0.904   6.182   1.164
  151    HA   VAL  16           HA       VAL  16  -0.300   8.405   2.120
  152    HB   VAL  16           HB       VAL  16  -0.854   8.907  -0.286
  153   HG11  VAL  16          HG11      VAL  16  -2.783   6.615  -0.064
  154   HG12  VAL  16          HG12      VAL  16  -1.330   6.656  -1.059
  155   HG13  VAL  16          HG13      VAL  16  -2.665   7.757  -1.401
  156   HG21  VAL  16          HG21      VAL  16  -2.082  10.069   1.352
  157   HG22  VAL  16          HG22      VAL  16  -3.100   8.673   1.694
  158   HG23  VAL  16          HG23      VAL  16  -3.250   9.512   0.154
  159    H    ILE  17           H        ILE  17  -3.152   7.123   1.661
  160    HA   ILE  17           HA       ILE  17  -3.241   5.254   3.703
  161    HB   ILE  17           HB       ILE  17  -5.301   6.144   2.972
  162   HG12  ILE  17          HG13      ILE  17  -5.140   3.529   3.422
  163   HG13  ILE  17          HG12      ILE  17  -6.656   4.291   2.962
  164   HG21  ILE  17          HG21      ILE  17  -6.205   5.834   0.693
  165   HG22  ILE  17          HG22      ILE  17  -4.665   5.116   0.218
  166   HG23  ILE  17          HG23      ILE  17  -4.729   6.798   0.744
  167   HD11  ILE  17          HD11      ILE  17  -6.410   3.543   0.696
  168   HD12  ILE  17          HD12      ILE  17  -6.190   2.164   1.773
  169   HD13  ILE  17          HD13      ILE  17  -4.789   2.935   1.029
  170    H    THR  18           H        THR  18  -2.325   4.903   0.373
  171    HA   THR  18           HA       THR  18  -2.394   2.140   0.074
  172    HB   THR  18           HB       THR  18  -0.451   4.116  -1.125
  173    HG1  THR  18           HG1      THR  18  -3.082   3.306  -1.730
  174   HG21  THR  18          HG21      THR  18  -1.237   1.350  -2.040
  175   HG22  THR  18          HG22      THR  18   0.317   1.797  -1.339
  176   HG23  THR  18          HG23      THR  18  -0.170   2.461  -2.898
  177    H    SER  19           H        SER  19   0.443   4.136   0.838
  178    HA   SER  19           HA       SER  19   1.950   1.823   1.644
  179    HB2  SER  19           HB3      SER  19   3.745   3.519   2.029
  180    HB3  SER  19           HB2      SER  19   3.055   3.591   0.412
  181    HG   SER  19           HG       SER  19   3.011   5.452   2.422
  182    H    HIS  20           H        HIS  20  -0.344   2.206   3.182
  183    HA   HIS  20           HA       HIS  20   0.227   3.412   5.708
  184    HB2  HIS  20           HB3      HIS  20  -2.083   2.909   4.784
  185    HB3  HIS  20           HB2      HIS  20  -1.765   1.209   5.101
  186    HD1  HIS  20           HD1      HIS  20  -2.254   4.480   6.922
  187    HD2  HIS  20           HD2      HIS  20  -2.212   0.396   7.687
  188    HE1  HIS  20           HE1      HIS  20  -3.085   4.228   9.279
  189    HE2  HIS  20           HE2      HIS  20  -3.167   1.742   9.679
  190    H    ILE  21           H        ILE  21  -0.161   0.030   4.737
  191    HA   ILE  21           HA       ILE  21   2.281  -0.612   6.231
  192    HB   ILE  21           HB       ILE  21   1.388  -2.854   6.736
  193   HG12  ILE  21          HG13      ILE  21  -1.301  -1.791   5.854
  194   HG13  ILE  21          HG12      ILE  21  -0.295  -2.845   4.866
  195   HG21  ILE  21          HG21      ILE  21  -0.165  -2.206   8.532
  196   HG22  ILE  21          HG22      ILE  21  -0.295  -0.599   7.817
  197   HG23  ILE  21          HG23      ILE  21   1.251  -1.157   8.453
  198   HD11  ILE  21          HD11      ILE  21  -1.436  -3.526   7.565
  199   HD12  ILE  21          HD12      ILE  21  -0.440  -4.582   6.564
  200   HD13  ILE  21          HD13      ILE  21  -2.039  -4.089   6.006
  201    H    ASP  22           H        ASP  22   3.509  -2.311   5.206
  202    HA   ASP  22           HA       ASP  22   2.745  -2.675   2.388
  203    HB2  ASP  22           HB3      ASP  22   5.573  -2.388   3.427
  204    HB3  ASP  22           HB2      ASP  22   5.077  -2.533   1.747
  205    H    LYS  23           H        LYS  23   4.249  -4.467   1.410
  206    HA   LYS  23           HA       LYS  23   3.832  -6.950   2.463
  207    HB2  LYS  23           HB3      LYS  23   5.702  -7.770   1.121
  208    HB3  LYS  23           HB2      LYS  23   4.756  -6.602   0.220
  209    HG2  LYS  23           HG3      LYS  23   7.439  -6.128   1.513
  210    HG3  LYS  23           HG2      LYS  23   7.109  -6.285  -0.212
  211    HD2  LYS  23           HD3      LYS  23   5.572  -4.280   0.061
  212    HD3  LYS  23           HD2      LYS  23   6.302  -4.070   1.649
  213    HE2  LYS  23           HE3      LYS  23   7.619  -3.900  -1.038
  214    HE3  LYS  23           HE2      LYS  23   7.425  -2.631   0.167
  215    HZ1  LYS  23           HZ1      LYS  23   9.674  -3.487   0.145
  216    HZ2  LYS  23           HZ2      LYS  23   9.121  -5.052   0.448
  217    HZ3  LYS  23           HZ3      LYS  23   8.939  -3.845   1.619
  218    H    VAL  24           H        VAL  24   6.501  -4.775   3.200
  219    HA   VAL  24           HA       VAL  24   6.732  -6.147   5.775
  220    HB   VAL  24           HB       VAL  24   9.074  -5.008   4.236
  221   HG11  VAL  24          HG11      VAL  24   9.295  -4.612   6.622
  222   HG12  VAL  24          HG12      VAL  24  10.432  -5.855   6.100
  223   HG13  VAL  24          HG13      VAL  24   8.957  -6.311   6.952
  224   HG21  VAL  24          HG21      VAL  24   9.911  -7.315   4.214
  225   HG22  VAL  24          HG22      VAL  24   8.380  -7.164   3.352
  226   HG23  VAL  24          HG23      VAL  24   8.413  -7.856   4.973
  227    H    LEU  25           H        LEU  25   8.275  -3.242   4.384
  228    HA   LEU  25           HA       LEU  25   6.438  -1.372   5.380
  229    HB2  LEU  25           HB3      LEU  25   7.336  -2.190   7.568
  230    HB3  LEU  25           HB2      LEU  25   8.922  -1.625   7.081
  231    HG   LEU  25           HG       LEU  25   7.954   0.688   6.903
  232   HD11  LEU  25          HD11      LEU  25   5.614   0.074   6.663
  233   HD12  LEU  25          HD12      LEU  25   5.850   1.127   8.058
  234   HD13  LEU  25          HD13      LEU  25   5.614  -0.605   8.293
  235   HD21  LEU  25          HD21      LEU  25   7.953   1.072   9.320
  236   HD22  LEU  25          HD22      LEU  25   9.270   0.011   8.825
  237   HD23  LEU  25          HD23      LEU  25   7.833  -0.665   9.592
  238    H    ARG  26           H        ARG  26   6.899  -0.577   3.248
  239    HA   ARG  26           HA       ARG  26   9.072   1.280   3.197
  240    HB2  ARG  26           HB3      ARG  26  10.373  -0.547   2.468
  241    HB3  ARG  26           HB2      ARG  26   9.076  -1.196   1.482
  242    HG2  ARG  26           HG3      ARG  26  10.070   1.469   0.716
  243    HG3  ARG  26           HG2      ARG  26  11.184   0.116   0.491
  244    HD2  ARG  26           HD3      ARG  26   9.656  -1.030  -0.904
  245    HD3  ARG  26           HD2      ARG  26   8.329   0.054  -0.454
  246    HE   ARG  26           HE       ARG  26  10.051   1.751  -1.609
  247   HH11  ARG  26          HH11      ARG  26   8.918  -1.390  -2.648
  248   HH12  ARG  26          HH12      ARG  26   9.061  -1.024  -4.334
  249   HH21  ARG  26          HH22      ARG  26  10.245   2.234  -3.844
  250   HH22  ARG  26          HH21      ARG  26   9.806   1.030  -5.015
  251    HA   PRO  27           HA       PRO  27   5.477   3.037   0.949
  252    HB2  PRO  27           HB2      PRO  27   7.132   5.415   1.684
  253    HB3  PRO  27           HB3      PRO  27   5.372   5.188   1.782
  254    HG2  PRO  27           HG3      PRO  27   6.811   5.098   3.995
  255    HG3  PRO  27           HG2      PRO  27   5.517   3.904   3.730
  256    HD2  PRO  27           HD3      PRO  27   8.491   3.585   3.377
  257    HD3  PRO  27           HD2      PRO  27   7.327   2.482   4.144
  258    H    GLN  28           H        GLN  28   5.669   4.757  -0.897
  259    HA   GLN  28           HA       GLN  28   8.007   4.703  -2.454
  260    HB2  GLN  28           HB3      GLN  28   7.172   2.997  -4.137
  261    HB3  GLN  28           HB2      GLN  28   7.774   2.354  -2.619
  262    HG2  GLN  28           HG3      GLN  28   5.372   2.287  -1.838
  263    HG3  GLN  28           HG2      GLN  28   4.916   2.616  -3.509
  264   HE21  GLN  28          HE22      GLN  28   6.221   0.310  -1.285
  265   HE22  GLN  28          HE21      GLN  28   6.170  -1.063  -2.352
  266    H    GLY  29           H        GLY  29   7.372   6.788  -2.818
  267    HA2  GLY  29           HA3      GLY  29   6.453   7.683  -5.079
  268    HA3  GLY  29           HA2      GLY  29   4.915   7.220  -4.361
  Start of MODEL   13
    1    H1   ARG   1           H1       ARG   1  -9.164   4.116   1.317
    2    H2   ARG   1           H2       ARG   1 -10.632   3.330   1.620
    3    H3   ARG   1           H3       ARG   1 -10.582   4.654   0.572
    4    HA   ARG   1           HA       ARG   1 -10.764   2.534  -0.593
    5    HB2  ARG   1           HB3      ARG   1  -8.252   4.163  -0.986
    6    HB3  ARG   1           HB2      ARG   1  -8.762   2.906  -2.104
    7    HG2  ARG   1           HG3      ARG   1 -10.368   5.353  -1.394
    8    HG3  ARG   1           HG2      ARG   1  -9.404   5.148  -2.856
    9    HD2  ARG   1           HD3      ARG   1 -10.791   3.319  -3.576
   10    HD3  ARG   1           HD2      ARG   1 -11.681   3.341  -2.058
   11    HE   ARG   1           HE       ARG   1 -11.859   5.854  -3.361
   12   HH11  ARG   1          HH12      ARG   1 -13.055   2.569  -3.532
   13   HH12  ARG   1          HH11      ARG   1 -14.566   3.017  -4.252
   14   HH21  ARG   1          HH21      ARG   1 -13.865   6.453  -4.307
   15   HH22  ARG   1          HH22      ARG   1 -15.028   5.222  -4.686
   16    H    LYS   2           H        LYS   2 -10.624   0.590   0.360
   17    HA   LYS   2           HA       LYS   2  -7.927  -0.370   1.049
   18    HB2  LYS   2           HB3      LYS   2 -10.590  -1.218   2.205
   19    HB3  LYS   2           HB2      LYS   2  -9.029  -1.920   2.615
   20    HG2  LYS   2           HG3      LYS   2  -8.309   0.030   3.692
   21    HG3  LYS   2           HG2      LYS   2  -9.598   1.004   2.989
   22    HD2  LYS   2           HD3      LYS   2 -10.090   0.564   5.311
   23    HD3  LYS   2           HD2      LYS   2 -11.240  -0.307   4.299
   24    HE2  LYS   2           HE3      LYS   2  -9.996  -2.364   4.614
   25    HE3  LYS   2           HE2      LYS   2  -8.770  -1.507   5.547
   26    HZ1  LYS   2           HZ1      LYS   2 -11.624  -1.792   6.319
   27    HZ2  LYS   2           HZ2      LYS   2 -10.424  -1.012   7.219
   28    HZ3  LYS   2           HZ3      LYS   2 -10.342  -2.678   6.969
   29    H    CYS   3           H        CYS   3  -7.798  -0.851  -1.252
   30    HA   CYS   3           HA       CYS   3  -9.429  -2.996  -2.303
   31    HB2  CYS   3           HB3      CYS   3  -6.973  -2.343  -3.761
   32    HB3  CYS   3           HB2      CYS   3  -8.641  -2.340  -4.318
   33    H    ASN   4           H        ASN   4  -7.945  -3.597   0.071
   34    HA   ASN   4           HA       ASN   4  -6.628  -5.175   0.998
   35    HB2  ASN   4           HB3      ASN   4  -6.948  -6.482  -1.713
   36    HB3  ASN   4           HB2      ASN   4  -6.220  -7.268  -0.317
   37   HD21  ASN   4          HD22      ASN   4  -7.513  -7.929   1.374
   38   HD22  ASN   4          HD21      ASN   4  -9.235  -8.002   1.251
   39    H    PHE   5           H        PHE   5  -4.932  -6.561  -1.438
   40    HA   PHE   5           HA       PHE   5  -2.514  -5.244  -0.651
   41    HB2  PHE   5           HB3      PHE   5  -1.547  -6.852  -2.424
   42    HB3  PHE   5           HB2      PHE   5  -2.236  -7.533  -0.958
   43    HD1  PHE   5           HD2      PHE   5  -2.789  -6.989  -4.558
   44    HD2  PHE   5           HD1      PHE   5  -4.182  -8.902  -1.024
   45    HE1  PHE   5           HE2      PHE   5  -4.299  -8.377  -5.909
   46    HE2  PHE   5           HE1      PHE   5  -5.694 -10.294  -2.371
   47    HZ   PHE   5           HZ       PHE   5  -5.756 -10.033  -4.818
   48    H    LEU   6           H        LEU   6  -1.017  -4.199  -2.058
   49    HA   LEU   6           HA       LEU   6  -0.470  -2.545  -3.479
   50    HB2  LEU   6           HB3      LEU   6  -2.380  -4.032  -5.280
   51    HB3  LEU   6           HB2      LEU   6  -1.466  -2.636  -5.807
   52    HG   LEU   6           HG       LEU   6  -0.216  -4.410  -6.613
   53   HD11  LEU   6          HD11      LEU   6   1.023  -3.923  -3.913
   54   HD12  LEU   6          HD12      LEU   6   1.161  -2.849  -5.306
   55   HD13  LEU   6          HD13      LEU   6   1.839  -4.474  -5.377
   56   HD21  LEU   6          HD21      LEU   6  -1.367  -6.244  -5.616
   57   HD22  LEU   6          HD22      LEU   6  -0.738  -5.838  -4.019
   58   HD23  LEU   6          HD23      LEU   6   0.353  -6.419  -5.276
   59    H    CYS   7           H        CYS   7  -2.391  -2.019  -1.538
   60    HA   CYS   7           HA       CYS   7  -3.557   0.360  -2.568
   61    HB2  CYS   7           HB3      CYS   7  -5.201  -1.248  -3.463
   62    HB3  CYS   7           HB2      CYS   7  -5.523  -1.812  -1.826
   63    H    LYS   8           H        LYS   8  -3.494  -2.033   0.066
   64    HA   LYS   8           HA       LYS   8  -2.776   0.143   1.848
   65    HB2  LYS   8           HB3      LYS   8  -5.257   0.020   1.983
   66    HB3  LYS   8           HB2      LYS   8  -5.128  -1.668   2.446
   67    HG2  LYS   8           HG3      LYS   8  -4.021  -1.056   4.508
   68    HG3  LYS   8           HG2      LYS   8  -4.027   0.645   4.029
   69    HD2  LYS   8           HD3      LYS   8  -6.483   0.602   3.973
   70    HD3  LYS   8           HD2      LYS   8  -6.458  -1.078   4.501
   71    HE2  LYS   8           HE3      LYS   8  -5.307   1.231   6.056
   72    HE3  LYS   8           HE2      LYS   8  -6.905   0.541   6.325
   73    HZ1  LYS   8           HZ1      LYS   8  -4.307  -0.852   6.653
   74    HZ2  LYS   8           HZ2      LYS   8  -5.822  -1.590   6.813
   75    HZ3  LYS   8           HZ3      LYS   8  -5.357  -0.370   7.886
   76    H    LEU   9           H        LEU   9  -3.482  -3.255   1.399
   77    HA   LEU   9           HA       LEU   9  -1.874  -4.183   3.584
   78    HB2  LEU   9           HB3      LEU   9  -3.221  -5.504   1.251
   79    HB3  LEU   9           HB2      LEU   9  -2.325  -6.409   2.467
   80    HG   LEU   9           HG       LEU   9  -4.684  -4.641   3.110
   81   HD11  LEU   9          HD11      LEU   9  -4.607  -7.626   2.720
   82   HD12  LEU   9          HD12      LEU   9  -5.331  -6.453   1.616
   83   HD13  LEU   9          HD13      LEU   9  -6.000  -6.670   3.235
   84   HD21  LEU   9          HD21      LEU   9  -3.238  -6.767   4.689
   85   HD22  LEU   9          HD22      LEU   9  -4.695  -5.921   5.208
   86   HD23  LEU   9          HD23      LEU   9  -3.191  -5.029   4.985
   87    H    LYS  10           H        LYS  10  -1.490  -4.017   0.077
   88    HA   LYS  10           HA       LYS  10   1.393  -4.267   0.546
   89    HB2  LYS  10           HB3      LYS  10   0.111  -6.191  -0.768
   90    HB3  LYS  10           HB2      LYS  10   0.251  -5.058  -2.103
   91    HG2  LYS  10           HG3      LYS  10   2.663  -5.013  -1.840
   92    HG3  LYS  10           HG2      LYS  10   2.536  -6.129  -0.480
   93    HD2  LYS  10           HD3      LYS  10   1.793  -6.673  -3.352
   94    HD3  LYS  10           HD2      LYS  10   3.151  -7.361  -2.460
   95    HE2  LYS  10           HE3      LYS  10   1.523  -8.407  -0.904
   96    HE3  LYS  10           HE2      LYS  10   0.219  -7.805  -1.927
   97    HZ1  LYS  10           HZ1      LYS  10   2.325  -9.752  -2.689
   98    HZ2  LYS  10           HZ2      LYS  10   1.207  -9.092  -3.773
   99    HZ3  LYS  10           HZ3      LYS  10   0.677 -10.062  -2.497
  100    H    GLU  11           H        GLU  11   2.569  -3.204  -1.433
  101    HA   GLU  11           HA       GLU  11   1.120  -0.754  -2.147
  102    HB2  GLU  11           HB3      GLU  11   2.783  -0.854   0.005
  103    HB3  GLU  11           HB2      GLU  11   3.921  -0.464  -1.259
  104    HG2  GLU  11           HG3      GLU  11   1.473   1.129  -0.557
  105    HG3  GLU  11           HG2      GLU  11   3.115   1.505  -0.069
  106    H    LYS  12           H        LYS  12   2.416   0.517  -3.750
  107    HA   LYS  12           HA       LYS  12   4.229  -1.137  -5.340
  108    HB2  LYS  12           HB3      LYS  12   3.077  -0.418  -7.424
  109    HB3  LYS  12           HB2      LYS  12   2.096  -1.456  -6.414
  110    HG2  LYS  12           HG3      LYS  12   1.836   1.525  -6.434
  111    HG3  LYS  12           HG2      LYS  12   0.955   0.473  -7.537
  112    HD2  LYS  12           HD3      LYS  12   0.163  -0.739  -5.400
  113    HD3  LYS  12           HD2      LYS  12   0.701   0.724  -4.555
  114    HE2  LYS  12           HE3      LYS  12  -1.466   1.294  -5.013
  115    HE3  LYS  12           HE2      LYS  12  -0.634   1.904  -6.444
  116    HZ1  LYS  12           HZ1      LYS  12  -2.139  -0.639  -6.244
  117    HZ2  LYS  12           HZ2      LYS  12  -1.234  -0.160  -7.592
  118    HZ3  LYS  12           HZ3      LYS  12  -2.586   0.736  -7.117
  119    H    LEU  13           H        LEU  13   2.765   2.100  -5.045
  120    HA   LEU  13           HA       LEU  13   5.120   3.511  -4.673
  121    HB2  LEU  13           HB3      LEU  13   5.497   2.645  -7.063
  122    HB3  LEU  13           HB2      LEU  13   4.229   3.754  -7.544
  123    HG   LEU  13           HG       LEU  13   5.573   5.646  -6.705
  124   HD11  LEU  13          HD11      LEU  13   7.941   5.259  -6.145
  125   HD12  LEU  13          HD12      LEU  13   7.651   3.521  -6.185
  126   HD13  LEU  13          HD13      LEU  13   6.845   4.523  -4.978
  127   HD21  LEU  13          HD21      LEU  13   7.259   5.603  -8.466
  128   HD22  LEU  13          HD22      LEU  13   5.718   4.976  -9.052
  129   HD23  LEU  13          HD23      LEU  13   7.028   3.865  -8.657
  130    H    ARG  14           H        ARG  14   2.417   3.464  -3.807
  131    HA   ARG  14           HA       ARG  14   1.018   5.664  -5.057
  132    HB2  ARG  14           HB3      ARG  14   0.389   3.578  -3.101
  133    HB3  ARG  14           HB2      ARG  14  -0.393   5.119  -2.792
  134    HG2  ARG  14           HG3      ARG  14  -0.580   3.506  -5.321
  135    HG3  ARG  14           HG2      ARG  14  -1.821   3.671  -4.076
  136    HD2  ARG  14           HD3      ARG  14  -1.956   6.066  -4.527
  137    HD3  ARG  14           HD2      ARG  14  -0.722   5.907  -5.774
  138    HE   ARG  14           HE       ARG  14  -2.700   4.141  -6.487
  139   HH11  ARG  14          HH11      ARG  14  -2.485   7.576  -5.881
  140   HH12  ARG  14          HH12      ARG  14  -3.741   7.989  -7.002
  141   HH21  ARG  14          HH22      ARG  14  -4.348   4.672  -7.988
  142   HH22  ARG  14          HH21      ARG  14  -4.800   6.333  -8.207
  143    H    THR  15           H        THR  15   2.730   5.080  -2.028
  144    HA   THR  15           HA       THR  15   3.221   6.375  -0.257
  145    HB   THR  15           HB       THR  15   4.895   7.227  -1.745
  146    HG1  THR  15           HG1      THR  15   4.429   8.303   0.364
  147   HG21  THR  15          HG21      THR  15   3.339   8.032  -3.548
  148   HG22  THR  15          HG22      THR  15   4.678   9.109  -3.165
  149   HG23  THR  15          HG23      THR  15   3.062   9.470  -2.565
  150    H    VAL  16           H        VAL  16   1.113   6.176   0.468
  151    HA   VAL  16           HA       VAL  16  -0.315   8.484   1.139
  152    HB   VAL  16           HB       VAL  16  -0.702   8.336  -1.393
  153   HG11  VAL  16          HG11      VAL  16  -1.173   5.766  -1.099
  154   HG12  VAL  16          HG12      VAL  16  -1.951   6.715  -2.370
  155   HG13  VAL  16          HG13      VAL  16  -2.831   6.335  -0.891
  156   HG21  VAL  16          HG21      VAL  16  -2.050   9.765   0.002
  157   HG22  VAL  16          HG22      VAL  16  -3.100   8.418   0.431
  158   HG23  VAL  16          HG23      VAL  16  -3.058   9.006  -1.228
  159    H    ILE  17           H        ILE  17  -2.963   6.948   0.958
  160    HA   ILE  17           HA       ILE  17  -2.828   5.599   3.408
  161    HB   ILE  17           HB       ILE  17  -4.928   6.467   2.562
  162   HG12  ILE  17          HG13      ILE  17  -4.819   4.309   4.033
  163   HG13  ILE  17          HG12      ILE  17  -6.356   4.818   3.351
  164   HG21  ILE  17          HG21      ILE  17  -4.697   4.405   0.385
  165   HG22  ILE  17          HG22      ILE  17  -4.641   6.159   0.206
  166   HG23  ILE  17          HG23      ILE  17  -6.134   5.371   0.711
  167   HD11  ILE  17          HD11      ILE  17  -6.118   2.440   3.149
  168   HD12  ILE  17          HD12      ILE  17  -4.572   2.620   2.318
  169   HD13  ILE  17          HD13      ILE  17  -6.061   3.166   1.545
  170    H    THR  18           H        THR  18  -2.405   4.508   0.114
  171    HA   THR  18           HA       THR  18  -2.407   1.759   0.409
  172    HB   THR  18           HB       THR  18  -0.485   3.317  -1.335
  173    HG1  THR  18           HG1      THR  18  -2.715   2.668  -2.647
  174   HG21  THR  18          HG21      THR  18  -1.875   0.658  -1.716
  175   HG22  THR  18          HG22      THR  18  -0.182   0.884  -1.302
  176   HG23  THR  18          HG23      THR  18  -0.782   1.428  -2.866
  177    H    SER  19           H        SER  19   0.332   3.985   0.598
  178    HA   SER  19           HA       SER  19   2.183   2.016   1.473
  179    HB2  SER  19           HB3      SER  19   2.495   5.006   1.680
  180    HB3  SER  19           HB2      SER  19   3.751   3.798   1.446
  181    HG   SER  19           HG       SER  19   3.105   3.483  -0.621
  182    H    HIS  20           H        HIS  20   0.195   1.709   3.252
  183    HA   HIS  20           HA       HIS  20   1.194   3.026   5.693
  184    HB2  HIS  20           HB3      HIS  20  -1.486   1.924   4.964
  185    HB3  HIS  20           HB2      HIS  20  -1.001   1.936   6.656
  186    HD1  HIS  20           HD1      HIS  20  -2.728   3.727   7.320
  187    HD2  HIS  20           HD2      HIS  20  -0.087   4.953   4.353
  188    HE1  HIS  20           HE1      HIS  20  -3.055   6.210   7.106
  189    HE2  HIS  20           HE2      HIS  20  -1.310   6.949   5.443
  190    H    ILE  21           H        ILE  21  -0.220  -0.158   4.844
  191    HA   ILE  21           HA       ILE  21   1.914  -1.348   6.486
  192    HB   ILE  21           HB       ILE  21   0.263  -3.237   6.933
  193   HG12  ILE  21          HG13      ILE  21  -1.742  -1.084   6.216
  194   HG13  ILE  21          HG12      ILE  21  -1.415  -2.512   5.241
  195   HG21  ILE  21          HG21      ILE  21   0.994  -1.724   8.664
  196   HG22  ILE  21          HG22      ILE  21  -0.730  -2.046   8.851
  197   HG23  ILE  21          HG23      ILE  21  -0.189  -0.519   8.155
  198   HD11  ILE  21          HD11      ILE  21  -2.548  -2.470   8.027
  199   HD12  ILE  21          HD12      ILE  21  -2.167  -3.923   7.104
  200   HD13  ILE  21          HD13      ILE  21  -3.422  -2.822   6.537
  201    H    ASP  22           H        ASP  22   3.011  -1.369   4.416
  202    HA   ASP  22           HA       ASP  22   1.951  -2.808   2.189
  203    HB2  ASP  22           HB3      ASP  22   3.985  -2.265   1.078
  204    HB3  ASP  22           HB2      ASP  22   3.602  -0.891   2.096
  205    H    LYS  23           H        LYS  23   4.148  -4.213   1.250
  206    HA   LYS  23           HA       LYS  23   3.983  -6.651   2.734
  207    HB2  LYS  23           HB3      LYS  23   5.903  -7.229   0.972
  208    HB3  LYS  23           HB2      LYS  23   4.200  -7.224   0.548
  209    HG2  LYS  23           HG3      LYS  23   5.532  -6.111  -1.146
  210    HG3  LYS  23           HG2      LYS  23   4.427  -4.976  -0.374
  211    HD2  LYS  23           HD3      LYS  23   6.338  -4.276   1.097
  212    HD3  LYS  23           HD2      LYS  23   7.389  -5.262   0.076
  213    HE2  LYS  23           HE3      LYS  23   5.617  -3.083  -0.996
  214    HE3  LYS  23           HE2      LYS  23   7.276  -2.796  -0.482
  215    HZ1  LYS  23           HZ1      LYS  23   7.979  -4.481  -2.126
  216    HZ2  LYS  23           HZ2      LYS  23   7.204  -3.160  -2.843
  217    HZ3  LYS  23           HZ3      LYS  23   6.380  -4.621  -2.648
  218    H    VAL  24           H        VAL  24   5.363  -4.112   3.777
  219    HA   VAL  24           HA       VAL  24   6.873  -3.752   5.424
  220    HB   VAL  24           HB       VAL  24   7.644  -6.672   5.255
  221   HG11  VAL  24          HG11      VAL  24   9.241  -5.308   6.484
  222   HG12  VAL  24          HG12      VAL  24   8.350  -6.360   7.585
  223   HG13  VAL  24          HG13      VAL  24   7.939  -4.650   7.475
  224   HG21  VAL  24          HG21      VAL  24   5.528  -5.358   6.958
  225   HG22  VAL  24          HG22      VAL  24   6.062  -7.033   7.097
  226   HG23  VAL  24          HG23      VAL  24   5.248  -6.485   5.631
  227    H    LEU  25           H        LEU  25   7.573  -2.845   3.114
  228    HA   LEU  25           HA       LEU  25  10.466  -3.342   3.079
  229    HB2  LEU  25           HB3      LEU  25   8.852  -4.149   1.074
  230    HB3  LEU  25           HB2      LEU  25   9.197  -2.515   0.548
  231    HG   LEU  25           HG       LEU  25  11.276  -4.619   1.145
  232   HD11  LEU  25          HD11      LEU  25   9.786  -5.003  -0.826
  233   HD12  LEU  25          HD12      LEU  25  11.508  -4.877  -1.192
  234   HD13  LEU  25          HD13      LEU  25  10.433  -3.515  -1.519
  235   HD21  LEU  25          HD21      LEU  25  11.550  -1.881  -0.098
  236   HD22  LEU  25          HD22      LEU  25  12.840  -3.065   0.108
  237   HD23  LEU  25          HD23      LEU  25  12.083  -2.331   1.523
  238    H    ARG  26           H        ARG  26   8.001  -1.107   1.734
  239    HA   ARG  26           HA       ARG  26   9.360   1.126   2.947
  240    HB2  ARG  26           HB3      ARG  26   9.439   2.230   0.532
  241    HB3  ARG  26           HB2      ARG  26  10.785   1.319   1.192
  242    HG2  ARG  26           HG3      ARG  26  10.598   0.534  -0.983
  243    HG3  ARG  26           HG2      ARG  26   9.778  -0.697  -0.031
  244    HD2  ARG  26           HD3      ARG  26   8.520  -0.197  -2.043
  245    HD3  ARG  26           HD2      ARG  26   7.611   0.308  -0.619
  246    HE   ARG  26           HE       ARG  26   9.206   2.399  -1.792
  247   HH11  ARG  26          HH11      ARG  26   6.146   0.731  -1.916
  248   HH12  ARG  26          HH12      ARG  26   5.266   2.100  -2.529
  249   HH21  ARG  26          HH22      ARG  26   8.093   4.195  -2.639
  250   HH22  ARG  26          HH21      ARG  26   6.398   4.061  -2.988
  251    HA   PRO  27           HA       PRO  27   4.927   2.086   2.257
  252    HB2  PRO  27           HB2      PRO  27   4.127   2.197   4.824
  253    HB3  PRO  27           HB3      PRO  27   4.173   0.670   3.920
  254    HG2  PRO  27           HG3      PRO  27   6.061   1.720   5.970
  255    HG3  PRO  27           HG2      PRO  27   5.532   0.058   5.664
  256    HD2  PRO  27           HD3      PRO  27   7.943   1.178   4.816
  257    HD3  PRO  27           HD2      PRO  27   7.211  -0.300   4.166
  258    H    GLN  28           H        GLN  28   6.027   4.036   1.553
  259    HA   GLN  28           HA       GLN  28   6.860   5.976   3.527
  260    HB2  GLN  28           HB3      GLN  28   7.445   7.363   1.549
  261    HB3  GLN  28           HB2      GLN  28   8.202   5.776   1.530
  262    HG2  GLN  28           HG3      GLN  28   6.641   4.983  -0.102
  263    HG3  GLN  28           HG2      GLN  28   5.699   6.468   0.016
  264   HE21  GLN  28          HE22      GLN  28   6.517   8.363  -0.880
  265   HE22  GLN  28          HE21      GLN  28   7.772   8.341  -2.070
  266    H    GLY  29           H        GLY  29   4.230   5.407   3.879
  267    HA2  GLY  29           HA3      GLY  29   3.024   8.012   3.203
  268    HA3  GLY  29           HA2      GLY  29   2.091   6.534   3.009
  Start of MODEL   14
    1    H1   ARG   1           H1       ARG   1  -9.797   3.906   3.087
    2    H2   ARG   1           H2       ARG   1  -9.780   3.416   4.704
    3    H3   ARG   1           H3       ARG   1 -11.172   4.111   4.047
    4    HA   ARG   1           HA       ARG   1 -11.387   1.710   4.268
    5    HB2  ARG   1           HB3      ARG   1 -12.518   3.004   2.426
    6    HB3  ARG   1           HB2      ARG   1 -11.176   2.581   1.374
    7    HG2  ARG   1           HG3      ARG   1 -12.920   1.073   0.884
    8    HG3  ARG   1           HG2      ARG   1 -11.727   0.168   1.819
    9    HD2  ARG   1           HD3      ARG   1 -13.109   0.648   3.861
   10    HD3  ARG   1           HD2      ARG   1 -14.344   1.304   2.790
   11    HE   ARG   1           HE       ARG   1 -13.641  -1.290   1.945
   12   HH11  ARG   1          HH12      ARG   1 -15.371   0.362   4.496
   13   HH12  ARG   1          HH11      ARG   1 -16.397  -0.992   4.851
   14   HH21  ARG   1          HH21      ARG   1 -14.977  -3.087   2.424
   15   HH22  ARG   1          HH22      ARG   1 -16.171  -2.953   3.677
   16    H    LYS   2           H        LYS   2 -10.511  -0.344   3.949
   17    HA   LYS   2           HA       LYS   2  -7.821  -0.407   2.786
   18    HB2  LYS   2           HB3      LYS   2  -9.269  -2.594   4.292
   19    HB3  LYS   2           HB2      LYS   2  -7.595  -2.633   3.758
   20    HG2  LYS   2           HG3      LYS   2  -7.238  -2.046   5.907
   21    HG3  LYS   2           HG2      LYS   2  -7.488  -0.429   5.247
   22    HD2  LYS   2           HD3      LYS   2  -8.826  -0.474   7.160
   23    HD3  LYS   2           HD2      LYS   2  -9.956  -0.771   5.843
   24    HE2  LYS   2           HE3      LYS   2  -8.712  -2.912   7.567
   25    HE3  LYS   2           HE2      LYS   2 -10.316  -2.234   7.816
   26    HZ1  LYS   2           HZ1      LYS   2  -9.387  -3.827   5.493
   27    HZ2  LYS   2           HZ2      LYS   2 -10.884  -3.043   5.556
   28    HZ3  LYS   2           HZ3      LYS   2 -10.530  -4.275   6.651
   29    H    CYS   3           H        CYS   3  -7.296  -2.138   1.278
   30    HA   CYS   3           HA       CYS   3  -9.598  -3.110  -0.247
   31    HB2  CYS   3           HB3      CYS   3  -7.495  -2.353  -2.049
   32    HB3  CYS   3           HB2      CYS   3  -9.166  -1.801  -2.010
   33    H    ASN   4           H        ASN   4  -8.325  -4.354  -2.291
   34    HA   ASN   4           HA       ASN   4  -7.345  -6.650  -0.795
   35    HB2  ASN   4           HB3      ASN   4  -8.177  -6.368  -3.689
   36    HB3  ASN   4           HB2      ASN   4  -7.677  -7.877  -2.934
   37   HD21  ASN   4          HD22      ASN   4 -10.170  -5.495  -3.206
   38   HD22  ASN   4          HD21      ASN   4 -11.395  -6.392  -2.381
   39    H    PHE   5           H        PHE   5  -5.341  -5.365  -0.424
   40    HA   PHE   5           HA       PHE   5  -3.175  -4.922  -0.709
   41    HB2  PHE   5           HB3      PHE   5  -3.218  -7.074  -2.802
   42    HB3  PHE   5           HB2      PHE   5  -1.862  -6.530  -1.852
   43    HD1  PHE   5           HD1      PHE   5  -1.668  -7.108   0.516
   44    HD2  PHE   5           HD2      PHE   5  -4.799  -8.636  -1.921
   45    HE1  PHE   5           HE1      PHE   5  -2.127  -8.836   2.199
   46    HE2  PHE   5           HE2      PHE   5  -5.266 -10.370  -0.241
   47    HZ   PHE   5           HZ       PHE   5  -3.949 -10.462   1.827
   48    H    LEU   6           H        LEU   6  -1.443  -4.357  -2.363
   49    HA   LEU   6           HA       LEU   6  -0.750  -2.744  -3.798
   50    HB2  LEU   6           HB3      LEU   6  -2.834  -4.016  -5.577
   51    HB3  LEU   6           HB2      LEU   6  -1.550  -2.956  -6.118
   52    HG   LEU   6           HG       LEU   6  -0.782  -5.074  -6.667
   53   HD11  LEU   6          HD11      LEU   6   0.419  -4.470  -3.960
   54   HD12  LEU   6          HD12      LEU   6   0.952  -3.857  -5.531
   55   HD13  LEU   6          HD13      LEU   6   1.087  -5.576  -5.168
   56   HD21  LEU   6          HD21      LEU   6  -2.443  -6.405  -5.550
   57   HD22  LEU   6          HD22      LEU   6  -1.726  -6.042  -3.981
   58   HD23  LEU   6          HD23      LEU   6  -0.836  -7.011  -5.152
   59    H    CYS   7           H        CYS   7  -2.563  -1.827  -1.954
   60    HA   CYS   7           HA       CYS   7  -3.740   0.430  -3.253
   61    HB2  CYS   7           HB3      CYS   7  -5.463  -1.197  -3.809
   62    HB3  CYS   7           HB2      CYS   7  -5.602  -1.682  -2.121
   63    H    LYS   8           H        LYS   8  -3.316  -1.538  -0.396
   64    HA   LYS   8           HA       LYS   8  -2.616   0.744   1.155
   65    HB2  LYS   8           HB3      LYS   8  -5.097   0.845   1.321
   66    HB3  LYS   8           HB2      LYS   8  -5.097  -0.783   1.988
   67    HG2  LYS   8           HG3      LYS   8  -3.965  -0.069   3.948
   68    HG3  LYS   8           HG2      LYS   8  -3.640   1.518   3.255
   69    HD2  LYS   8           HD3      LYS   8  -6.110   1.894   3.164
   70    HD3  LYS   8           HD2      LYS   8  -6.306   0.389   4.063
   71    HE2  LYS   8           HE3      LYS   8  -5.034   1.277   5.910
   72    HE3  LYS   8           HE2      LYS   8  -4.682   2.745   5.003
   73    HZ1  LYS   8           HZ1      LYS   8  -7.079   3.211   4.980
   74    HZ2  LYS   8           HZ2      LYS   8  -6.443   3.157   6.546
   75    HZ3  LYS   8           HZ3      LYS   8  -7.345   1.856   5.957
   76    H    LEU   9           H        LEU   9  -3.551  -2.615   1.059
   77    HA   LEU   9           HA       LEU   9  -1.931  -3.433   3.260
   78    HB2  LEU   9           HB3      LEU   9  -3.454  -4.873   1.120
   79    HB3  LEU   9           HB2      LEU   9  -2.372  -5.752   2.183
   80    HG   LEU   9           HG       LEU   9  -3.695  -4.950   4.131
   81   HD11  LEU   9          HD11      LEU   9  -5.585  -3.897   2.036
   82   HD12  LEU   9          HD12      LEU   9  -4.620  -2.921   3.143
   83   HD13  LEU   9          HD13      LEU   9  -5.891  -3.970   3.772
   84   HD21  LEU   9          HD21      LEU   9  -5.256  -6.424   2.019
   85   HD22  LEU   9          HD22      LEU   9  -5.615  -6.410   3.745
   86   HD23  LEU   9          HD23      LEU   9  -4.119  -7.139   3.162
   87    H    LYS  10           H        LYS  10  -1.621  -4.926   0.038
   88    HA   LYS  10           HA       LYS  10   1.263  -4.683   0.203
   89    HB2  LYS  10           HB3      LYS  10  -0.141  -6.611  -0.843
   90    HB3  LYS  10           HB2      LYS  10  -0.262  -5.554  -2.239
   91    HG2  LYS  10           HG3      LYS  10   1.829  -5.981  -2.894
   92    HG3  LYS  10           HG2      LYS  10   2.464  -5.911  -1.247
   93    HD2  LYS  10           HD3      LYS  10   2.716  -8.153  -2.163
   94    HD3  LYS  10           HD2      LYS  10   1.581  -8.157  -0.815
   95    HE2  LYS  10           HE3      LYS  10   0.579  -9.512  -2.444
   96    HE3  LYS  10           HE2      LYS  10  -0.259  -7.964  -2.574
   97    HZ1  LYS  10           HZ1      LYS  10   0.330  -8.893  -4.743
   98    HZ2  LYS  10           HZ2      LYS  10   1.969  -8.867  -4.327
   99    HZ3  LYS  10           HZ3      LYS  10   1.113  -7.419  -4.482
  100    H    GLU  11           H        GLU  11   2.403  -3.715  -1.891
  101    HA   GLU  11           HA       GLU  11   1.034  -1.156  -2.357
  102    HB2  GLU  11           HB3      GLU  11   3.118   0.020  -2.083
  103    HB3  GLU  11           HB2      GLU  11   2.772  -0.937  -0.651
  104    HG2  GLU  11           HG3      GLU  11   5.005  -1.310  -0.969
  105    HG3  GLU  11           HG2      GLU  11   4.285  -2.706  -1.754
  106    H    LYS  12           H        LYS  12   1.935   0.140  -4.087
  107    HA   LYS  12           HA       LYS  12   3.437  -1.152  -6.167
  108    HB2  LYS  12           HB3      LYS  12   1.569  -0.431  -7.854
  109    HB3  LYS  12           HB2      LYS  12   1.446  -1.972  -7.026
  110    HG2  LYS  12           HG3      LYS  12  -0.706  -0.951  -7.018
  111    HG3  LYS  12           HG2      LYS  12  -0.075  -0.903  -5.373
  112    HD2  LYS  12           HD3      LYS  12  -1.136   1.194  -5.874
  113    HD3  LYS  12           HD2      LYS  12   0.604   1.458  -5.750
  114    HE2  LYS  12           HE3      LYS  12   0.733   1.334  -8.234
  115    HE3  LYS  12           HE2      LYS  12  -1.023   1.212  -8.283
  116    HZ1  LYS  12           HZ1      LYS  12  -1.163   3.375  -7.213
  117    HZ2  LYS  12           HZ2      LYS  12  -0.287   3.472  -8.659
  118    HZ3  LYS  12           HZ3      LYS  12   0.526   3.487  -7.176
  119    H    LEU  13           H        LEU  13   3.929   0.954  -4.443
  120    HA   LEU  13           HA       LEU  13   4.423   3.117  -4.153
  121    HB2  LEU  13           HB3      LEU  13   5.575   4.238  -5.819
  122    HB3  LEU  13           HB2      LEU  13   5.803   2.552  -6.219
  123    HG   LEU  13           HG       LEU  13   3.777   2.991  -7.855
  124   HD11  LEU  13          HD11      LEU  13   3.824   5.243  -8.795
  125   HD12  LEU  13          HD12      LEU  13   4.966   5.746  -7.550
  126   HD13  LEU  13          HD13      LEU  13   3.328   5.270  -7.103
  127   HD21  LEU  13          HD21      LEU  13   6.007   2.291  -8.523
  128   HD22  LEU  13          HD22      LEU  13   6.587   3.949  -8.377
  129   HD23  LEU  13          HD23      LEU  13   5.394   3.537  -9.609
  130    H    ARG  14           H        ARG  14   3.468   5.041  -3.789
  131    HA   ARG  14           HA       ARG  14   1.403   6.095  -5.418
  132    HB2  ARG  14           HB3      ARG  14   0.181   4.206  -4.325
  133    HB3  ARG  14           HB2      ARG  14   0.480   4.975  -2.773
  134    HG2  ARG  14           HG3      ARG  14  -1.776   5.418  -3.628
  135    HG3  ARG  14           HG2      ARG  14  -0.832   6.893  -3.422
  136    HD2  ARG  14           HD3      ARG  14  -0.420   7.038  -5.772
  137    HD3  ARG  14           HD2      ARG  14  -1.129   5.448  -6.048
  138    HE   ARG  14           HE       ARG  14  -3.246   6.583  -5.141
  139   HH11  ARG  14          HH11      ARG  14  -0.794   8.192  -7.062
  140   HH12  ARG  14          HH12      ARG  14  -1.909   9.322  -7.758
  141   HH21  ARG  14          HH22      ARG  14  -4.714   8.056  -6.077
  142   HH22  ARG  14          HH21      ARG  14  -4.137   9.242  -7.204
  143    H    THR  15           H        THR  15   1.627   6.152  -1.839
  144    HA   THR  15           HA       THR  15   3.062   8.535  -1.659
  145    HB   THR  15           HB       THR  15   1.139   9.447  -2.915
  146    HG1  THR  15           HG1      THR  15   2.408  10.637  -1.198
  147   HG21  THR  15          HG21      THR  15  -1.015   9.787  -1.853
  148   HG22  THR  15          HG22      THR  15  -0.467   8.913  -0.423
  149   HG23  THR  15          HG23      THR  15  -0.649   8.067  -1.956
  150    H    VAL  16           H        VAL  16   0.318   6.792  -0.220
  151    HA   VAL  16           HA       VAL  16   1.415   6.747   2.403
  152    HB   VAL  16           HB       VAL  16  -0.853   8.706   1.926
  153   HG11  VAL  16          HG11      VAL  16  -1.348   7.237   3.833
  154   HG12  VAL  16          HG12      VAL  16  -1.052   8.900   4.339
  155   HG13  VAL  16          HG13      VAL  16   0.198   7.676   4.559
  156   HG21  VAL  16          HG21      VAL  16   0.553  10.312   3.096
  157   HG22  VAL  16          HG22      VAL  16   1.396   9.664   1.688
  158   HG23  VAL  16          HG23      VAL  16   1.804   9.085   3.303
  159    H    ILE  17           H        ILE  17  -1.772   6.949   0.792
  160    HA   ILE  17           HA       ILE  17  -3.092   5.089   2.366
  161    HB   ILE  17           HB       ILE  17  -4.437   6.424   0.975
  162   HG12  ILE  17          HG13      ILE  17  -5.813   4.842  -0.287
  163   HG13  ILE  17          HG12      ILE  17  -4.508   3.663  -0.260
  164   HG21  ILE  17          HG21      ILE  17  -2.736   6.876  -0.753
  165   HG22  ILE  17          HG22      ILE  17  -4.331   6.539  -1.422
  166   HG23  ILE  17          HG23      ILE  17  -3.079   5.300  -1.464
  167   HD11  ILE  17          HD11      ILE  17  -5.757   4.718   2.251
  168   HD12  ILE  17          HD12      ILE  17  -4.769   3.272   2.035
  169   HD13  ILE  17          HD13      ILE  17  -6.405   3.330   1.377
  170    H    THR  18           H        THR  18  -1.755   4.417  -0.891
  171    HA   THR  18           HA       THR  18  -2.000   1.618  -0.585
  172    HB   THR  18           HB       THR  18  -0.178   3.128  -2.460
  173    HG1  THR  18           HG1      THR  18  -2.932   2.756  -2.387
  174   HG21  THR  18          HG21      THR  18  -1.358   0.354  -2.621
  175   HG22  THR  18          HG22      THR  18   0.334   0.746  -2.307
  176   HG23  THR  18          HG23      THR  18  -0.386   1.133  -3.869
  177    H    SER  19           H        SER  19   0.641   3.908  -0.145
  178    HA   SER  19           HA       SER  19   2.492   1.859   0.698
  179    HB2  SER  19           HB3      SER  19   4.075   3.637   0.833
  180    HB3  SER  19           HB2      SER  19   3.033   4.035  -0.537
  181    HG   SER  19           HG       SER  19   2.597   5.032   2.068
  182    H    HIS  20           H        HIS  20   0.271   1.637   2.325
  183    HA   HIS  20           HA       HIS  20   0.726   3.272   4.696
  184    HB2  HIS  20           HB3      HIS  20  -1.597   2.845   3.761
  185    HB3  HIS  20           HB2      HIS  20  -1.440   1.199   4.369
  186    HD1  HIS  20           HD1      HIS  20  -2.389   0.889   6.641
  187    HD2  HIS  20           HD2      HIS  20  -1.124   4.794   6.005
  188    HE1  HIS  20           HE1      HIS  20  -2.975   2.137   8.740
  189    HE2  HIS  20           HE2      HIS  20  -2.019   4.444   8.405
  190    H    ILE  21           H        ILE  21  -0.261  -0.153   4.615
  191    HA   ILE  21           HA       ILE  21   1.697  -0.662   6.706
  192    HB   ILE  21           HB       ILE  21  -0.508  -1.653   7.025
  193   HG12  ILE  21          HG13      ILE  21   1.593  -3.755   6.457
  194   HG13  ILE  21          HG12      ILE  21   1.467  -2.809   7.937
  195   HG21  ILE  21          HG21      ILE  21  -1.180  -1.939   4.717
  196   HG22  ILE  21          HG22      ILE  21  -1.319  -3.465   5.592
  197   HG23  ILE  21          HG23      ILE  21   0.038  -3.197   4.498
  198   HD11  ILE  21          HD11      ILE  21  -0.569  -4.777   6.918
  199   HD12  ILE  21          HD12      ILE  21  -0.703  -3.828   8.398
  200   HD13  ILE  21          HD13      ILE  21   0.569  -5.039   8.240
  201    H    ASP  22           H        ASP  22   1.017  -1.479   3.378
  202    HA   ASP  22           HA       ASP  22   2.435  -1.831   1.640
  203    HB2  ASP  22           HB3      ASP  22   3.846  -0.197   3.127
  204    HB3  ASP  22           HB2      ASP  22   4.798  -1.629   3.476
  205    H    LYS  23           H        LYS  23   4.178  -3.416   0.861
  206    HA   LYS  23           HA       LYS  23   3.988  -5.908   2.307
  207    HB2  LYS  23           HB3      LYS  23   5.658  -6.662   0.483
  208    HB3  LYS  23           HB2      LYS  23   4.006  -6.296   0.022
  209    HG2  LYS  23           HG3      LYS  23   5.200  -5.264  -1.638
  210    HG3  LYS  23           HG2      LYS  23   4.956  -3.940  -0.506
  211    HD2  LYS  23           HD3      LYS  23   7.182  -4.235   0.379
  212    HD3  LYS  23           HD2      LYS  23   7.435  -5.645  -0.652
  213    HE2  LYS  23           HE3      LYS  23   6.894  -4.010  -2.583
  214    HE3  LYS  23           HE2      LYS  23   7.252  -2.746  -1.403
  215    HZ1  LYS  23           HZ1      LYS  23   9.451  -3.653  -1.120
  216    HZ2  LYS  23           HZ2      LYS  23   9.181  -3.400  -2.772
  217    HZ3  LYS  23           HZ3      LYS  23   9.102  -4.961  -2.131
  218    H    VAL  24           H        VAL  24   6.157  -3.230   2.093
  219    HA   VAL  24           HA       VAL  24   7.354  -3.719   4.521
  220    HB   VAL  24           HB       VAL  24   8.447  -5.678   3.533
  221   HG11  VAL  24          HG11      VAL  24   9.666  -3.730   1.594
  222   HG12  VAL  24          HG12      VAL  24   8.654  -5.131   1.237
  223   HG13  VAL  24          HG13      VAL  24  10.281  -5.358   1.871
  224   HG21  VAL  24          HG21      VAL  24  10.768  -5.149   4.177
  225   HG22  VAL  24          HG22      VAL  24   9.579  -4.552   5.336
  226   HG23  VAL  24          HG23      VAL  24  10.345  -3.437   4.205
  227    H    LEU  25           H        LEU  25   6.428  -1.582   3.911
  228    HA   LEU  25           HA       LEU  25   6.573   0.583   3.131
  229    HB2  LEU  25           HB3      LEU  25   8.282   1.792   4.642
  230    HB3  LEU  25           HB2      LEU  25   6.887   1.012   5.335
  231    HG   LEU  25           HG       LEU  25   8.928   0.753   6.685
  232   HD11  LEU  25          HD11      LEU  25   7.196  -0.888   6.935
  233   HD12  LEU  25          HD12      LEU  25   8.774  -1.665   7.065
  234   HD13  LEU  25          HD13      LEU  25   7.833  -1.819   5.581
  235   HD21  LEU  25          HD21      LEU  25   9.974  -0.860   4.371
  236   HD22  LEU  25          HD22      LEU  25  10.712  -0.755   5.970
  237   HD23  LEU  25          HD23      LEU  25  10.606   0.680   4.952
  238    H    ARG  26           H        ARG  26   7.473  -0.337   0.985
  239    HA   ARG  26           HA       ARG  26  10.247   0.358   0.531
  240    HB2  ARG  26           HB3      ARG  26   9.771  -1.644  -0.497
  241    HB3  ARG  26           HB2      ARG  26   8.156  -1.146  -0.962
  242    HG2  ARG  26           HG3      ARG  26  10.281   0.382  -2.262
  243    HG3  ARG  26           HG2      ARG  26  10.289  -1.343  -2.642
  244    HD2  ARG  26           HD3      ARG  26   8.005  -1.255  -3.371
  245    HD3  ARG  26           HD2      ARG  26   7.842   0.408  -2.811
  246    HE   ARG  26           HE       ARG  26   9.883   0.475  -4.635
  247   HH11  ARG  26          HH11      ARG  26   6.513  -0.519  -4.701
  248   HH12  ARG  26          HH12      ARG  26   6.338  -0.185  -6.398
  249   HH21  ARG  26          HH22      ARG  26   9.614   0.944  -6.846
  250   HH22  ARG  26          HH21      ARG  26   8.086   0.640  -7.614
  251    HA   PRO  27           HA       PRO  27   8.251   3.232  -2.720
  252    HB2  PRO  27           HB2      PRO  27   5.659   3.980  -2.467
  253    HB3  PRO  27           HB3      PRO  27   6.159   2.528  -3.359
  254    HG2  PRO  27           HG3      PRO  27   5.125   2.772  -0.559
  255    HG3  PRO  27           HG2      PRO  27   4.681   1.598  -1.810
  256    HD2  PRO  27           HD3      PRO  27   6.419   1.014   0.173
  257    HD3  PRO  27           HD2      PRO  27   6.565   0.317  -1.450
  258    H    GLN  28           H        GLN  28   6.643   3.630   0.420
  259    HA   GLN  28           HA       GLN  28   8.016   6.174   0.819
  260    HB2  GLN  28           HB3      GLN  28   5.021   5.805   0.954
  261    HB3  GLN  28           HB2      GLN  28   5.849   7.141   1.735
  262    HG2  GLN  28           HG3      GLN  28   6.020   6.577  -1.211
  263    HG3  GLN  28           HG2      GLN  28   4.826   7.653  -0.488
  264   HE21  GLN  28          HE22      GLN  28   8.167   7.187  -1.268
  265   HE22  GLN  28          HE21      GLN  28   8.672   8.819  -0.990
  266    H    GLY  29           H        GLY  29   5.304   4.687   2.538
  267    HA2  GLY  29           HA3      GLY  29   5.244   3.566   4.564
  268    HA3  GLY  29           HA2      GLY  29   7.001   3.608   4.606
  Start of MODEL   15
    1    H1   ARG   1           H1       ARG   1 -10.819   3.725   2.576
    2    H2   ARG   1           H2       ARG   1 -12.365   3.868   3.250
    3    H3   ARG   1           H3       ARG   1 -12.064   4.457   1.694
    4    HA   ARG   1           HA       ARG   1 -11.955   1.620   2.517
    5    HB2  ARG   1           HB3      ARG   1 -14.251   2.463   2.436
    6    HB3  ARG   1           HB2      ARG   1 -13.970   3.131   0.837
    7    HG2  ARG   1           HG3      ARG   1 -15.230   1.094   0.651
    8    HG3  ARG   1           HG2      ARG   1 -13.622   0.852  -0.030
    9    HD2  ARG   1           HD3      ARG   1 -14.272  -1.068   1.300
   10    HD3  ARG   1           HD2      ARG   1 -12.916  -0.234   2.054
   11    HE   ARG   1           HE       ARG   1 -15.429   0.655   3.082
   12   HH11  ARG   1          HH12      ARG   1 -13.061  -1.911   3.296
   13   HH12  ARG   1          HH11      ARG   1 -13.477  -2.332   4.925
   14   HH21  ARG   1          HH21      ARG   1 -15.990   0.090   5.220
   15   HH22  ARG   1          HH22      ARG   1 -15.142  -1.197   6.019
   16    H    LYS   2           H        LYS   2 -10.479   0.596   1.367
   17    HA   LYS   2           HA       LYS   2  -9.993   1.476  -1.406
   18    HB2  LYS   2           HB3      LYS   2  -7.951   0.349   0.524
   19    HB3  LYS   2           HB2      LYS   2  -7.643   0.868  -1.125
   20    HG2  LYS   2           HG3      LYS   2  -8.540   2.651   1.128
   21    HG3  LYS   2           HG2      LYS   2  -6.891   2.512   0.524
   22    HD2  LYS   2           HD3      LYS   2  -9.264   3.418  -1.102
   23    HD3  LYS   2           HD2      LYS   2  -8.081   4.493  -0.358
   24    HE2  LYS   2           HE3      LYS   2  -6.312   3.476  -1.713
   25    HE3  LYS   2           HE2      LYS   2  -7.496   2.400  -2.452
   26    HZ1  LYS   2           HZ1      LYS   2  -8.638   4.349  -3.336
   27    HZ2  LYS   2           HZ2      LYS   2  -7.036   4.279  -3.878
   28    HZ3  LYS   2           HZ3      LYS   2  -7.467   5.360  -2.654
   29    H    CYS   3           H        CYS   3  -8.493  -0.483  -2.389
   30    HA   CYS   3           HA       CYS   3 -10.264  -2.675  -2.637
   31    HB2  CYS   3           HB3      CYS   3  -7.814  -3.537  -3.621
   32    HB3  CYS   3           HB2      CYS   3  -9.088  -2.746  -4.542
   33    H    ASN   4           H        ASN   4  -6.847  -3.230  -1.925
   34    HA   ASN   4           HA       ASN   4  -7.106  -4.027   0.745
   35    HB2  ASN   4           HB3      ASN   4  -8.483  -5.861  -0.268
   36    HB3  ASN   4           HB2      ASN   4  -7.062  -6.381  -1.164
   37   HD21  ASN   4          HD22      ASN   4  -8.612  -6.231   1.921
   38   HD22  ASN   4          HD21      ASN   4  -7.525  -7.291   2.752
   39    H    PHE   5           H        PHE   5  -5.425  -6.074  -1.542
   40    HA   PHE   5           HA       PHE   5  -2.897  -5.215  -0.419
   41    HB2  PHE   5           HB3      PHE   5  -1.986  -7.133  -1.812
   42    HB3  PHE   5           HB2      PHE   5  -3.105  -7.572  -0.531
   43    HD1  PHE   5           HD1      PHE   5  -5.586  -7.896  -1.237
   44    HD2  PHE   5           HD2      PHE   5  -2.313  -7.941  -3.951
   45    HE1  PHE   5           HE1      PHE   5  -6.951  -9.144  -2.856
   46    HE2  PHE   5           HE2      PHE   5  -3.676  -9.179  -5.579
   47    HZ   PHE   5           HZ       PHE   5  -5.997  -9.786  -5.032
   48    H    LEU   6           H        LEU   6  -1.198  -4.364  -1.594
   49    HA   LEU   6           HA       LEU   6  -0.254  -2.888  -3.024
   50    HB2  LEU   6           HB3      LEU   6  -2.125  -4.141  -5.047
   51    HB3  LEU   6           HB2      LEU   6  -0.899  -2.961  -5.450
   52    HG   LEU   6           HG       LEU   6  -0.092  -5.101  -6.087
   53   HD11  LEU   6          HD11      LEU   6   1.244  -3.963  -3.662
   54   HD12  LEU   6          HD12      LEU   6   1.744  -3.944  -5.360
   55   HD13  LEU   6          HD13      LEU   6   1.853  -5.435  -4.429
   56   HD21  LEU   6          HD21      LEU   6  -1.493  -6.533  -4.806
   57   HD22  LEU   6          HD22      LEU   6  -0.723  -6.027  -3.303
   58   HD23  LEU   6          HD23      LEU   6   0.190  -6.953  -4.494
   59    H    CYS   7           H        CYS   7  -2.193  -2.005  -1.333
   60    HA   CYS   7           HA       CYS   7  -3.474   0.171  -2.772
   61    HB2  CYS   7           HB3      CYS   7  -5.124  -1.875  -1.268
   62    HB3  CYS   7           HB2      CYS   7  -5.734  -0.349  -1.889
   63    H    LYS   8           H        LYS   8  -2.816  -1.506   0.230
   64    HA   LYS   8           HA       LYS   8  -2.505   0.812   1.820
   65    HB2  LYS   8           HB3      LYS   8  -4.974   0.910   1.508
   66    HB3  LYS   8           HB2      LYS   8  -5.105  -0.707   2.180
   67    HG2  LYS   8           HG3      LYS   8  -4.273   0.102   4.320
   68    HG3  LYS   8           HG2      LYS   8  -4.100   1.724   3.647
   69    HD2  LYS   8           HD3      LYS   8  -6.150   1.689   4.858
   70    HD3  LYS   8           HD2      LYS   8  -6.565   1.666   3.148
   71    HE2  LYS   8           HE3      LYS   8  -7.979   0.105   4.262
   72    HE3  LYS   8           HE2      LYS   8  -6.814  -0.809   3.310
   73    HZ1  LYS   8           HZ1      LYS   8  -6.706  -0.325   6.237
   74    HZ2  LYS   8           HZ2      LYS   8  -5.511  -1.130   5.352
   75    HZ3  LYS   8           HZ3      LYS   8  -7.060  -1.789   5.475
   76    H    LEU   9           H        LEU   9  -3.458  -2.553   1.658
   77    HA   LEU   9           HA       LEU   9  -2.097  -3.301   4.088
   78    HB2  LEU   9           HB3      LEU   9  -3.463  -4.817   1.890
   79    HB3  LEU   9           HB2      LEU   9  -2.524  -5.657   3.114
   80    HG   LEU   9           HG       LEU   9  -4.016  -4.537   4.843
   81   HD11  LEU   9          HD11      LEU   9  -6.217  -3.814   4.074
   82   HD12  LEU   9          HD12      LEU   9  -5.690  -3.986   2.401
   83   HD13  LEU   9          HD13      LEU   9  -4.937  -2.780   3.444
   84   HD21  LEU   9          HD21      LEU   9  -4.211  -6.885   4.256
   85   HD22  LEU   9          HD22      LEU   9  -5.252  -6.472   2.895
   86   HD23  LEU   9          HD23      LEU   9  -5.800  -6.178   4.544
   87    H    LYS  10           H        LYS  10  -1.623  -4.416   0.723
   88    HA   LYS  10           HA       LYS  10   1.269  -4.256   1.177
   89    HB2  LYS  10           HB3      LYS  10   0.085  -6.286   0.031
   90    HB3  LYS  10           HB2      LYS  10   0.022  -5.243  -1.378
   91    HG2  LYS  10           HG3      LYS  10   2.459  -5.005  -1.305
   92    HG3  LYS  10           HG2      LYS  10   2.509  -6.093   0.081
   93    HD2  LYS  10           HD3      LYS  10   1.531  -6.767  -2.691
   94    HD3  LYS  10           HD2      LYS  10   3.049  -7.291  -1.963
   95    HE2  LYS  10           HE3      LYS  10   1.693  -8.423  -0.181
   96    HE3  LYS  10           HE2      LYS  10   0.253  -8.037  -1.124
   97    HZ1  LYS  10           HZ1      LYS  10   1.173  -9.312  -2.964
   98    HZ2  LYS  10           HZ2      LYS  10   1.012 -10.270  -1.584
   99    HZ3  LYS  10           HZ3      LYS  10   2.536  -9.700  -2.044
  100    H    GLU  11           H        GLU  11   2.358  -3.361  -1.100
  101    HA   GLU  11           HA       GLU  11   1.249  -0.670  -0.925
  102    HB2  GLU  11           HB3      GLU  11   3.678   0.016  -1.342
  103    HB3  GLU  11           HB2      GLU  11   3.221  -0.617   0.230
  104    HG2  GLU  11           HG3      GLU  11   5.346  -1.507  -0.530
  105    HG3  GLU  11           HG2      GLU  11   4.147  -2.773  -0.317
  106    H    LYS  12           H        LYS  12   2.430   0.804  -2.530
  107    HA   LYS  12           HA       LYS  12   3.217   0.220  -5.051
  108    HB2  LYS  12           HB3      LYS  12   1.437  -0.170  -6.401
  109    HB3  LYS  12           HB2      LYS  12   0.580  -0.583  -4.937
  110    HG2  LYS  12           HG3      LYS  12   0.604   2.208  -5.976
  111    HG3  LYS  12           HG2      LYS  12  -0.489   0.993  -6.634
  112    HD2  LYS  12           HD3      LYS  12  -1.072   0.585  -4.125
  113    HD3  LYS  12           HD2      LYS  12  -0.419   2.217  -3.922
  114    HE2  LYS  12           HE3      LYS  12  -2.681   2.591  -4.320
  115    HE3  LYS  12           HE2      LYS  12  -1.903   2.827  -5.889
  116    HZ1  LYS  12           HZ1      LYS  12  -3.972   1.459  -5.930
  117    HZ2  LYS  12           HZ2      LYS  12  -3.131   0.261  -5.084
  118    HZ3  LYS  12           HZ3      LYS  12  -2.617   0.727  -6.627
  119    H    LEU  13           H        LEU  13   2.950   2.252  -6.485
  120    HA   LEU  13           HA       LEU  13   3.927   4.366  -4.911
  121    HB2  LEU  13           HB3      LEU  13   4.616   3.988  -7.227
  122    HB3  LEU  13           HB2      LEU  13   3.003   4.389  -7.783
  123    HG   LEU  13           HG       LEU  13   3.293   6.691  -6.943
  124   HD11  LEU  13          HD11      LEU  13   6.101   5.797  -6.317
  125   HD12  LEU  13          HD12      LEU  13   4.867   6.259  -5.145
  126   HD13  LEU  13          HD13      LEU  13   5.515   7.459  -6.262
  127   HD21  LEU  13          HD21      LEU  13   4.904   7.414  -8.638
  128   HD22  LEU  13          HD22      LEU  13   3.814   6.177  -9.262
  129   HD23  LEU  13          HD23      LEU  13   5.464   5.751  -8.811
  130    H    ARG  14           H        ARG  14   2.447   5.051  -3.393
  131    HA   ARG  14           HA       ARG  14   0.533   6.956  -4.485
  132    HB2  ARG  14           HB3      ARG  14  -0.293   4.516  -3.248
  133    HB3  ARG  14           HB2      ARG  14  -0.731   5.854  -2.193
  134    HG2  ARG  14           HG3      ARG  14  -1.472   5.579  -5.100
  135    HG3  ARG  14           HG2      ARG  14  -2.541   5.308  -3.722
  136    HD2  ARG  14           HD3      ARG  14  -2.321   7.637  -3.065
  137    HD3  ARG  14           HD2      ARG  14  -1.185   7.924  -4.379
  138    HE   ARG  14           HE       ARG  14  -3.675   6.913  -5.329
  139   HH11  ARG  14          HH11      ARG  14  -2.064   9.819  -4.228
  140   HH12  ARG  14          HH12      ARG  14  -3.114  10.886  -5.100
  141   HH21  ARG  14          HH22      ARG  14  -5.050   8.316  -6.496
  142   HH22  ARG  14          HH21      ARG  14  -4.805  10.033  -6.395
  143    H    THR  15           H        THR  15   2.448   5.758  -1.823
  144    HA   THR  15           HA       THR  15   3.831   6.909  -0.454
  145    HB   THR  15           HB       THR  15   2.780   9.443  -1.682
  146    HG1  THR  15           HG1      THR  15   5.114   8.428  -2.724
  147   HG21  THR  15          HG21      THR  15   5.033  10.291  -1.195
  148   HG22  THR  15          HG22      THR  15   5.465   8.734  -0.487
  149   HG23  THR  15          HG23      THR  15   4.232   9.737   0.275
  150    H    VAL  16           H        VAL  16   0.447   7.396  -0.379
  151    HA   VAL  16           HA       VAL  16   0.709   8.450   2.356
  152    HB   VAL  16           HB       VAL  16  -1.508   9.183   0.438
  153   HG11  VAL  16          HG11      VAL  16  -2.065   8.932   2.894
  154   HG12  VAL  16          HG12      VAL  16  -2.419  10.507   2.169
  155   HG13  VAL  16          HG13      VAL  16  -0.986  10.304   3.181
  156   HG21  VAL  16          HG21      VAL  16   0.736  10.869   1.553
  157   HG22  VAL  16          HG22      VAL  16  -0.586  11.447   0.540
  158   HG23  VAL  16          HG23      VAL  16   0.594  10.311  -0.113
  159    H    ILE  17           H        ILE  17  -2.210   7.469   0.587
  160    HA   ILE  17           HA       ILE  17  -3.274   6.010   2.706
  161    HB   ILE  17           HB       ILE  17  -4.838   6.624   1.088
  162   HG12  ILE  17          HG13      ILE  17  -5.798   4.524   0.191
  163   HG13  ILE  17          HG12      ILE  17  -4.303   3.687   0.587
  164   HG21  ILE  17          HG21      ILE  17  -4.686   6.105  -1.294
  165   HG22  ILE  17          HG22      ILE  17  -3.138   5.307  -1.022
  166   HG23  ILE  17          HG23      ILE  17  -3.296   7.040  -0.744
  167   HD11  ILE  17          HD11      ILE  17  -4.754   4.424   2.993
  168   HD12  ILE  17          HD12      ILE  17  -5.755   3.137   2.309
  169   HD13  ILE  17          HD13      ILE  17  -6.388   4.784   2.431
  170    H    THR  18           H        THR  18  -1.550   4.838  -0.157
  171    HA   THR  18           HA       THR  18  -1.674   2.123   0.660
  172    HB   THR  18           HB       THR  18   0.147   3.360  -1.403
  173    HG1  THR  18           HG1      THR  18  -2.570   2.514  -1.486
  174   HG21  THR  18          HG21      THR  18   0.118   1.132  -2.387
  175   HG22  THR  18          HG22      THR  18  -0.947   0.563  -1.101
  176   HG23  THR  18          HG23      THR  18   0.699   1.067  -0.725
  177    H    SER  19           H        SER  19   0.428   4.753   1.390
  178    HA   SER  19           HA       SER  19   2.673   3.073   2.031
  179    HB2  SER  19           HB3      SER  19   3.827   5.063   2.578
  180    HB3  SER  19           HB2      SER  19   2.790   5.490   1.228
  181    HG   SER  19           HG       SER  19   2.750   7.014   2.984
  182    H    HIS  20           H        HIS  20  -0.141   3.117   3.384
  183    HA   HIS  20           HA       HIS  20   0.277   3.597   6.141
  184    HB2  HIS  20           HB3      HIS  20  -1.958   3.437   5.061
  185    HB3  HIS  20           HB2      HIS  20  -1.690   1.719   4.805
  186    HD1  HIS  20           HD1      HIS  20  -2.792   0.308   6.492
  187    HD2  HIS  20           HD2      HIS  20  -1.754   4.026   8.042
  188    HE1  HIS  20           HE1      HIS  20  -3.635   0.315   8.857
  189    HE2  HIS  20           HE2      HIS  20  -2.841   2.499   9.825
  190    H    ILE  21           H        ILE  21  -0.051   0.491   4.430
  191    HA   ILE  21           HA       ILE  21   2.086  -0.630   6.098
  192    HB   ILE  21           HB       ILE  21  -0.571  -1.996   5.563
  193   HG12  ILE  21          HG13      ILE  21   0.683  -1.029   8.142
  194   HG13  ILE  21          HG12      ILE  21  -0.722  -0.329   7.345
  195   HG21  ILE  21          HG21      ILE  21   1.861  -3.020   7.024
  196   HG22  ILE  21          HG22      ILE  21   1.269  -3.585   5.462
  197   HG23  ILE  21          HG23      ILE  21   0.305  -3.842   6.916
  198   HD11  ILE  21          HD11      ILE  21  -0.549  -3.070   8.573
  199   HD12  ILE  21          HD12      ILE  21  -1.953  -2.417   7.729
  200   HD13  ILE  21          HD13      ILE  21  -1.401  -1.672   9.228
  201    H    ASP  22           H        ASP  22   3.193  -2.422   5.004
  202    HA   ASP  22           HA       ASP  22   2.550  -2.707   2.181
  203    HB2  ASP  22           HB3      ASP  22   4.516  -1.785   1.362
  204    HB3  ASP  22           HB2      ASP  22   4.101  -0.694   2.667
  205    H    LYS  23           H        LYS  23   4.816  -3.929   1.286
  206    HA   LYS  23           HA       LYS  23   4.668  -6.555   2.374
  207    HB2  LYS  23           HB3      LYS  23   6.299  -7.135   0.716
  208    HB3  LYS  23           HB2      LYS  23   5.204  -5.964  -0.009
  209    HG2  LYS  23           HG3      LYS  23   6.837  -4.186   0.410
  210    HG3  LYS  23           HG2      LYS  23   7.936  -5.372   1.109
  211    HD2  LYS  23           HD3      LYS  23   8.680  -5.068  -1.098
  212    HD3  LYS  23           HD2      LYS  23   7.779  -6.585  -1.126
  213    HE2  LYS  23           HE3      LYS  23   5.802  -5.349  -1.934
  214    HE3  LYS  23           HE2      LYS  23   6.778  -3.877  -1.976
  215    HZ1  LYS  23           HZ1      LYS  23   7.271  -6.340  -3.563
  216    HZ2  LYS  23           HZ2      LYS  23   8.225  -4.946  -3.601
  217    HZ3  LYS  23           HZ3      LYS  23   6.631  -4.895  -4.157
  218    H    VAL  24           H        VAL  24   6.013  -3.967   3.741
  219    HA   VAL  24           HA       VAL  24   7.436  -3.634   5.460
  220    HB   VAL  24           HB       VAL  24   8.265  -6.540   5.319
  221   HG11  VAL  24          HG11      VAL  24   8.461  -4.424   7.449
  222   HG12  VAL  24          HG12      VAL  24   9.785  -5.255   6.633
  223   HG13  VAL  24          HG13      VAL  24   8.742  -6.139   7.747
  224   HG21  VAL  24          HG21      VAL  24   5.833  -6.380   5.576
  225   HG22  VAL  24          HG22      VAL  24   6.049  -5.288   6.942
  226   HG23  VAL  24          HG23      VAL  24   6.596  -6.959   7.056
  227    H    LEU  25           H        LEU  25   8.040  -3.141   2.815
  228    HA   LEU  25           HA       LEU  25  10.965  -3.024   3.038
  229    HB2  LEU  25           HB3      LEU  25   9.377  -3.890   0.660
  230    HB3  LEU  25           HB2      LEU  25  10.822  -2.941   0.393
  231    HG   LEU  25           HG       LEU  25  12.034  -4.719   1.802
  232   HD11  LEU  25          HD11      LEU  25   9.975  -5.779   2.672
  233   HD12  LEU  25          HD12      LEU  25  11.068  -6.908   1.871
  234   HD13  LEU  25          HD13      LEU  25   9.621  -6.345   1.039
  235   HD21  LEU  25          HD21      LEU  25  10.920  -5.417  -0.908
  236   HD22  LEU  25          HD22      LEU  25  12.332  -6.157  -0.153
  237   HD23  LEU  25          HD23      LEU  25  12.358  -4.448  -0.585
  238    H    ARG  26           H        ARG  26   8.406  -1.753   0.865
  239    HA   ARG  26           HA       ARG  26   8.933   0.923   1.859
  240    HB2  ARG  26           HB3      ARG  26   8.949   1.538  -0.784
  241    HB3  ARG  26           HB2      ARG  26  10.381   1.408   0.220
  242    HG2  ARG  26           HG3      ARG  26  10.791   0.243  -1.806
  243    HG3  ARG  26           HG2      ARG  26  10.616  -0.952  -0.525
  244    HD2  ARG  26           HD3      ARG  26   8.364  -1.459  -1.260
  245    HD3  ARG  26           HD2      ARG  26   8.439  -0.183  -2.481
  246    HE   ARG  26           HE       ARG  26  10.534  -2.157  -2.690
  247   HH11  ARG  26          HH11      ARG  26   7.226  -1.420  -3.617
  248   HH12  ARG  26          HH12      ARG  26   7.321  -2.331  -5.091
  249   HH21  ARG  26          HH22      ARG  26  10.623  -3.382  -4.600
  250   HH22  ARG  26          HH21      ARG  26   9.245  -3.446  -5.648
  251    HA   PRO  27           HA       PRO  27   4.457   0.591   1.284
  252    HB2  PRO  27           HB2      PRO  27   4.586   3.152   2.750
  253    HB3  PRO  27           HB3      PRO  27   3.667   1.680   3.122
  254    HG2  PRO  27           HG3      PRO  27   5.804   2.393   4.555
  255    HG3  PRO  27           HG2      PRO  27   5.435   0.695   4.202
  256    HD2  PRO  27           HD3      PRO  27   7.461   2.501   2.935
  257    HD3  PRO  27           HD2      PRO  27   7.602   0.786   3.371
  258    H    GLN  28           H        GLN  28   6.681   3.050   0.362
  259    HA   GLN  28           HA       GLN  28   4.737   4.702  -0.966
  260    HB2  GLN  28           HB3      GLN  28   7.757   4.687  -1.052
  261    HB3  GLN  28           HB2      GLN  28   6.762   5.851  -1.915
  262    HG2  GLN  28           HG3      GLN  28   7.474   6.917   0.061
  263    HG3  GLN  28           HG2      GLN  28   5.780   6.502   0.307
  264   HE21  GLN  28          HE22      GLN  28   5.981   6.569   2.537
  265   HE22  GLN  28          HE21      GLN  28   6.816   5.346   3.431
  266    H    GLY  29           H        GLY  29   6.140   1.763  -1.642
  267    HA2  GLY  29           HA3      GLY  29   5.889   0.395  -3.471
  268    HA3  GLY  29           HA2      GLY  29   4.979   1.681  -4.248
  Start of MODEL   16
    1    H1   ARG   1           H1       ARG   1  -9.678   4.199   2.847
    2    H2   ARG   1           H2       ARG   1 -11.034   3.207   3.011
    3    H3   ARG   1           H3       ARG   1 -11.100   4.564   2.003
    4    HA   ARG   1           HA       ARG   1 -10.891   2.590   0.688
    5    HB2  ARG   1           HB3      ARG   1  -8.341   4.217   0.827
    6    HB3  ARG   1           HB2      ARG   1  -8.761   3.135  -0.492
    7    HG2  ARG   1           HG3      ARG   1 -10.623   4.499  -1.107
    8    HG3  ARG   1           HG2      ARG   1 -10.415   5.509   0.326
    9    HD2  ARG   1           HD3      ARG   1  -9.524   6.601  -1.667
   10    HD3  ARG   1           HD2      ARG   1  -8.251   6.256  -0.497
   11    HE   ARG   1           HE       ARG   1  -8.255   4.105  -2.200
   12   HH11  ARG   1          HH12      ARG   1  -7.855   7.563  -2.539
   13   HH12  ARG   1          HH11      ARG   1  -6.840   7.438  -3.939
   14   HH21  ARG   1          HH21      ARG   1  -6.899   3.930  -4.020
   15   HH22  ARG   1          HH22      ARG   1  -6.293   5.369  -4.784
   16    H    LYS   2           H        LYS   2 -10.209   0.534   0.562
   17    HA   LYS   2           HA       LYS   2  -7.764  -0.417   1.597
   18    HB2  LYS   2           HB3      LYS   2  -9.273   0.040   3.692
   19    HB3  LYS   2           HB2      LYS   2 -10.094  -1.427   3.191
   20    HG2  LYS   2           HG3      LYS   2  -7.942  -2.640   3.333
   21    HG3  LYS   2           HG2      LYS   2  -7.191  -1.158   3.937
   22    HD2  LYS   2           HD3      LYS   2  -8.736  -1.164   5.841
   23    HD3  LYS   2           HD2      LYS   2  -9.447  -2.668   5.252
   24    HE2  LYS   2           HE3      LYS   2  -7.313  -3.799   5.502
   25    HE3  LYS   2           HE2      LYS   2  -6.553  -2.295   6.013
   26    HZ1  LYS   2           HZ1      LYS   2  -7.130  -3.772   7.870
   27    HZ2  LYS   2           HZ2      LYS   2  -8.765  -3.636   7.465
   28    HZ3  LYS   2           HZ3      LYS   2  -7.904  -2.273   7.975
   29    H    CYS   3           H        CYS   3  -8.780  -0.662  -0.812
   30    HA   CYS   3           HA       CYS   3 -10.519  -2.919  -1.112
   31    HB2  CYS   3           HB3      CYS   3 -10.332  -2.501  -3.510
   32    HB3  CYS   3           HB2      CYS   3 -10.713  -1.035  -2.632
   33    H    ASN   4           H        ASN   4  -8.772  -4.127   0.206
   34    HA   ASN   4           HA       ASN   4  -7.601  -6.071   0.248
   35    HB2  ASN   4           HB3      ASN   4  -7.873  -6.030  -2.768
   36    HB3  ASN   4           HB2      ASN   4  -7.341  -7.403  -1.803
   37   HD21  ASN   4          HD22      ASN   4  -9.623  -7.066  -3.616
   38   HD22  ASN   4          HD21      ASN   4 -11.022  -7.476  -2.685
   39    H    PHE   5           H        PHE   5  -5.620  -7.067  -1.439
   40    HA   PHE   5           HA       PHE   5  -3.426  -5.494  -0.649
   41    HB2  PHE   5           HB3      PHE   5  -2.194  -7.089  -2.304
   42    HB3  PHE   5           HB2      PHE   5  -2.872  -7.719  -0.809
   43    HD1  PHE   5           HD2      PHE   5  -3.482  -7.384  -4.442
   44    HD2  PHE   5           HD1      PHE   5  -4.502  -9.417  -0.848
   45    HE1  PHE   5           HE2      PHE   5  -4.780  -9.019  -5.740
   46    HE2  PHE   5           HE1      PHE   5  -5.807 -11.054  -2.139
   47    HZ   PHE   5           HZ       PHE   5  -5.928 -10.892  -4.562
   48    H    LEU   6           H        LEU   6  -1.747  -4.670  -2.073
   49    HA   LEU   6           HA       LEU   6  -1.103  -2.979  -3.422
   50    HB2  LEU   6           HB3      LEU   6  -2.969  -4.434  -5.281
   51    HB3  LEU   6           HB2      LEU   6  -2.069  -3.021  -5.786
   52    HG   LEU   6           HG       LEU   6  -0.858  -4.883  -6.569
   53   HD11  LEU   6          HD11      LEU   6   0.515  -4.074  -4.011
   54   HD12  LEU   6          HD12      LEU   6   0.497  -3.125  -5.501
   55   HD13  LEU   6          HD13      LEU   6   1.263  -4.711  -5.478
   56   HD21  LEU   6          HD21      LEU   6  -1.875  -6.642  -5.283
   57   HD22  LEU   6          HD22      LEU   6  -1.101  -6.061  -3.810
   58   HD23  LEU   6          HD23      LEU   6  -0.123  -6.732  -5.114
   59    H    CYS   7           H        CYS   7  -3.138  -2.414  -1.570
   60    HA   CYS   7           HA       CYS   7  -4.358  -0.084  -2.749
   61    HB2  CYS   7           HB3      CYS   7  -5.952  -1.941  -3.284
   62    HB3  CYS   7           HB2      CYS   7  -6.123  -2.240  -1.560
   63    H    LYS   8           H        LYS   8  -4.903  -2.205   0.085
   64    HA   LYS   8           HA       LYS   8  -3.254  -0.518   1.733
   65    HB2  LYS   8           HB3      LYS   8  -5.449   0.675   1.768
   66    HB3  LYS   8           HB2      LYS   8  -6.191  -0.779   2.410
   67    HG2  LYS   8           HG3      LYS   8  -4.920  -0.619   4.431
   68    HG3  LYS   8           HG2      LYS   8  -3.983   0.729   3.782
   69    HD2  LYS   8           HD3      LYS   8  -5.819   2.187   3.869
   70    HD3  LYS   8           HD2      LYS   8  -6.971   0.863   4.049
   71    HE2  LYS   8           HE3      LYS   8  -6.220   0.422   6.268
   72    HE3  LYS   8           HE2      LYS   8  -4.878   1.543   6.090
   73    HZ1  LYS   8           HZ1      LYS   8  -6.438   3.362   5.949
   74    HZ2  LYS   8           HZ2      LYS   8  -6.700   2.493   7.374
   75    HZ3  LYS   8           HZ3      LYS   8  -7.747   2.297   6.062
   76    H    LEU   9           H        LEU   9  -2.858  -3.029   0.962
   77    HA   LEU   9           HA       LEU   9  -2.998  -4.555   3.432
   78    HB2  LEU   9           HB3      LEU   9  -4.439  -5.348   0.966
   79    HB3  LEU   9           HB2      LEU   9  -3.536  -6.611   1.774
   80    HG   LEU   9           HG       LEU   9  -4.868  -5.824   3.888
   81   HD11  LEU   9          HD11      LEU   9  -6.686  -4.904   1.670
   82   HD12  LEU   9          HD12      LEU   9  -5.871  -3.859   2.831
   83   HD13  LEU   9          HD13      LEU   9  -7.095  -5.003   3.382
   84   HD21  LEU   9          HD21      LEU   9  -5.033  -8.024   2.863
   85   HD22  LEU   9          HD22      LEU   9  -6.141  -7.387   1.648
   86   HD23  LEU   9          HD23      LEU   9  -6.625  -7.435   3.343
   87    H    LYS  10           H        LYS  10  -1.813  -4.235   0.128
   88    HA   LYS  10           HA       LYS  10   0.674  -5.593   0.961
   89    HB2  LYS  10           HB3      LYS  10  -0.667  -6.988  -0.626
   90    HB3  LYS  10           HB2      LYS  10  -0.513  -5.706  -1.814
   91    HG2  LYS  10           HG3      LYS  10   1.115  -7.321  -2.358
   92    HG3  LYS  10           HG2      LYS  10   1.980  -5.968  -1.625
   93    HD2  LYS  10           HD3      LYS  10   2.894  -7.946  -0.685
   94    HD3  LYS  10           HD2      LYS  10   1.867  -7.229   0.556
   95    HE2  LYS  10           HE3      LYS  10   1.402  -9.551   0.569
   96    HE3  LYS  10           HE2      LYS  10   0.035  -8.773  -0.231
   97    HZ1  LYS  10           HZ1      LYS  10   0.756 -10.761  -1.405
   98    HZ2  LYS  10           HZ2      LYS  10   2.302 -10.108  -1.609
   99    HZ3  LYS  10           HZ3      LYS  10   0.973  -9.388  -2.364
  100    H    GLU  11           H        GLU  11  -0.680  -3.489  -1.544
  101    HA   GLU  11           HA       GLU  11  -0.078  -1.519  -2.417
  102    HB2  GLU  11           HB3      GLU  11   1.459  -1.410   0.148
  103    HB3  GLU  11           HB2      GLU  11   1.560  -0.111  -1.032
  104    HG2  GLU  11           HG3      GLU  11  -0.083   0.476   0.573
  105    HG3  GLU  11           HG2      GLU  11  -0.908   0.091  -0.932
  106    H    LYS  12           H        LYS  12   2.029  -0.094  -2.856
  107    HA   LYS  12           HA       LYS  12   4.151  -1.776  -3.843
  108    HB2  LYS  12           HB3      LYS  12   3.835  -1.185  -6.189
  109    HB3  LYS  12           HB2      LYS  12   2.444  -2.048  -5.565
  110    HG2  LYS  12           HG3      LYS  12   2.510   0.945  -5.773
  111    HG3  LYS  12           HG2      LYS  12   2.038  -0.082  -7.121
  112    HD2  LYS  12           HD3      LYS  12   0.341  -1.114  -5.488
  113    HD3  LYS  12           HD2      LYS  12   0.665   0.302  -4.469
  114    HE2  LYS  12           HE3      LYS  12  -0.140   1.786  -6.088
  115    HE3  LYS  12           HE2      LYS  12  -0.023   0.585  -7.371
  116    HZ1  LYS  12           HZ1      LYS  12  -1.877  -0.595  -6.442
  117    HZ2  LYS  12           HZ2      LYS  12  -2.321   1.020  -6.656
  118    HZ3  LYS  12           HZ3      LYS  12  -1.948   0.443  -5.114
  119    H    LEU  13           H        LEU  13   2.706   1.461  -4.137
  120    HA   LEU  13           HA       LEU  13   4.610   2.959  -2.878
  121    HB2  LEU  13           HB3      LEU  13   6.112   1.973  -4.709
  122    HB3  LEU  13           HB2      LEU  13   5.211   2.960  -5.840
  123    HG   LEU  13           HG       LEU  13   6.600   4.215  -3.489
  124   HD11  LEU  13          HD11      LEU  13   8.554   4.578  -4.908
  125   HD12  LEU  13          HD12      LEU  13   7.824   3.591  -6.173
  126   HD13  LEU  13          HD13      LEU  13   8.275   2.859  -4.634
  127   HD21  LEU  13          HD21      LEU  13   6.696   6.146  -5.005
  128   HD22  LEU  13          HD22      LEU  13   5.040   5.608  -4.728
  129   HD23  LEU  13          HD23      LEU  13   5.856   5.209  -6.238
  130    H    ARG  14           H        ARG  14   3.627   4.904  -2.616
  131    HA   ARG  14           HA       ARG  14   2.442   6.286  -4.806
  132    HB2  ARG  14           HB3      ARG  14   0.728   4.473  -3.843
  133    HB3  ARG  14           HB2      ARG  14   0.406   5.766  -2.701
  134    HG2  ARG  14           HG3      ARG  14   0.157   5.927  -5.696
  135    HG3  ARG  14           HG2      ARG  14  -1.164   5.846  -4.531
  136    HD2  ARG  14           HD3      ARG  14  -0.445   7.997  -3.591
  137    HD3  ARG  14           HD2      ARG  14   0.846   8.077  -4.788
  138    HE   ARG  14           HE       ARG  14  -1.559   7.738  -6.155
  139   HH11  ARG  14          HH11      ARG  14  -0.002  10.138  -4.124
  140   HH12  ARG  14          HH12      ARG  14  -0.825  11.475  -4.869
  141   HH21  ARG  14          HH22      ARG  14  -2.663   9.494  -7.106
  142   HH22  ARG  14          HH21      ARG  14  -2.338  11.111  -6.557
  143    H    THR  15           H        THR  15   1.207   6.501  -1.508
  144    HA   THR  15           HA       THR  15   2.914   8.758  -0.918
  145    HB   THR  15           HB       THR  15  -0.079   9.169  -1.074
  146    HG1  THR  15           HG1      THR  15   2.032   9.955  -2.831
  147   HG21  THR  15          HG21      THR  15   2.170  11.138  -0.640
  148   HG22  THR  15          HG22      THR  15   1.120  10.507   0.627
  149   HG23  THR  15          HG23      THR  15   0.446  11.500  -0.661
  150    H    VAL  16           H        VAL  16  -0.135   7.144   0.133
  151    HA   VAL  16           HA       VAL  16   0.988   6.755   2.775
  152    HB   VAL  16           HB       VAL  16  -1.503   8.447   2.436
  153   HG11  VAL  16          HG11      VAL  16  -1.594   6.670   4.232
  154   HG12  VAL  16          HG12      VAL  16  -1.815   8.333   4.786
  155   HG13  VAL  16          HG13      VAL  16  -0.266   7.523   5.023
  156   HG21  VAL  16          HG21      VAL  16  -0.283  10.125   3.726
  157   HG22  VAL  16          HG22      VAL  16   0.573   9.727   2.239
  158   HG23  VAL  16          HG23      VAL  16   1.129   9.070   3.777
  159    H    ILE  17           H        ILE  17  -2.286   6.840   1.317
  160    HA   ILE  17           HA       ILE  17  -3.035   4.514   2.787
  161    HB   ILE  17           HB       ILE  17  -4.579   6.400   2.089
  162   HG12  ILE  17          HG13      ILE  17  -5.321   4.146   2.984
  163   HG13  ILE  17          HG12      ILE  17  -6.518   5.048   2.071
  164   HG21  ILE  17          HG21      ILE  17  -3.975   6.584  -0.242
  165   HG22  ILE  17          HG22      ILE  17  -5.694   6.230  -0.083
  166   HG23  ILE  17          HG23      ILE  17  -4.570   4.956  -0.550
  167   HD11  ILE  17          HD11      ILE  17  -6.683   2.767   1.455
  168   HD12  ILE  17          HD12      ILE  17  -4.948   2.655   1.163
  169   HD13  ILE  17          HD13      ILE  17  -5.960   3.630   0.098
  170    H    THR  18           H        THR  18  -2.074   5.132  -0.539
  171    HA   THR  18           HA       THR  18  -2.542   2.380  -1.319
  172    HB   THR  18           HB       THR  18  -1.190   4.486  -2.998
  173    HG1  THR  18           HG1      THR  18  -3.938   4.202  -2.337
  174   HG21  THR  18          HG21      THR  18  -2.986   2.157  -3.679
  175   HG22  THR  18          HG22      THR  18  -1.234   2.200  -3.861
  176   HG23  THR  18          HG23      THR  18  -2.247   3.263  -4.838
  177    H    SER  19           H        SER  19  -0.357   3.821   0.469
  178    HA   SER  19           HA       SER  19   1.581   1.702   0.002
  179    HB2  SER  19           HB3      SER  19   2.399   3.707  -1.235
  180    HB3  SER  19           HB2      SER  19   2.364   4.618   0.272
  181    HG   SER  19           HG       SER  19   3.835   2.213   0.056
  182    H    HIS  20           H        HIS  20   0.011   1.247   1.933
  183    HA   HIS  20           HA       HIS  20   0.854   2.697   4.341
  184    HB2  HIS  20           HB3      HIS  20  -1.513   3.075   3.594
  185    HB3  HIS  20           HB2      HIS  20  -1.812   1.360   3.863
  186    HD1  HIS  20           HD1      HIS  20  -0.447   4.268   5.922
  187    HD2  HIS  20           HD2      HIS  20  -2.831   0.884   6.310
  188    HE1  HIS  20           HE1      HIS  20  -1.249   4.275   8.304
  189    HE2  HIS  20           HE2      HIS  20  -2.743   2.257   8.499
  190    H    ILE  21           H        ILE  21  -0.839  -0.375   3.639
  191    HA   ILE  21           HA       ILE  21   0.793  -1.648   5.710
  192    HB   ILE  21           HB       ILE  21  -1.515  -2.887   4.190
  193   HG12  ILE  21          HG13      ILE  21  -1.518  -1.403   6.831
  194   HG13  ILE  21          HG12      ILE  21  -2.329  -0.905   5.352
  195   HG21  ILE  21          HG21      ILE  21  -0.021  -4.481   5.287
  196   HG22  ILE  21          HG22      ILE  21  -1.587  -4.433   6.096
  197   HG23  ILE  21          HG23      ILE  21  -0.200  -3.612   6.812
  198   HD11  ILE  21          HD11      ILE  21  -3.899  -1.830   6.952
  199   HD12  ILE  21          HD12      ILE  21  -2.989  -3.340   6.991
  200   HD13  ILE  21          HD13      ILE  21  -3.806  -2.841   5.510
  201    H    ASP  22           H        ASP  22   2.193  -0.851   3.667
  202    HA   ASP  22           HA       ASP  22   2.511  -2.420   1.406
  203    HB2  ASP  22           HB3      ASP  22   3.556  -0.210   1.784
  204    HB3  ASP  22           HB2      ASP  22   4.599  -0.928   2.993
  205    H    LYS  23           H        LYS  23   4.143  -3.934   0.894
  206    HA   LYS  23           HA       LYS  23   4.477  -6.076   2.691
  207    HB2  LYS  23           HB3      LYS  23   6.129  -6.917   0.979
  208    HB3  LYS  23           HB2      LYS  23   4.526  -6.551   0.358
  209    HG2  LYS  23           HG3      LYS  23   6.563  -4.403   0.218
  210    HG3  LYS  23           HG2      LYS  23   6.748  -5.776  -0.872
  211    HD2  LYS  23           HD3      LYS  23   4.592  -5.401  -1.827
  212    HD3  LYS  23           HD2      LYS  23   4.194  -4.194  -0.612
  213    HE2  LYS  23           HE3      LYS  23   4.754  -3.099  -2.672
  214    HE3  LYS  23           HE2      LYS  23   6.009  -2.759  -1.480
  215    HZ1  LYS  23           HZ1      LYS  23   7.415  -4.388  -2.520
  216    HZ2  LYS  23           HZ2      LYS  23   6.880  -3.312  -3.706
  217    HZ3  LYS  23           HZ3      LYS  23   6.194  -4.852  -3.585
  218    H    VAL  24           H        VAL  24   5.756  -3.202   3.097
  219    HA   VAL  24           HA       VAL  24   7.368  -2.361   4.427
  220    HB   VAL  24           HB       VAL  24   8.261  -5.185   5.040
  221   HG11  VAL  24          HG11      VAL  24   8.540  -2.575   6.525
  222   HG12  VAL  24          HG12      VAL  24   9.831  -3.515   5.778
  223   HG13  VAL  24          HG13      VAL  24   8.977  -4.152   7.183
  224   HG21  VAL  24          HG21      VAL  24   6.136  -3.551   6.429
  225   HG22  VAL  24          HG22      VAL  24   6.758  -5.109   6.973
  226   HG23  VAL  24          HG23      VAL  24   5.862  -4.997   5.458
  227    H    LEU  25           H        LEU  25   7.768  -2.376   1.808
  228    HA   LEU  25           HA       LEU  25  10.665  -2.881   1.588
  229    HB2  LEU  25           HB3      LEU  25   8.473  -3.399  -0.333
  230    HB3  LEU  25           HB2      LEU  25   9.951  -2.740  -1.000
  231    HG   LEU  25           HG       LEU  25  11.200  -4.641   0.037
  232   HD11  LEU  25          HD11      LEU  25   8.431  -5.684   0.589
  233   HD12  LEU  25          HD12      LEU  25   9.641  -5.234   1.790
  234   HD13  LEU  25          HD13      LEU  25   9.923  -6.609   0.726
  235   HD21  LEU  25          HD21      LEU  25  10.578  -4.667  -2.307
  236   HD22  LEU  25          HD22      LEU  25   9.007  -5.355  -1.900
  237   HD23  LEU  25          HD23      LEU  25  10.477  -6.287  -1.618
  238    H    ARG  26           H        ARG  26   7.979  -0.750   0.604
  239    HA   ARG  26           HA       ARG  26   9.752   1.507   0.929
  240    HB2  ARG  26           HB3      ARG  26   9.315   2.465  -1.319
  241    HB3  ARG  26           HB2      ARG  26  10.290   1.005  -1.360
  242    HG2  ARG  26           HG3      ARG  26   7.363   0.699  -1.710
  243    HG3  ARG  26           HG2      ARG  26   8.278   1.423  -3.033
  244    HD2  ARG  26           HD3      ARG  26   9.136  -1.144  -1.745
  245    HD3  ARG  26           HD2      ARG  26   7.939  -1.120  -3.037
  246    HE   ARG  26           HE       ARG  26   9.624  -0.179  -4.487
  247   HH11  ARG  26          HH11      ARG  26  10.852  -1.392  -1.442
  248   HH12  ARG  26          HH12      ARG  26  12.423  -1.745  -2.072
  249   HH21  ARG  26          HH22      ARG  26  11.703  -0.616  -5.303
  250   HH22  ARG  26          HH21      ARG  26  12.911  -1.295  -4.256
  251    HA   PRO  27           HA       PRO  27   5.167   2.330   1.849
  252    HB2  PRO  27           HB2      PRO  27   6.359   2.887   4.520
  253    HB3  PRO  27           HB3      PRO  27   4.828   2.082   4.110
  254    HG2  PRO  27           HG3      PRO  27   6.892   0.661   4.982
  255    HG3  PRO  27           HG2      PRO  27   5.862   0.064   3.665
  256    HD2  PRO  27           HD3      PRO  27   8.575   1.351   3.509
  257    HD3  PRO  27           HD2      PRO  27   7.959  -0.074   2.641
  258    H    GLN  28           H        GLN  28   4.769   4.329   1.143
  259    HA   GLN  28           HA       GLN  28   6.816   6.361   1.302
  260    HB2  GLN  28           HB3      GLN  28   4.056   6.450   0.075
  261    HB3  GLN  28           HB2      GLN  28   5.306   7.674  -0.127
  262    HG2  GLN  28           HG3      GLN  28   5.498   4.802  -1.007
  263    HG3  GLN  28           HG2      GLN  28   5.180   6.188  -2.052
  264   HE21  GLN  28          HE22      GLN  28   7.409   4.181  -1.907
  265   HE22  GLN  28          HE21      GLN  28   8.848   5.144  -1.873
  266    H    GLY  29           H        GLY  29   3.953   5.542   3.020
  267    HA2  GLY  29           HA3      GLY  29   3.834   8.215   4.232
  268    HA3  GLY  29           HA2      GLY  29   2.597   6.973   4.366
  Start of MODEL   17
    1    H1   ARG   1           H1       ARG   1 -11.549   1.930   3.916
    2    H2   ARG   1           H2       ARG   1 -11.252   2.824   2.516
    3    H3   ARG   1           H3       ARG   1 -10.097   1.727   3.073
    4    HA   ARG   1           HA       ARG   1 -11.609  -0.108   2.660
    5    HB2  ARG   1           HB3      ARG   1 -13.356   1.996   1.361
    6    HB3  ARG   1           HB2      ARG   1 -13.670   0.268   1.416
    7    HG2  ARG   1           HG3      ARG   1 -13.595   2.113   3.789
    8    HG3  ARG   1           HG2      ARG   1 -15.045   1.497   3.005
    9    HD2  ARG   1           HD3      ARG   1 -14.442  -0.770   3.608
   10    HD3  ARG   1           HD2      ARG   1 -12.929  -0.205   4.313
   11    HE   ARG   1           HE       ARG   1 -15.219   1.052   5.478
   12   HH11  ARG   1          HH12      ARG   1 -13.244  -1.840   5.554
   13   HH12  ARG   1          HH11      ARG   1 -13.636  -2.212   7.203
   14   HH21  ARG   1          HH21      ARG   1 -15.743   0.548   7.647
   15   HH22  ARG   1          HH22      ARG   1 -15.060  -0.865   8.385
   16    H    LYS   2           H        LYS   2  -9.722  -0.542   1.505
   17    HA   LYS   2           HA       LYS   2  -9.722   0.413  -1.279
   18    HB2  LYS   2           HB3      LYS   2  -7.293  -0.220   0.410
   19    HB3  LYS   2           HB2      LYS   2  -7.284   0.345  -1.252
   20    HG2  LYS   2           HG3      LYS   2  -8.271   1.898   1.128
   21    HG3  LYS   2           HG2      LYS   2  -6.731   2.130   0.301
   22    HD2  LYS   2           HD3      LYS   2  -7.934   2.726  -1.754
   23    HD3  LYS   2           HD2      LYS   2  -9.470   2.509  -0.911
   24    HE2  LYS   2           HE3      LYS   2  -8.798   4.273   0.684
   25    HE3  LYS   2           HE2      LYS   2  -7.326   4.524  -0.253
   26    HZ1  LYS   2           HZ1      LYS   2  -8.696   5.129  -2.153
   27    HZ2  LYS   2           HZ2      LYS   2  -9.007   6.136  -0.832
   28    HZ3  LYS   2           HZ3      LYS   2 -10.097   4.911  -1.238
   29    H    CYS   3           H        CYS   3  -8.160  -1.137  -2.586
   30    HA   CYS   3           HA       CYS   3  -9.383  -3.728  -2.409
   31    HB2  CYS   3           HB3      CYS   3  -7.621  -3.997  -4.430
   32    HB3  CYS   3           HB2      CYS   3  -9.200  -3.241  -4.611
   33    H    ASN   4           H        ASN   4  -7.645  -3.094  -0.222
   34    HA   ASN   4           HA       ASN   4  -6.085  -4.037   1.120
   35    HB2  ASN   4           HB3      ASN   4  -7.482  -6.052   0.676
   36    HB3  ASN   4           HB2      ASN   4  -6.404  -6.469  -0.651
   37   HD21  ASN   4          HD22      ASN   4  -6.769  -6.269   2.796
   38   HD22  ASN   4          HD21      ASN   4  -5.367  -7.195   3.201
   39    H    PHE   5           H        PHE   5  -4.854  -6.078  -1.412
   40    HA   PHE   5           HA       PHE   5  -2.261  -4.998  -0.868
   41    HB2  PHE   5           HB3      PHE   5  -1.543  -6.762  -2.552
   42    HB3  PHE   5           HB2      PHE   5  -2.317  -7.330  -1.082
   43    HD1  PHE   5           HD2      PHE   5  -2.821  -6.761  -4.685
   44    HD2  PHE   5           HD1      PHE   5  -4.388  -8.507  -1.142
   45    HE1  PHE   5           HE2      PHE   5  -4.468  -7.999  -6.028
   46    HE2  PHE   5           HE1      PHE   5  -6.039  -9.749  -2.474
   47    HZ   PHE   5           HZ       PHE   5  -6.120  -9.490  -4.876
   48    H    LEU   6           H        LEU   6  -0.865  -4.014  -2.251
   49    HA   LEU   6           HA       LEU   6  -0.296  -2.290  -3.615
   50    HB2  LEU   6           HB3      LEU   6  -2.168  -3.671  -5.539
   51    HB3  LEU   6           HB2      LEU   6  -1.072  -2.378  -5.971
   52    HG   LEU   6           HG       LEU   6   0.008  -4.294  -6.709
   53   HD11  LEU   6          HD11      LEU   6   1.127  -3.826  -3.953
   54   HD12  LEU   6          HD12      LEU   6   1.497  -2.882  -5.395
   55   HD13  LEU   6          HD13      LEU   6   1.965  -4.579  -5.309
   56   HD21  LEU   6          HD21      LEU   6  -1.536  -5.843  -5.538
   57   HD22  LEU   6          HD22      LEU   6  -0.538  -5.678  -4.091
   58   HD23  LEU   6          HD23      LEU   6   0.139  -6.372  -5.575
   59    H    CYS   7           H        CYS   7  -2.365  -1.730  -1.791
   60    HA   CYS   7           HA       CYS   7  -3.866   0.347  -3.156
   61    HB2  CYS   7           HB3      CYS   7  -5.299  -2.007  -1.906
   62    HB3  CYS   7           HB2      CYS   7  -6.083  -0.526  -2.434
   63    H    LYS   8           H        LYS   8  -3.903  -1.585  -0.193
   64    HA   LYS   8           HA       LYS   8  -3.141   0.843   1.284
   65    HB2  LYS   8           HB3      LYS   8  -5.434   0.384   1.942
   66    HB3  LYS   8           HB2      LYS   8  -5.066  -1.319   2.189
   67    HG2  LYS   8           HG3      LYS   8  -3.505  -0.652   4.010
   68    HG3  LYS   8           HG2      LYS   8  -4.061   1.009   3.814
   69    HD2  LYS   8           HD3      LYS   8  -5.943  -1.267   4.384
   70    HD3  LYS   8           HD2      LYS   8  -5.137  -0.364   5.665
   71    HE2  LYS   8           HE3      LYS   8  -6.128   1.713   4.786
   72    HE3  LYS   8           HE2      LYS   8  -6.977   0.767   3.563
   73    HZ1  LYS   8           HZ1      LYS   8  -8.400   1.263   5.453
   74    HZ2  LYS   8           HZ2      LYS   8  -7.322   0.490   6.503
   75    HZ3  LYS   8           HZ3      LYS   8  -8.142  -0.402   5.326
   76    H    LEU   9           H        LEU   9  -2.994  -2.531   0.716
   77    HA   LEU   9           HA       LEU   9  -0.629  -2.861   2.403
   78    HB2  LEU   9           HB3      LEU   9  -2.589  -4.879   1.302
   79    HB3  LEU   9           HB2      LEU   9  -1.100  -5.317   2.112
   80    HG   LEU   9           HG       LEU   9  -2.020  -4.010   4.126
   81   HD11  LEU   9          HD11      LEU   9  -4.466  -3.932   4.263
   82   HD12  LEU   9          HD12      LEU   9  -4.564  -4.409   2.568
   83   HD13  LEU   9          HD13      LEU   9  -3.838  -2.864   3.007
   84   HD21  LEU   9          HD21      LEU   9  -3.328  -6.569   3.228
   85   HD22  LEU   9          HD22      LEU   9  -3.276  -5.967   4.883
   86   HD23  LEU   9          HD23      LEU   9  -1.783  -6.425   4.066
   87    H    LYS  10           H        LYS  10  -0.100  -5.386   0.809
   88    HA   LYS  10           HA       LYS  10   2.105  -5.505   0.044
   89    HB2  LYS  10           HB3      LYS  10   0.469  -6.512  -1.518
   90    HB3  LYS  10           HB2      LYS  10   0.521  -5.030  -2.465
   91    HG2  LYS  10           HG3      LYS  10   2.780  -5.349  -3.045
   92    HG3  LYS  10           HG2      LYS  10   2.998  -6.597  -1.825
   93    HD2  LYS  10           HD3      LYS  10   1.431  -6.783  -4.381
   94    HD3  LYS  10           HD2      LYS  10   2.890  -7.666  -3.950
   95    HE2  LYS  10           HE3      LYS  10   1.591  -8.692  -2.063
   96    HE3  LYS  10           HE2      LYS  10   0.144  -7.949  -2.754
   97    HZ1  LYS  10           HZ1      LYS  10   1.914  -9.909  -4.116
   98    HZ2  LYS  10           HZ2      LYS  10   0.544  -9.189  -4.797
   99    HZ3  LYS  10           HZ3      LYS  10   0.383 -10.234  -3.480
  100    H    GLU  11           H        GLU  11   0.777  -3.030  -2.127
  101    HA   GLU  11           HA       GLU  11   1.305  -0.845  -2.385
  102    HB2  GLU  11           HB3      GLU  11   2.555  -1.349   0.020
  103    HB3  GLU  11           HB2      GLU  11   3.884  -0.807  -0.992
  104    HG2  GLU  11           HG3      GLU  11   1.318   0.688  -0.538
  105    HG3  GLU  11           HG2      GLU  11   2.850   1.003   0.276
  106    H    LYS  12           H        LYS  12   2.877   0.424  -3.584
  107    HA   LYS  12           HA       LYS  12   4.973  -1.029  -4.944
  108    HB2  LYS  12           HB3      LYS  12   4.083  -0.838  -7.158
  109    HB3  LYS  12           HB2      LYS  12   2.864  -1.617  -6.175
  110    HG2  LYS  12           HG3      LYS  12   2.828   1.314  -6.811
  111    HG3  LYS  12           HG2      LYS  12   2.086   0.099  -7.845
  112    HD2  LYS  12           HD3      LYS  12   0.738  -0.614  -5.822
  113    HD3  LYS  12           HD2      LYS  12   1.333   0.853  -5.021
  114    HE2  LYS  12           HE3      LYS  12   0.351   2.248  -6.670
  115    HE3  LYS  12           HE2      LYS  12   0.000   0.872  -7.709
  116    HZ1  LYS  12           HZ1      LYS  12  -1.626   0.104  -6.106
  117    HZ2  LYS  12           HZ2      LYS  12  -1.976   1.692  -6.570
  118    HZ3  LYS  12           HZ3      LYS  12  -1.261   1.391  -5.072
  119    H    LEU  13           H        LEU  13   2.986   1.906  -4.896
  120    HA   LEU  13           HA       LEU  13   4.845   3.820  -4.426
  121    HB2  LEU  13           HB3      LEU  13   5.845   2.813  -6.617
  122    HB3  LEU  13           HB2      LEU  13   4.556   3.683  -7.417
  123    HG   LEU  13           HG       LEU  13   6.609   5.026  -5.656
  124   HD11  LEU  13          HD11      LEU  13   7.728   3.967  -7.535
  125   HD12  LEU  13          HD12      LEU  13   7.704   5.718  -7.731
  126   HD13  LEU  13          HD13      LEU  13   6.587   4.713  -8.654
  127   HD21  LEU  13          HD21      LEU  13   4.714   6.135  -7.725
  128   HD22  LEU  13          HD22      LEU  13   5.884   7.059  -6.782
  129   HD23  LEU  13          HD23      LEU  13   4.522   6.276  -5.978
  130    H    ARG  14           H        ARG  14   3.493   5.376  -3.798
  131    HA   ARG  14           HA       ARG  14   1.693   6.651  -5.570
  132    HB2  ARG  14           HB3      ARG  14   0.360   4.594  -5.025
  133    HB3  ARG  14           HB2      ARG  14   0.370   5.093  -3.339
  134    HG2  ARG  14           HG3      ARG  14  -1.725   5.693  -4.402
  135    HG3  ARG  14           HG2      ARG  14  -0.828   7.142  -3.942
  136    HD2  ARG  14           HD3      ARG  14  -0.038   7.391  -6.237
  137    HD3  ARG  14           HD2      ARG  14  -0.899   5.927  -6.701
  138    HE   ARG  14           HE       ARG  14  -2.737   7.701  -5.567
  139   HH11  ARG  14          HH11      ARG  14  -0.709   7.434  -8.407
  140   HH12  ARG  14          HH12      ARG  14  -1.761   8.384  -9.404
  141   HH21  ARG  14          HH22      ARG  14  -4.110   8.980  -6.874
  142   HH22  ARG  14          HH21      ARG  14  -3.691   9.264  -8.532
  143    H    THR  15           H        THR  15   2.383   5.937  -2.170
  144    HA   THR  15           HA       THR  15   3.049   7.299  -0.472
  145    HB   THR  15           HB       THR  15   3.016   9.538  -2.491
  146    HG1  THR  15           HG1      THR  15   5.426   8.415  -1.689
  147   HG21  THR  15          HG21      THR  15   4.620  10.612  -0.951
  148   HG22  THR  15          HG22      THR  15   4.402   9.276   0.179
  149   HG23  THR  15          HG23      THR  15   3.051  10.347  -0.191
  150    H    VAL  16           H        VAL  16   0.959   6.824   0.360
  151    HA   VAL  16           HA       VAL  16  -0.379   8.897   1.500
  152    HB   VAL  16           HB       VAL  16  -1.036   9.355  -0.940
  153   HG11  VAL  16          HG11      VAL  16  -2.828   6.988  -0.503
  154   HG12  VAL  16          HG12      VAL  16  -1.517   7.123  -1.674
  155   HG13  VAL  16          HG13      VAL  16  -2.953   8.134  -1.838
  156   HG21  VAL  16          HG21      VAL  16  -3.339  10.017  -0.366
  157   HG22  VAL  16          HG22      VAL  16  -2.152  10.483   0.852
  158   HG23  VAL  16          HG23      VAL  16  -3.205   9.102   1.131
  159    H    ILE  17           H        ILE  17  -3.101   7.606   1.420
  160    HA   ILE  17           HA       ILE  17  -2.772   5.646   3.369
  161    HB   ILE  17           HB       ILE  17  -4.879   6.869   2.967
  162   HG12  ILE  17          HG13      ILE  17  -4.667   4.457   4.058
  163   HG13  ILE  17          HG12      ILE  17  -6.227   5.235   3.850
  164   HG21  ILE  17          HG21      ILE  17  -4.935   6.843   0.560
  165   HG22  ILE  17          HG22      ILE  17  -6.420   6.141   1.203
  166   HG23  ILE  17          HG23      ILE  17  -5.159   5.094   0.553
  167   HD11  ILE  17          HD11      ILE  17  -6.480   2.987   3.194
  168   HD12  ILE  17          HD12      ILE  17  -5.031   3.026   2.193
  169   HD13  ILE  17          HD13      ILE  17  -6.461   3.936   1.711
  170    H    THR  18           H        THR  18  -2.799   5.405  -0.115
  171    HA   THR  18           HA       THR  18  -2.896   2.660  -0.486
  172    HB   THR  18           HB       THR  18  -1.104   4.591  -1.990
  173    HG1  THR  18           HG1      THR  18  -3.743   3.882  -2.770
  174   HG21  THR  18          HG21      THR  18  -2.436   2.009  -2.842
  175   HG22  THR  18          HG22      THR  18  -0.722   2.219  -2.486
  176   HG23  THR  18          HG23      THR  18  -1.444   3.049  -3.864
  177    H    SER  19           H        SER  19   0.020   4.658  -0.381
  178    HA   SER  19           HA       SER  19   1.719   2.496   0.312
  179    HB2  SER  19           HB3      SER  19   2.224   5.468   0.434
  180    HB3  SER  19           HB2      SER  19   3.448   4.199   0.411
  181    HG   SER  19           HG       SER  19   2.817   3.645  -1.666
  182    H    HIS  20           H        HIS  20  -0.158   2.329   2.249
  183    HA   HIS  20           HA       HIS  20   1.084   3.590   4.600
  184    HB2  HIS  20           HB3      HIS  20  -1.413   3.848   4.234
  185    HB3  HIS  20           HB2      HIS  20  -1.552   2.121   4.559
  186    HD1  HIS  20           HD1      HIS  20  -1.870   1.503   6.955
  187    HD2  HIS  20           HD2      HIS  20  -0.174   5.271   6.523
  188    HE1  HIS  20           HE1      HIS  20  -1.664   2.424   9.284
  189    HE2  HIS  20           HE2      HIS  20  -0.738   4.747   8.987
  190    H    ILE  21           H        ILE  21  -0.348   0.457   3.674
  191    HA   ILE  21           HA       ILE  21   1.513  -0.864   5.531
  192    HB   ILE  21           HB       ILE  21  -0.928  -2.033   4.176
  193   HG12  ILE  21          HG13      ILE  21  -0.593  -1.057   7.019
  194   HG13  ILE  21          HG12      ILE  21  -1.583  -0.300   5.776
  195   HG21  ILE  21          HG21      ILE  21  -0.656  -3.870   5.778
  196   HG22  ILE  21          HG22      ILE  21   0.811  -3.109   6.392
  197   HG23  ILE  21          HG23      ILE  21   0.754  -3.698   4.732
  198   HD11  ILE  21          HD11      ILE  21  -3.023  -2.249   5.707
  199   HD12  ILE  21          HD12      ILE  21  -2.919  -1.608   7.345
  200   HD13  ILE  21          HD13      ILE  21  -2.014  -3.055   6.906
  201    H    ASP  22           H        ASP  22   2.854  -2.510   4.759
  202    HA   ASP  22           HA       ASP  22   3.072  -2.614   1.822
  203    HB2  ASP  22           HB3      ASP  22   4.864  -1.289   3.038
  204    HB3  ASP  22           HB2      ASP  22   5.361  -2.785   3.801
  205    H    LYS  23           H        LYS  23   3.951  -4.587   0.957
  206    HA   LYS  23           HA       LYS  23   3.144  -6.970   2.207
  207    HB2  LYS  23           HB3      LYS  23   4.794  -8.014   0.478
  208    HB3  LYS  23           HB2      LYS  23   3.342  -7.204  -0.077
  209    HG2  LYS  23           HG3      LYS  23   5.030  -6.463  -1.508
  210    HG3  LYS  23           HG2      LYS  23   4.801  -5.135  -0.372
  211    HD2  LYS  23           HD3      LYS  23   6.723  -6.081   0.946
  212    HD3  LYS  23           HD2      LYS  23   7.006  -7.179  -0.405
  213    HE2  LYS  23           HE3      LYS  23   7.184  -5.166  -1.886
  214    HE3  LYS  23           HE2      LYS  23   7.122  -4.163  -0.427
  215    HZ1  LYS  23           HZ1      LYS  23   9.164  -6.253  -0.981
  216    HZ2  LYS  23           HZ2      LYS  23   9.119  -5.226   0.363
  217    HZ3  LYS  23           HZ3      LYS  23   9.395  -4.591  -1.178
  218    H    VAL  24           H        VAL  24   6.049  -5.099   2.494
  219    HA   VAL  24           HA       VAL  24   6.922  -6.955   4.595
  220    HB   VAL  24           HB       VAL  24   8.804  -5.752   2.548
  221   HG11  VAL  24          HG11      VAL  24   9.396  -7.356   5.033
  222   HG12  VAL  24          HG12      VAL  24   9.803  -5.663   4.754
  223   HG13  VAL  24          HG13      VAL  24  10.579  -6.926   3.798
  224   HG21  VAL  24          HG21      VAL  24   8.160  -8.631   3.176
  225   HG22  VAL  24          HG22      VAL  24   9.374  -8.075   2.025
  226   HG23  VAL  24          HG23      VAL  24   7.666  -7.749   1.730
  227    H    LEU  25           H        LEU  25   8.411  -4.018   3.253
  228    HA   LEU  25           HA       LEU  25   7.221  -2.169   4.950
  229    HB2  LEU  25           HB3      LEU  25   8.702  -3.735   6.527
  230    HB3  LEU  25           HB2      LEU  25   9.968  -2.645   6.001
  231    HG   LEU  25           HG       LEU  25   9.011  -1.981   8.163
  232   HD11  LEU  25          HD11      LEU  25   8.390  -0.044   5.943
  233   HD12  LEU  25          HD12      LEU  25   9.945  -0.245   6.753
  234   HD13  LEU  25          HD13      LEU  25   8.554   0.365   7.650
  235   HD21  LEU  25          HD21      LEU  25   6.744  -2.836   7.798
  236   HD22  LEU  25          HD22      LEU  25   6.450  -1.540   6.639
  237   HD23  LEU  25          HD23      LEU  25   6.743  -1.158   8.335
  238    H    ARG  26           H        ARG  26   7.609  -1.622   2.456
  239    HA   ARG  26           HA       ARG  26   9.493   0.560   2.833
  240    HB2  ARG  26           HB3      ARG  26  10.845   0.199   1.056
  241    HB3  ARG  26           HB2      ARG  26  10.412  -1.462   1.374
  242    HG2  ARG  26           HG3      ARG  26   9.245   0.302  -0.769
  243    HG3  ARG  26           HG2      ARG  26  10.434  -0.974  -0.997
  244    HD2  ARG  26           HD3      ARG  26   8.742  -2.598  -0.145
  245    HD3  ARG  26           HD2      ARG  26   7.564  -1.281  -0.136
  246    HE   ARG  26           HE       ARG  26   8.961  -1.815  -2.641
  247   HH11  ARG  26          HH11      ARG  26   6.013  -2.081  -0.748
  248   HH12  ARG  26          HH12      ARG  26   5.027  -2.441  -2.140
  249   HH21  ARG  26          HH22      ARG  26   7.659  -2.269  -4.448
  250   HH22  ARG  26          HH21      ARG  26   5.961  -2.560  -4.231
  251    HA   PRO  27           HA       PRO  27   5.302   1.513   0.829
  252    HB2  PRO  27           HB2      PRO  27   4.041   2.752   2.888
  253    HB3  PRO  27           HB3      PRO  27   3.959   0.996   2.635
  254    HG2  PRO  27           HG3      PRO  27   5.647   2.565   4.540
  255    HG3  PRO  27           HG2      PRO  27   4.797   1.030   4.794
  256    HD2  PRO  27           HD3      PRO  27   7.475   1.211   4.280
  257    HD3  PRO  27           HD2      PRO  27   6.488  -0.200   3.858
  258    H    GLN  28           H        GLN  28   4.992   3.472  -0.160
  259    HA   GLN  28           HA       GLN  28   7.139   5.336   0.131
  260    HB2  GLN  28           HB3      GLN  28   4.674   5.529  -1.592
  261    HB3  GLN  28           HB2      GLN  28   6.124   6.506  -1.752
  262    HG2  GLN  28           HG3      GLN  28   5.905   3.538  -2.183
  263    HG3  GLN  28           HG2      GLN  28   6.086   4.782  -3.417
  264   HE21  GLN  28          HE22      GLN  28   7.683   2.925  -0.961
  265   HE22  GLN  28          HE21      GLN  28   9.294   3.390  -1.377
  266    H    GLY  29           H        GLY  29   4.279   5.137   1.851
  267    HA2  GLY  29           HA3      GLY  29   4.277   8.063   2.273
  268    HA3  GLY  29           HA2      GLY  29   2.798   7.107   2.302
  Start of MODEL   18
    1    H1   ARG   1           H1       ARG   1  -9.451   3.255   3.649
    2    H2   ARG   1           H2       ARG   1 -10.736   3.256   4.746
    3    H3   ARG   1           H3       ARG   1 -10.912   3.994   3.237
    4    HA   ARG   1           HA       ARG   1 -10.455   1.109   3.679
    5    HB2  ARG   1           HB3      ARG   1 -12.822   0.891   2.877
    6    HB3  ARG   1           HB2      ARG   1 -12.650   1.630   4.461
    7    HG2  ARG   1           HG3      ARG   1 -12.815   3.866   3.276
    8    HG3  ARG   1           HG2      ARG   1 -13.336   2.953   1.859
    9    HD2  ARG   1           HD3      ARG   1 -15.254   3.752   3.118
   10    HD3  ARG   1           HD2      ARG   1 -15.170   1.993   3.160
   11    HE   ARG   1           HE       ARG   1 -14.021   3.499   5.389
   12   HH11  ARG   1          HH12      ARG   1 -16.542   1.408   4.169
   13   HH12  ARG   1          HH11      ARG   1 -17.140   0.998   5.743
   14   HH21  ARG   1          HH21      ARG   1 -14.800   2.967   7.463
   15   HH22  ARG   1          HH22      ARG   1 -16.150   1.891   7.619
   16    H    LYS   2           H        LYS   2  -9.875   0.007   1.934
   17    HA   LYS   2           HA       LYS   2 -10.156   1.159  -0.727
   18    HB2  LYS   2           HB3      LYS   2  -7.514   0.530   0.594
   19    HB3  LYS   2           HB2      LYS   2  -7.694   0.678  -1.145
   20    HG2  LYS   2           HG3      LYS   2  -8.369   2.860   0.805
   21    HG3  LYS   2           HG2      LYS   2  -6.816   2.702  -0.015
   22    HD2  LYS   2           HD3      LYS   2  -7.994   2.836  -2.187
   23    HD3  LYS   2           HD2      LYS   2  -9.511   3.083  -1.323
   24    HE2  LYS   2           HE3      LYS   2  -8.565   5.115  -0.300
   25    HE3  LYS   2           HE2      LYS   2  -7.090   4.878  -1.235
   26    HZ1  LYS   2           HZ1      LYS   2  -8.535   6.471  -2.305
   27    HZ2  LYS   2           HZ2      LYS   2  -9.800   5.349  -2.353
   28    HZ3  LYS   2           HZ3      LYS   2  -8.402   5.086  -3.263
   29    H    CYS   3           H        CYS   3  -8.300  -0.634  -1.921
   30    HA   CYS   3           HA       CYS   3  -9.820  -3.053  -2.012
   31    HB2  CYS   3           HB3      CYS   3  -7.153  -3.135  -3.212
   32    HB3  CYS   3           HB2      CYS   3  -8.728  -3.370  -3.963
   33    H    ASN   4           H        ASN   4  -7.801  -4.979  -2.319
   34    HA   ASN   4           HA       ASN   4  -7.018  -5.347   0.467
   35    HB2  ASN   4           HB3      ASN   4  -8.229  -7.181  -0.649
   36    HB3  ASN   4           HB2      ASN   4  -6.950  -7.296  -1.851
   37   HD21  ASN   4          HD22      ASN   4  -6.516  -9.430  -1.330
   38   HD22  ASN   4          HD21      ASN   4  -5.703  -9.876   0.127
   39    H    PHE   5           H        PHE   5  -5.369  -6.462  -2.470
   40    HA   PHE   5           HA       PHE   5  -2.866  -5.635  -1.212
   41    HB2  PHE   5           HB3      PHE   5  -1.850  -7.091  -3.044
   42    HB3  PHE   5           HB2      PHE   5  -2.752  -7.899  -1.775
   43    HD1  PHE   5           HD2      PHE   5  -2.923  -6.742  -5.279
   44    HD2  PHE   5           HD1      PHE   5  -4.656  -9.207  -2.278
   45    HE1  PHE   5           HE2      PHE   5  -4.329  -7.821  -6.981
   46    HE2  PHE   5           HE1      PHE   5  -6.066 -10.290  -3.974
   47    HZ   PHE   5           HZ       PHE   5  -5.908  -9.610  -6.320
   48    H    LEU   6           H        LEU   6  -1.195  -4.690  -2.469
   49    HA   LEU   6           HA       LEU   6  -0.450  -2.815  -3.516
   50    HB2  LEU   6           HB3      LEU   6  -2.102  -4.017  -5.743
   51    HB3  LEU   6           HB2      LEU   6  -0.988  -2.685  -5.960
   52    HG   LEU   6           HG       LEU   6   0.234  -4.494  -6.707
   53   HD11  LEU   6          HD11      LEU   6   0.946  -4.283  -3.787
   54   HD12  LEU   6          HD12      LEU   6   1.547  -3.270  -5.100
   55   HD13  LEU   6          HD13      LEU   6   1.958  -4.983  -5.050
   56   HD21  LEU   6          HD21      LEU   6  -1.256  -6.268  -6.143
   57   HD22  LEU   6          HD22      LEU   6  -0.887  -6.098  -4.428
   58   HD23  LEU   6          HD23      LEU   6   0.351  -6.671  -5.542
   59    H    CYS   7           H        CYS   7  -2.420  -2.131  -1.840
   60    HA   CYS   7           HA       CYS   7  -3.682   0.096  -3.117
   61    HB2  CYS   7           HB3      CYS   7  -5.142  -1.875  -3.758
   62    HB3  CYS   7           HB2      CYS   7  -5.557  -2.025  -2.055
   63    H    LYS   8           H        LYS   8  -2.874  -1.769  -0.378
   64    HA   LYS   8           HA       LYS   8  -2.643   0.402   1.343
   65    HB2  LYS   8           HB3      LYS   8  -5.076   0.479   1.394
   66    HB3  LYS   8           HB2      LYS   8  -5.154  -1.234   1.773
   67    HG2  LYS   8           HG3      LYS   8  -4.379  -0.904   3.957
   68    HG3  LYS   8           HG2      LYS   8  -3.782   0.714   3.593
   69    HD2  LYS   8           HD3      LYS   8  -5.825   0.805   4.924
   70    HD3  LYS   8           HD2      LYS   8  -6.075   1.506   3.330
   71    HE2  LYS   8           HE3      LYS   8  -7.981   0.175   3.878
   72    HE3  LYS   8           HE2      LYS   8  -7.081  -0.642   2.601
   73    HZ1  LYS   8           HZ1      LYS   8  -7.804  -2.185   4.314
   74    HZ2  LYS   8           HZ2      LYS   8  -6.976  -1.309   5.497
   75    HZ3  LYS   8           HZ3      LYS   8  -6.119  -2.102   4.278
   76    H    LEU   9           H        LEU   9  -2.819  -2.953   0.737
   77    HA   LEU   9           HA       LEU   9  -1.690  -3.629   3.339
   78    HB2  LEU   9           HB3      LEU   9  -3.278  -5.151   1.340
   79    HB3  LEU   9           HB2      LEU   9  -2.244  -6.022   2.464
   80    HG   LEU   9           HG       LEU   9  -3.469  -4.760   4.324
   81   HD11  LEU   9          HD11      LEU   9  -5.439  -4.298   2.096
   82   HD12  LEU   9          HD12      LEU   9  -4.502  -3.054   2.925
   83   HD13  LEU   9          HD13      LEU   9  -5.708  -3.985   3.810
   84   HD21  LEU   9          HD21      LEU   9  -4.960  -6.761   2.638
   85   HD22  LEU   9          HD22      LEU   9  -5.324  -6.357   4.317
   86   HD23  LEU   9          HD23      LEU   9  -3.788  -7.123   3.908
   87    H    LYS  10           H        LYS  10  -1.323  -4.853  -0.024
   88    HA   LYS  10           HA       LYS  10   1.288  -5.824   0.603
   89    HB2  LYS  10           HB3      LYS  10  -0.148  -6.933  -1.053
   90    HB3  LYS  10           HB2      LYS  10  -0.017  -5.531  -2.097
   91    HG2  LYS  10           HG3      LYS  10   2.209  -5.913  -2.573
   92    HG3  LYS  10           HG2      LYS  10   2.418  -6.955  -1.172
   93    HD2  LYS  10           HD3      LYS  10   0.827  -7.599  -3.653
   94    HD3  LYS  10           HD2      LYS  10   2.408  -8.257  -3.235
   95    HE2  LYS  10           HE3      LYS  10   1.298  -9.119  -1.105
   96    HE3  LYS  10           HE2      LYS  10  -0.235  -8.739  -1.892
   97    HZ1  LYS  10           HZ1      LYS  10   1.838 -10.599  -2.918
   98    HZ2  LYS  10           HZ2      LYS  10   0.400 -10.210  -3.716
   99    HZ3  LYS  10           HZ3      LYS  10   0.350 -11.038  -2.244
  100    H    GLU  11           H        GLU  11   0.053  -2.903  -0.732
  101    HA   GLU  11           HA       GLU  11   0.992  -0.848  -0.950
  102    HB2  GLU  11           HB3      GLU  11   2.436  -1.422   0.957
  103    HB3  GLU  11           HB2      GLU  11   3.571  -2.205  -0.127
  104    HG2  GLU  11           HG3      GLU  11   2.912   0.668  -0.534
  105    HG3  GLU  11           HG2      GLU  11   3.997   0.207   0.770
  106    H    LYS  12           H        LYS  12   1.868   0.345  -2.625
  107    HA   LYS  12           HA       LYS  12   3.089  -1.183  -4.823
  108    HB2  LYS  12           HB3      LYS  12   1.537  -0.089  -6.393
  109    HB3  LYS  12           HB2      LYS  12   0.682  -1.078  -5.212
  110    HG2  LYS  12           HG3      LYS  12   0.382   1.060  -3.872
  111    HG3  LYS  12           HG2      LYS  12   0.911   1.910  -5.322
  112    HD2  LYS  12           HD3      LYS  12  -1.426   0.016  -5.185
  113    HD3  LYS  12           HD2      LYS  12  -1.538   1.775  -5.098
  114    HE2  LYS  12           HE3      LYS  12  -0.630   1.979  -7.329
  115    HE3  LYS  12           HE2      LYS  12  -0.360   0.239  -7.411
  116    HZ1  LYS  12           HZ1      LYS  12  -2.364   0.888  -8.595
  117    HZ2  LYS  12           HZ2      LYS  12  -3.011   1.557  -7.182
  118    HZ3  LYS  12           HZ3      LYS  12  -2.742  -0.108  -7.285
  119    H    LEU  13           H        LEU  13   3.986   0.979  -2.848
  120    HA   LEU  13           HA       LEU  13   4.961   3.020  -2.728
  121    HB2  LEU  13           HB3      LEU  13   5.911   1.912  -5.325
  122    HB3  LEU  13           HB2      LEU  13   6.320   3.566  -4.921
  123    HG   LEU  13           HG       LEU  13   7.021   1.135  -3.268
  124   HD11  LEU  13          HD11      LEU  13   8.281   1.282  -5.365
  125   HD12  LEU  13          HD12      LEU  13   9.306   1.577  -3.962
  126   HD13  LEU  13          HD13      LEU  13   8.762   2.928  -4.956
  127   HD21  LEU  13          HD21      LEU  13   8.397   2.716  -1.978
  128   HD22  LEU  13          HD22      LEU  13   6.679   3.090  -1.869
  129   HD23  LEU  13          HD23      LEU  13   7.725   4.048  -2.916
  130    H    ARG  14           H        ARG  14   2.497   3.610  -2.963
  131    HA   ARG  14           HA       ARG  14   2.023   5.195  -5.350
  132    HB2  ARG  14           HB3      ARG  14   0.234   3.733  -4.381
  133    HB3  ARG  14           HB2      ARG  14   0.186   4.805  -2.989
  134    HG2  ARG  14           HG3      ARG  14  -1.604   5.298  -4.574
  135    HG3  ARG  14           HG2      ARG  14  -0.492   6.658  -4.406
  136    HD2  ARG  14           HD3      ARG  14   0.624   6.021  -6.471
  137    HD3  ARG  14           HD2      ARG  14  -0.430   4.620  -6.630
  138    HE   ARG  14           HE       ARG  14  -2.236   6.540  -6.613
  139   HH11  ARG  14          HH11      ARG  14   0.864   6.455  -8.244
  140   HH12  ARG  14          HH12      ARG  14   0.349   7.469  -9.555
  141   HH21  ARG  14          HH22      ARG  14  -2.923   7.868  -8.349
  142   HH22  ARG  14          HH21      ARG  14  -1.808   8.259  -9.621
  143    H    THR  15           H        THR  15   1.274   5.974  -1.940
  144    HA   THR  15           HA       THR  15   2.957   8.303  -2.022
  145    HB   THR  15           HB       THR  15   0.018   8.822  -1.625
  146    HG1  THR  15           HG1      THR  15   1.507   8.692  -4.023
  147   HG21  THR  15          HG21      THR  15   2.255  10.669  -2.435
  148   HG22  THR  15          HG22      THR  15   1.757  10.402  -0.765
  149   HG23  THR  15          HG23      THR  15   0.627  11.112  -1.916
  150    H    VAL  16           H        VAL  16   0.138   6.878  -0.297
  151    HA   VAL  16           HA       VAL  16   1.507   7.207   2.242
  152    HB   VAL  16           HB       VAL  16  -1.103   8.664   1.763
  153   HG11  VAL  16          HG11      VAL  16  -0.996   7.695   3.990
  154   HG12  VAL  16          HG12      VAL  16  -0.853   9.451   4.067
  155   HG13  VAL  16          HG13      VAL  16   0.580   8.441   4.254
  156   HG21  VAL  16          HG21      VAL  16   1.638   9.768   2.351
  157   HG22  VAL  16          HG22      VAL  16   0.149  10.704   2.222
  158   HG23  VAL  16          HG23      VAL  16   0.789   9.867   0.810
  159    H    ILE  17           H        ILE  17  -1.943   6.888   1.299
  160    HA   ILE  17           HA       ILE  17  -2.253   4.853   3.324
  161    HB   ILE  17           HB       ILE  17  -3.982   6.565   3.036
  162   HG12  ILE  17          HG13      ILE  17  -4.493   4.178   3.849
  163   HG13  ILE  17          HG12      ILE  17  -5.848   5.201   3.397
  164   HG21  ILE  17          HG21      ILE  17  -4.491   5.302   0.352
  165   HG22  ILE  17          HG22      ILE  17  -3.862   6.920   0.656
  166   HG23  ILE  17          HG23      ILE  17  -5.513   6.517   1.121
  167   HD11  ILE  17          HD11      ILE  17  -6.390   3.162   2.462
  168   HD12  ILE  17          HD12      ILE  17  -4.724   2.808   1.976
  169   HD13  ILE  17          HD13      ILE  17  -5.670   4.025   1.106
  170    H    THR  18           H        THR  18  -2.409   5.013  -0.204
  171    HA   THR  18           HA       THR  18  -3.044   2.289  -0.608
  172    HB   THR  18           HB       THR  18  -1.422   3.816  -2.598
  173    HG1  THR  18           HG1      THR  18  -4.058   4.475  -2.749
  174   HG21  THR  18          HG21      THR  18  -2.306   1.627  -3.191
  175   HG22  THR  18          HG22      THR  18  -3.084   2.889  -4.142
  176   HG23  THR  18          HG23      THR  18  -3.938   2.162  -2.785
  177    H    SER  19           H        SER  19  -0.352   3.875   0.515
  178    HA   SER  19           HA       SER  19   1.358   1.529   0.131
  179    HB2  SER  19           HB3      SER  19   3.253   3.000  -0.017
  180    HB3  SER  19           HB2      SER  19   2.022   3.656  -1.098
  181    HG   SER  19           HG       SER  19   2.480   4.531   1.557
  182    H    HIS  20           H        HIS  20  -0.553   1.962   2.272
  183    HA   HIS  20           HA       HIS  20   0.803   3.037   4.554
  184    HB2  HIS  20           HB3      HIS  20  -1.651   3.114   4.362
  185    HB3  HIS  20           HB2      HIS  20  -1.710   1.357   4.418
  186    HD1  HIS  20           HD1      HIS  20  -2.778   0.854   6.612
  187    HD2  HIS  20           HD2      HIS  20   0.185   3.753   6.946
  188    HE1  HIS  20           HE1      HIS  20  -2.554   1.316   9.071
  189    HE2  HIS  20           HE2      HIS  20  -0.724   3.034   9.259
  190    H    ILE  21           H        ILE  21  -0.576  -0.219   4.225
  191    HA   ILE  21           HA       ILE  21   1.593  -1.302   5.827
  192    HB   ILE  21           HB       ILE  21  -0.709  -2.790   4.560
  193   HG12  ILE  21          HG13      ILE  21  -0.547  -1.693   7.370
  194   HG13  ILE  21          HG12      ILE  21  -1.472  -0.951   6.068
  195   HG21  ILE  21          HG21      ILE  21   1.114  -3.492   6.856
  196   HG22  ILE  21          HG22      ILE  21   1.129  -4.222   5.249
  197   HG23  ILE  21          HG23      ILE  21  -0.259  -4.456   6.311
  198   HD11  ILE  21          HD11      ILE  21  -1.920  -3.705   7.187
  199   HD12  ILE  21          HD12      ILE  21  -2.863  -2.936   5.911
  200   HD13  ILE  21          HD13      ILE  21  -2.881  -2.272   7.546
  201    H    ASP  22           H        ASP  22   2.876  -3.114   4.985
  202    HA   ASP  22           HA       ASP  22   3.219  -2.999   2.076
  203    HB2  ASP  22           HB3      ASP  22   4.547  -1.186   3.235
  204    HB3  ASP  22           HB2      ASP  22   5.447  -2.437   4.052
  205    H    LYS  23           H        LYS  23   4.306  -4.776   1.214
  206    HA   LYS  23           HA       LYS  23   4.344  -7.150   2.814
  207    HB2  LYS  23           HB3      LYS  23   5.524  -8.027   0.588
  208    HB3  LYS  23           HB2      LYS  23   3.789  -7.799   0.718
  209    HG2  LYS  23           HG3      LYS  23   4.641  -6.941  -1.385
  210    HG3  LYS  23           HG2      LYS  23   3.966  -5.648  -0.400
  211    HD2  LYS  23           HD3      LYS  23   6.645  -5.690   0.301
  212    HD3  LYS  23           HD2      LYS  23   6.653  -5.989  -1.440
  213    HE2  LYS  23           HE3      LYS  23   5.139  -3.748  -0.117
  214    HE3  LYS  23           HE2      LYS  23   6.755  -3.558  -0.780
  215    HZ1  LYS  23           HZ1      LYS  23   4.324  -4.340  -2.300
  216    HZ2  LYS  23           HZ2      LYS  23   5.870  -4.141  -2.956
  217    HZ3  LYS  23           HZ3      LYS  23   5.048  -2.809  -2.306
  218    H    VAL  24           H        VAL  24   6.648  -4.709   2.452
  219    HA   VAL  24           HA       VAL  24   8.690  -6.460   3.614
  220    HB   VAL  24           HB       VAL  24   9.008  -6.618   1.139
  221   HG11  VAL  24          HG11      VAL  24   9.750  -3.708   1.371
  222   HG12  VAL  24          HG12      VAL  24   8.350  -4.361   0.522
  223   HG13  VAL  24          HG13      VAL  24   9.978  -4.720  -0.055
  224   HG21  VAL  24          HG21      VAL  24  10.853  -7.066   2.637
  225   HG22  VAL  24          HG22      VAL  24  11.250  -5.349   2.704
  226   HG23  VAL  24          HG23      VAL  24  11.437  -6.239   1.193
  227    H    LEU  25           H        LEU  25   7.266  -3.467   3.128
  228    HA   LEU  25           HA       LEU  25   7.300  -1.564   4.344
  229    HB2  LEU  25           HB3      LEU  25   8.160  -2.910   6.260
  230    HB3  LEU  25           HB2      LEU  25   9.791  -2.574   5.714
  231    HG   LEU  25           HG       LEU  25   9.394  -0.158   6.065
  232   HD11  LEU  25          HD11      LEU  25   6.996  -0.091   5.748
  233   HD12  LEU  25          HD12      LEU  25   7.409   0.536   7.344
  234   HD13  LEU  25          HD13      LEU  25   6.754  -1.092   7.179
  235   HD21  LEU  25          HD21      LEU  25   8.832  -1.887   8.469
  236   HD22  LEU  25          HD22      LEU  25   9.428  -0.230   8.504
  237   HD23  LEU  25          HD23      LEU  25  10.425  -1.510   7.817
  238    H    ARG  26           H        ARG  26   7.837  -1.107   1.990
  239    HA   ARG  26           HA       ARG  26  10.406   0.372   1.890
  240    HB2  ARG  26           HB3      ARG  26  10.412   0.001  -0.474
  241    HB3  ARG  26           HB2      ARG  26  10.049  -1.552   0.279
  242    HG2  ARG  26           HG3      ARG  26   7.564  -0.658   0.000
  243    HG3  ARG  26           HG2      ARG  26   8.313   0.234  -1.321
  244    HD2  ARG  26           HD3      ARG  26   8.817  -2.685  -1.053
  245    HD3  ARG  26           HD2      ARG  26   7.277  -2.119  -1.690
  246    HE   ARG  26           HE       ARG  26   9.905  -1.778  -2.928
  247   HH11  ARG  26          HH11      ARG  26   6.446  -1.220  -3.010
  248   HH12  ARG  26          HH12      ARG  26   6.390  -1.068  -4.741
  249   HH21  ARG  26          HH22      ARG  26   9.845  -1.540  -5.199
  250   HH22  ARG  26          HH21      ARG  26   8.332  -1.233  -5.987
  251    HA   PRO  27           HA       PRO  27   6.324   2.510   0.277
  252    HB2  PRO  27           HB2      PRO  27   4.946   3.639   2.310
  253    HB3  PRO  27           HB3      PRO  27   4.702   1.959   1.798
  254    HG2  PRO  27           HG3      PRO  27   6.277   3.033   4.101
  255    HG3  PRO  27           HG2      PRO  27   5.212   1.617   4.032
  256    HD2  PRO  27           HD3      PRO  27   7.932   1.467   3.883
  257    HD3  PRO  27           HD2      PRO  27   6.843   0.282   3.135
  258    H    GLN  28           H        GLN  28   5.800   4.783  -0.022
  259    HA   GLN  28           HA       GLN  28   8.041   6.489   0.786
  260    HB2  GLN  28           HB3      GLN  28   7.378   7.931  -1.109
  261    HB3  GLN  28           HB2      GLN  28   7.766   6.292  -1.608
  262    HG2  GLN  28           HG3      GLN  28   5.417   5.761  -1.816
  263    HG3  GLN  28           HG2      GLN  28   4.975   7.358  -1.213
  264   HE21  GLN  28          HE22      GLN  28   5.280   9.162  -2.540
  265   HE22  GLN  28          HE21      GLN  28   5.507   9.007  -4.247
  266    H    GLY  29           H        GLY  29   5.754   5.919   2.518
  267    HA2  GLY  29           HA3      GLY  29   4.242   8.414   2.549
  268    HA3  GLY  29           HA2      GLY  29   3.963   7.013   3.576
  Start of MODEL   19
    1    H1   ARG   1           H1       ARG   1  -8.490   5.383   1.359
    2    H2   ARG   1           H2       ARG   1  -8.908   6.368   0.055
    3    H3   ARG   1           H3       ARG   1  -7.452   5.515   0.031
    4    HA   ARG   1           HA       ARG   1 -10.157   4.317   0.013
    5    HB2  ARG   1           HB3      ARG   1  -9.343   5.523  -2.087
    6    HB3  ARG   1           HB2      ARG   1  -8.094   4.292  -2.190
    7    HG2  ARG   1           HG3      ARG   1  -9.757   3.542  -3.629
    8    HG3  ARG   1           HG2      ARG   1 -10.012   2.602  -2.159
    9    HD2  ARG   1           HD3      ARG   1 -11.506   5.140  -2.782
   10    HD3  ARG   1           HD2      ARG   1 -12.089   3.545  -3.240
   11    HE   ARG   1           HE       ARG   1 -11.834   3.136  -0.680
   12   HH11  ARG   1          HH12      ARG   1 -12.958   6.064  -2.238
   13   HH12  ARG   1          HH11      ARG   1 -14.028   6.497  -0.942
   14   HH21  ARG   1          HH21      ARG   1 -13.241   3.703   1.030
   15   HH22  ARG   1          HH22      ARG   1 -14.199   5.145   0.915
   16    H    LYS   2           H        LYS   2  -9.666   2.834   1.659
   17    HA   LYS   2           HA       LYS   2  -7.365   1.073   1.302
   18    HB2  LYS   2           HB3      LYS   2  -9.557   0.921   3.386
   19    HB3  LYS   2           HB2      LYS   2  -8.077  -0.017   3.367
   20    HG2  LYS   2           HG3      LYS   2  -7.700   1.609   4.973
   21    HG3  LYS   2           HG2      LYS   2  -6.865   2.223   3.555
   22    HD2  LYS   2           HD3      LYS   2  -8.085   3.998   4.685
   23    HD3  LYS   2           HD2      LYS   2  -8.755   3.702   3.082
   24    HE2  LYS   2           HE3      LYS   2 -10.496   4.028   4.793
   25    HE3  LYS   2           HE2      LYS   2 -10.583   2.443   4.034
   26    HZ1  LYS   2           HZ1      LYS   2 -10.882   2.351   6.443
   27    HZ2  LYS   2           HZ2      LYS   2  -9.336   2.993   6.673
   28    HZ3  LYS   2           HZ3      LYS   2  -9.526   1.474   5.954
   29    H    CYS   3           H        CYS   3  -7.507  -1.003   0.518
   30    HA   CYS   3           HA       CYS   3 -10.158  -2.139   0.227
   31    HB2  CYS   3           HB3      CYS   3  -9.808  -2.743  -2.130
   32    HB3  CYS   3           HB2      CYS   3  -9.878  -1.011  -1.874
   33    H    ASN   4           H        ASN   4  -7.086  -3.243  -1.231
   34    HA   ASN   4           HA       ASN   4  -7.004  -5.410   0.721
   35    HB2  ASN   4           HB3      ASN   4  -6.995  -7.157  -1.004
   36    HB3  ASN   4           HB2      ASN   4  -8.499  -6.247  -1.026
   37   HD21  ASN   4          HD22      ASN   4  -7.403  -7.854  -3.108
   38   HD22  ASN   4          HD21      ASN   4  -7.147  -6.820  -4.471
   39    H    PHE   5           H        PHE   5  -5.236  -6.905  -1.261
   40    HA   PHE   5           HA       PHE   5  -2.765  -5.778  -0.440
   41    HB2  PHE   5           HB3      PHE   5  -1.847  -7.489  -2.158
   42    HB3  PHE   5           HB2      PHE   5  -2.637  -8.073  -0.702
   43    HD1  PHE   5           HD2      PHE   5  -3.182  -7.428  -4.312
   44    HD2  PHE   5           HD1      PHE   5  -4.494  -9.478  -0.824
   45    HE1  PHE   5           HE2      PHE   5  -4.718  -8.769  -5.682
   46    HE2  PHE   5           HE1      PHE   5  -6.034 -10.824  -2.188
   47    HZ   PHE   5           HZ       PHE   5  -6.146 -10.468  -4.621
   48    H    LEU   6           H        LEU   6  -1.096  -4.928  -1.739
   49    HA   LEU   6           HA       LEU   6  -0.334  -3.209  -2.998
   50    HB2  LEU   6           HB3      LEU   6  -2.198  -4.333  -5.102
   51    HB3  LEU   6           HB2      LEU   6  -0.914  -3.184  -5.393
   52    HG   LEU   6           HG       LEU   6   0.055  -5.123  -6.130
   53   HD11  LEU   6          HD11      LEU   6   1.206  -4.101  -3.942
   54   HD12  LEU   6          HD12      LEU   6   1.863  -5.464  -4.847
   55   HD13  LEU   6          HD13      LEU   6   0.921  -5.753  -3.390
   56   HD21  LEU   6          HD21      LEU   6  -1.742  -6.621  -5.613
   57   HD22  LEU   6          HD22      LEU   6  -1.314  -6.601  -3.902
   58   HD23  LEU   6          HD23      LEU   6  -0.217  -7.327  -5.076
   59    H    CYS   7           H        CYS   7  -1.800  -2.105  -1.287
   60    HA   CYS   7           HA       CYS   7  -3.518  -0.151  -2.433
   61    HB2  CYS   7           HB3      CYS   7  -4.947  -2.106  -2.811
   62    HB3  CYS   7           HB2      CYS   7  -4.844  -2.530  -1.110
   63    H    LYS   8           H        LYS   8  -3.212  -2.177   0.451
   64    HA   LYS   8           HA       LYS   8  -2.100   0.001   1.975
   65    HB2  LYS   8           HB3      LYS   8  -4.491   0.361   2.413
   66    HB3  LYS   8           HB2      LYS   8  -4.683  -1.333   2.844
   67    HG2  LYS   8           HG3      LYS   8  -3.308  -1.058   4.791
   68    HG3  LYS   8           HG2      LYS   8  -2.900   0.592   4.321
   69    HD2  LYS   8           HD3      LYS   8  -4.564   0.679   6.044
   70    HD3  LYS   8           HD2      LYS   8  -5.305   1.185   4.527
   71    HE2  LYS   8           HE3      LYS   8  -6.857  -0.247   5.594
   72    HE3  LYS   8           HE2      LYS   8  -6.146  -1.174   4.278
   73    HZ1  LYS   8           HZ1      LYS   8  -6.326  -2.465   6.314
   74    HZ2  LYS   8           HZ2      LYS   8  -5.352  -1.352   7.132
   75    HZ3  LYS   8           HZ3      LYS   8  -4.707  -2.274   5.870
   76    H    LEU   9           H        LEU   9  -3.415  -3.233   1.864
   77    HA   LEU   9           HA       LEU   9  -1.882  -4.457   3.856
   78    HB2  LEU   9           HB3      LEU   9  -3.134  -5.458   1.319
   79    HB3  LEU   9           HB2      LEU   9  -2.205  -6.535   2.345
   80    HG   LEU   9           HG       LEU   9  -3.792  -6.002   4.217
   81   HD11  LEU   9          HD11      LEU   9  -5.969  -5.035   3.620
   82   HD12  LEU   9          HD12      LEU   9  -5.349  -4.657   2.014
   83   HD13  LEU   9          HD13      LEU   9  -4.653  -3.879   3.433
   84   HD21  LEU   9          HD21      LEU   9  -4.987  -7.195   1.720
   85   HD22  LEU   9          HD22      LEU   9  -5.580  -7.429   3.365
   86   HD23  LEU   9          HD23      LEU   9  -3.992  -8.042   2.903
   87    H    LYS  10           H        LYS  10  -1.313  -4.748   0.342
   88    HA   LYS  10           HA       LYS  10   1.572  -4.599   0.901
   89    HB2  LYS  10           HB3      LYS  10   0.298  -5.548  -1.664
   90    HB3  LYS  10           HB2      LYS  10   1.985  -5.672  -1.209
   91    HG2  LYS  10           HG3      LYS  10   1.400  -7.239   0.558
   92    HG3  LYS  10           HG2      LYS  10  -0.300  -7.098   0.112
   93    HD2  LYS  10           HD3      LYS  10   0.319  -7.902  -2.175
   94    HD3  LYS  10           HD2      LYS  10   1.941  -8.217  -1.558
   95    HE2  LYS  10           HE3      LYS  10   1.007  -9.749   0.104
   96    HE3  LYS  10           HE2      LYS  10  -0.610  -9.428  -0.517
   97    HZ1  LYS  10           HZ1      LYS  10   0.067 -10.363  -2.644
   98    HZ2  LYS  10           HZ2      LYS  10   0.269 -11.489  -1.398
   99    HZ3  LYS  10           HZ3      LYS  10   1.611 -10.682  -2.036
  100    H    GLU  11           H        GLU  11   2.381  -3.796  -1.711
  101    HA   GLU  11           HA       GLU  11   1.777  -0.977  -1.164
  102    HB2  GLU  11           HB3      GLU  11   3.929  -0.452  -1.919
  103    HB3  GLU  11           HB2      GLU  11   4.108  -1.900  -0.938
  104    HG2  GLU  11           HG3      GLU  11   3.799  -2.094  -3.898
  105    HG3  GLU  11           HG2      GLU  11   5.349  -1.682  -3.187
  106    H    LYS  12           H        LYS  12   1.881   0.581  -2.822
  107    HA   LYS  12           HA       LYS  12   2.045  -0.137  -5.596
  108    HB2  LYS  12           HB3      LYS  12  -0.079   0.778  -6.265
  109    HB3  LYS  12           HB2      LYS  12  -0.406  -0.417  -5.013
  110    HG2  LYS  12           HG3      LYS  12  -0.271   1.612  -3.410
  111    HG3  LYS  12           HG2      LYS  12  -0.541   2.554  -4.873
  112    HD2  LYS  12           HD3      LYS  12  -2.317   0.252  -4.193
  113    HD3  LYS  12           HD2      LYS  12  -2.534   1.828  -3.429
  114    HE2  LYS  12           HE3      LYS  12  -2.792   2.864  -5.627
  115    HE3  LYS  12           HE2      LYS  12  -2.498   1.312  -6.407
  116    HZ1  LYS  12           HZ1      LYS  12  -4.859   1.873  -6.298
  117    HZ2  LYS  12           HZ2      LYS  12  -4.786   1.907  -4.610
  118    HZ3  LYS  12           HZ3      LYS  12  -4.518   0.459  -5.442
  119    H    LEU  13           H        LEU  13   1.660   2.140  -6.827
  120    HA   LEU  13           HA       LEU  13   3.531   3.948  -5.614
  121    HB2  LEU  13           HB3      LEU  13   3.018   3.346  -8.155
  122    HB3  LEU  13           HB2      LEU  13   1.927   4.705  -8.010
  123    HG   LEU  13           HG       LEU  13   4.895   4.834  -7.463
  124   HD11  LEU  13          HD11      LEU  13   4.437   4.369  -9.812
  125   HD12  LEU  13          HD12      LEU  13   5.043   6.010  -9.593
  126   HD13  LEU  13          HD13      LEU  13   3.325   5.736  -9.872
  127   HD21  LEU  13          HD21      LEU  13   3.606   6.512  -6.243
  128   HD22  LEU  13          HD22      LEU  13   2.827   7.011  -7.744
  129   HD23  LEU  13          HD23      LEU  13   4.560   7.252  -7.527
  130    H    ARG  14           H        ARG  14   2.322   4.482  -3.679
  131    HA   ARG  14           HA       ARG  14   0.356   6.593  -4.190
  132    HB2  ARG  14           HB3      ARG  14  -0.077   4.117  -2.691
  133    HB3  ARG  14           HB2      ARG  14  -0.554   5.571  -1.826
  134    HG2  ARG  14           HG3      ARG  14  -1.516   4.713  -4.549
  135    HG3  ARG  14           HG2      ARG  14  -2.434   4.669  -3.040
  136    HD2  ARG  14           HD3      ARG  14  -2.031   7.170  -2.898
  137    HD3  ARG  14           HD2      ARG  14  -1.471   7.077  -4.564
  138    HE   ARG  14           HE       ARG  14  -3.999   5.870  -4.377
  139   HH11  ARG  14          HH11      ARG  14  -2.465   9.011  -4.255
  140   HH12  ARG  14          HH12      ARG  14  -3.889   9.872  -4.742
  141   HH21  ARG  14          HH22      ARG  14  -5.885   6.998  -5.022
  142   HH22  ARG  14          HH21      ARG  14  -5.834   8.723  -5.191
  143    H    THR  15           H        THR  15   2.416   5.141  -1.651
  144    HA   THR  15           HA       THR  15   3.924   6.100  -0.274
  145    HB   THR  15           HB       THR  15   3.276   8.741  -1.572
  146    HG1  THR  15           HG1      THR  15   5.358   7.912  -2.758
  147   HG21  THR  15          HG21      THR  15   5.590   9.300  -0.990
  148   HG22  THR  15          HG22      THR  15   5.794   7.711  -0.252
  149   HG23  THR  15          HG23      THR  15   4.669   8.873   0.453
  150    H    VAL  16           H        VAL  16   0.657   6.811  -0.288
  151    HA   VAL  16           HA       VAL  16   0.893   7.859   2.449
  152    HB   VAL  16           HB       VAL  16  -1.334   8.546   0.533
  153   HG11  VAL  16          HG11      VAL  16  -1.937   8.338   2.951
  154   HG12  VAL  16          HG12      VAL  16  -2.194   9.946   2.264
  155   HG13  VAL  16          HG13      VAL  16  -0.789   9.639   3.285
  156   HG21  VAL  16          HG21      VAL  16   0.898  10.268   1.603
  157   HG22  VAL  16          HG22      VAL  16  -0.437  10.816   0.593
  158   HG23  VAL  16          HG23      VAL  16   0.750   9.684  -0.053
  159    H    ILE  17           H        ILE  17  -2.035   6.818   0.691
  160    HA   ILE  17           HA       ILE  17  -3.070   5.477   2.919
  161    HB   ILE  17           HB       ILE  17  -4.395   6.315   0.958
  162   HG12  ILE  17          HG13      ILE  17  -5.348   4.766   2.685
  163   HG13  ILE  17          HG12      ILE  17  -6.157   4.715   1.128
  164   HG21  ILE  17          HG21      ILE  17  -3.050   5.408  -0.844
  165   HG22  ILE  17          HG22      ILE  17  -4.728   4.881  -0.978
  166   HG23  ILE  17          HG23      ILE  17  -3.499   3.771  -0.372
  167   HD11  ILE  17          HD11      ILE  17  -4.385   2.662   2.394
  168   HD12  ILE  17          HD12      ILE  17  -4.712   2.644   0.661
  169   HD13  ILE  17          HD13      ILE  17  -6.037   2.499   1.806
  170    H    THR  18           H        THR  18  -1.276   4.239   0.154
  171    HA   THR  18           HA       THR  18  -1.547   1.507   0.974
  172    HB   THR  18           HB       THR  18   0.400   2.620  -1.033
  173    HG1  THR  18           HG1      THR  18  -2.391   2.083  -1.216
  174   HG21  THR  18          HG21      THR  18   0.255   0.437  -2.018
  175   HG22  THR  18          HG22      THR  18  -1.044  -0.023  -0.919
  176   HG23  THR  18          HG23      THR  18   0.583   0.238  -0.298
  177    H    SER  19           H        SER  19   0.668   4.098   1.297
  178    HA   SER  19           HA       SER  19   2.796   2.560   2.424
  179    HB2  SER  19           HB3      SER  19   3.382   4.561   1.281
  180    HB3  SER  19           HB2      SER  19   2.233   5.516   2.201
  181    HG   SER  19           HG       SER  19   3.663   4.731   4.071
  182    H    HIS  20           H        HIS  20  -0.025   2.573   3.555
  183    HA   HIS  20           HA       HIS  20   0.400   3.519   6.252
  184    HB2  HIS  20           HB3      HIS  20  -1.838   2.313   4.758
  185    HB3  HIS  20           HB2      HIS  20  -1.770   1.897   6.468
  186    HD1  HIS  20           HD1      HIS  20  -3.034   3.464   7.897
  187    HD2  HIS  20           HD2      HIS  20  -1.611   5.322   4.466
  188    HE1  HIS  20           HE1      HIS  20  -3.914   5.819   7.988
  189    HE2  HIS  20           HE2      HIS  20  -2.878   6.970   5.998
  190    H    ILE  21           H        ILE  21   0.478   0.419   4.538
  191    HA   ILE  21           HA       ILE  21   1.740  -0.719   6.945
  192    HB   ILE  21           HB       ILE  21  -0.141  -2.221   5.117
  193   HG12  ILE  21          HG13      ILE  21  -0.549  -1.275   7.966
  194   HG13  ILE  21          HG12      ILE  21  -1.323  -0.585   6.544
  195   HG21  ILE  21          HG21      ILE  21   0.064  -4.028   6.746
  196   HG22  ILE  21          HG22      ILE  21   1.203  -3.064   7.685
  197   HG23  ILE  21          HG23      ILE  21   1.637  -3.611   6.065
  198   HD11  ILE  21          HD11      ILE  21  -2.442  -2.722   6.135
  199   HD12  ILE  21          HD12      ILE  21  -2.835  -2.055   7.718
  200   HD13  ILE  21          HD13      ILE  21  -1.684  -3.383   7.582
  201    H    ASP  22           H        ASP  22   1.109  -1.767   3.592
  202    HA   ASP  22           HA       ASP  22   2.429  -2.653   1.971
  203    HB2  ASP  22           HB3      ASP  22   3.911  -0.717   2.177
  204    HB3  ASP  22           HB2      ASP  22   4.747  -1.470   3.522
  205    H    LYS  23           H        LYS  23   3.852  -4.427   1.529
  206    HA   LYS  23           HA       LYS  23   3.589  -6.489   3.457
  207    HB2  LYS  23           HB3      LYS  23   5.045  -7.789   1.814
  208    HB3  LYS  23           HB2      LYS  23   3.500  -7.199   1.226
  209    HG2  LYS  23           HG3      LYS  23   4.949  -6.744  -0.518
  210    HG3  LYS  23           HG2      LYS  23   4.845  -5.199   0.324
  211    HD2  LYS  23           HD3      LYS  23   6.938  -5.776   1.523
  212    HD3  LYS  23           HD2      LYS  23   7.060  -7.233   0.534
  213    HE2  LYS  23           HE3      LYS  23   7.025  -5.750  -1.482
  214    HE3  LYS  23           HE2      LYS  23   7.129  -4.369  -0.390
  215    HZ1  LYS  23           HZ1      LYS  23   9.299  -4.993  -1.227
  216    HZ2  LYS  23           HZ2      LYS  23   9.127  -6.555  -0.613
  217    HZ3  LYS  23           HZ3      LYS  23   9.230  -5.239   0.441
  218    H    VAL  24           H        VAL  24   6.048  -4.109   2.905
  219    HA   VAL  24           HA       VAL  24   7.488  -5.216   5.194
  220    HB   VAL  24           HB       VAL  24   8.939  -4.618   2.602
  221   HG11  VAL  24          HG11      VAL  24  10.053  -5.234   5.340
  222   HG12  VAL  24          HG12      VAL  24  10.187  -3.701   4.479
  223   HG13  VAL  24          HG13      VAL  24  10.996  -5.138   3.854
  224   HG21  VAL  24          HG21      VAL  24   9.720  -6.912   2.749
  225   HG22  VAL  24          HG22      VAL  24   7.958  -6.874   2.744
  226   HG23  VAL  24          HG23      VAL  24   8.830  -7.142   4.252
  227    H    LEU  25           H        LEU  25   8.447  -2.710   2.852
  228    HA   LEU  25           HA       LEU  25   7.598  -0.496   4.347
  229    HB2  LEU  25           HB3      LEU  25   9.309  -1.437   5.929
  230    HB3  LEU  25           HB2      LEU  25  10.529  -1.121   4.713
  231    HG   LEU  25           HG       LEU  25  10.022   1.295   4.851
  232   HD11  LEU  25          HD11      LEU  25   7.701   1.170   5.545
  233   HD12  LEU  25          HD12      LEU  25   8.637   2.120   6.699
  234   HD13  LEU  25          HD13      LEU  25   8.180   0.461   7.086
  235   HD21  LEU  25          HD21      LEU  25  10.676  -0.010   7.489
  236   HD22  LEU  25          HD22      LEU  25  11.026   1.662   7.050
  237   HD23  LEU  25          HD23      LEU  25  11.818   0.340   6.193
  238    H    ARG  26           H        ARG  26   7.594  -1.160   1.627
  239    HA   ARG  26           HA       ARG  26   9.125   1.141   0.635
  240    HB2  ARG  26           HB3      ARG  26   9.659  -0.170  -1.472
  241    HB3  ARG  26           HB2      ARG  26  10.568  -0.600  -0.034
  242    HG2  ARG  26           HG3      ARG  26  10.073  -2.685  -0.737
  243    HG3  ARG  26           HG2      ARG  26   8.599  -2.385   0.183
  244    HD2  ARG  26           HD3      ARG  26   8.099  -3.343  -2.007
  245    HD3  ARG  26           HD2      ARG  26   7.446  -1.708  -1.866
  246    HE   ARG  26           HE       ARG  26  10.009  -1.593  -3.025
  247   HH11  ARG  26          HH11      ARG  26   6.801  -2.752  -3.783
  248   HH12  ARG  26          HH12      ARG  26   6.940  -2.402  -5.481
  249   HH21  ARG  26          HH22      ARG  26  10.216  -1.164  -5.253
  250   HH22  ARG  26          HH21      ARG  26   8.890  -1.501  -6.320
  251    HA   PRO  27           HA       PRO  27   4.711   0.571  -0.761
  252    HB2  PRO  27           HB2      PRO  27   3.699   2.667   0.830
  253    HB3  PRO  27           HB3      PRO  27   3.506   0.927   1.090
  254    HG2  PRO  27           HG3      PRO  27   4.950   2.666   2.729
  255    HG3  PRO  27           HG2      PRO  27   5.090   0.900   2.720
  256    HD2  PRO  27           HD3      PRO  27   6.830   2.951   1.432
  257    HD3  PRO  27           HD2      PRO  27   7.268   1.394   2.170
  258    H    GLN  28           H        GLN  28   6.693   2.098  -2.113
  259    HA   GLN  28           HA       GLN  28   5.088   4.419  -2.960
  260    HB2  GLN  28           HB3      GLN  28   8.062   3.962  -3.241
  261    HB3  GLN  28           HB2      GLN  28   7.194   5.321  -3.936
  262    HG2  GLN  28           HG3      GLN  28   8.070   6.224  -2.008
  263    HG3  GLN  28           HG2      GLN  28   6.435   5.777  -1.511
  264   HE21  GLN  28          HE22      GLN  28   7.078   5.693   0.655
  265   HE22  GLN  28          HE21      GLN  28   8.025   4.388   1.274
  266    H    GLY  29           H        GLY  29   5.802   1.328  -3.756
  267    HA2  GLY  29           HA3      GLY  29   4.746   0.336  -5.651
  268    HA3  GLY  29           HA2      GLY  29   5.027   1.823  -6.544
  Start of MODEL   20
    1    H1   ARG   1           H1       ARG   1  -8.952   3.757   3.228
    2    H2   ARG   1           H2       ARG   1  -9.357   2.979   4.668
    3    H3   ARG   1           H3       ARG   1 -10.417   4.105   4.001
    4    HA   ARG   1           HA       ARG   1 -11.257   1.932   3.571
    5    HB2  ARG   1           HB3      ARG   1 -10.019   3.255   1.153
    6    HB3  ARG   1           HB2      ARG   1 -11.100   1.878   1.029
    7    HG2  ARG   1           HG3      ARG   1 -12.457   3.720   0.628
    8    HG3  ARG   1           HG2      ARG   1 -12.784   3.308   2.310
    9    HD2  ARG   1           HD3      ARG   1 -11.252   5.069   3.032
   10    HD3  ARG   1           HD2      ARG   1 -10.912   5.470   1.353
   11    HE   ARG   1           HE       ARG   1 -13.632   5.683   1.603
   12   HH11  ARG   1          HH12      ARG   1 -10.889   7.080   3.262
   13   HH12  ARG   1          HH11      ARG   1 -11.672   8.599   3.551
   14   HH21  ARG   1          HH21      ARG   1 -14.677   7.682   1.985
   15   HH22  ARG   1          HH22      ARG   1 -13.834   8.941   2.828
   16    H    LYS   2           H        LYS   2 -10.683  -0.143   3.818
   17    HA   LYS   2           HA       LYS   2  -7.968  -0.925   3.067
   18    HB2  LYS   2           HB3      LYS   2 -10.022  -2.618   4.502
   19    HB3  LYS   2           HB2      LYS   2  -8.307  -2.960   4.303
   20    HG2  LYS   2           HG3      LYS   2  -8.364  -2.210   6.467
   21    HG3  LYS   2           HG2      LYS   2  -8.003  -0.713   5.605
   22    HD2  LYS   2           HD3      LYS   2 -10.368  -0.098   5.679
   23    HD3  LYS   2           HD2      LYS   2 -10.741  -1.605   6.517
   24    HE2  LYS   2           HE3      LYS   2  -9.301  -0.915   8.379
   25    HE3  LYS   2           HE2      LYS   2  -8.957   0.601   7.545
   26    HZ1  LYS   2           HZ1      LYS   2 -10.662   0.965   9.163
   27    HZ2  LYS   2           HZ2      LYS   2 -11.596  -0.308   8.559
   28    HZ3  LYS   2           HZ3      LYS   2 -11.362   1.083   7.631
   29    H    CYS   3           H        CYS   3  -8.542  -0.668   0.827
   30    HA   CYS   3           HA       CYS   3 -10.513  -2.117  -0.506
   31    HB2  CYS   3           HB3      CYS   3  -8.567  -1.796  -2.395
   32    HB3  CYS   3           HB2      CYS   3  -9.730  -0.554  -1.927
   33    H    ASN   4           H        ASN   4  -7.024  -2.824  -0.815
   34    HA   ASN   4           HA       ASN   4  -7.145  -5.533  -0.154
   35    HB2  ASN   4           HB3      ASN   4  -7.149  -6.633  -2.321
   36    HB3  ASN   4           HB2      ASN   4  -8.621  -5.685  -2.160
   37   HD21  ASN   4          HD22      ASN   4  -7.227  -6.659  -4.537
   38   HD22  ASN   4          HD21      ASN   4  -6.883  -5.263  -5.502
   39    H    PHE   5           H        PHE   5  -5.301  -6.661  -1.800
   40    HA   PHE   5           HA       PHE   5  -2.866  -5.506  -1.092
   41    HB2  PHE   5           HB3      PHE   5  -1.994  -6.982  -3.036
   42    HB3  PHE   5           HB2      PHE   5  -2.688  -7.748  -1.609
   43    HD1  PHE   5           HD2      PHE   5  -3.362  -6.814  -5.122
   44    HD2  PHE   5           HD1      PHE   5  -4.634  -9.085  -1.757
   45    HE1  PHE   5           HE2      PHE   5  -4.972  -8.012  -6.541
   46    HE2  PHE   5           HE1      PHE   5  -6.246 -10.287  -3.174
   47    HZ   PHE   5           HZ       PHE   5  -6.417  -9.749  -5.569
   48    H    LEU   6           H        LEU   6  -1.220  -4.660  -2.467
   49    HA   LEU   6           HA       LEU   6  -0.473  -2.894  -3.622
   50    HB2  LEU   6           HB3      LEU   6  -2.397  -4.034  -5.636
   51    HB3  LEU   6           HB2      LEU   6  -1.310  -2.712  -6.003
   52    HG   LEU   6           HG       LEU   6  -0.263  -4.627  -6.867
   53   HD11  LEU   6          HD11      LEU   6   0.989  -4.219  -4.157
   54   HD12  LEU   6          HD12      LEU   6   1.238  -3.188  -5.567
   55   HD13  LEU   6          HD13      LEU   6   1.771  -4.868  -5.601
   56   HD21  LEU   6          HD21      LEU   6  -1.600  -6.334  -5.812
   57   HD22  LEU   6          HD22      LEU   6  -0.835  -6.013  -4.257
   58   HD23  LEU   6          HD23      LEU   6   0.111  -6.685  -5.584
   59    H    CYS   7           H        CYS   7  -2.494  -2.242  -1.751
   60    HA   CYS   7           HA       CYS   7  -3.550   0.197  -2.830
   61    HB2  CYS   7           HB3      CYS   7  -5.158  -1.566  -3.649
   62    HB3  CYS   7           HB2      CYS   7  -5.568  -1.877  -1.966
   63    H    LYS   8           H        LYS   8  -4.137  -2.148  -0.143
   64    HA   LYS   8           HA       LYS   8  -2.829  -0.347   1.694
   65    HB2  LYS   8           HB3      LYS   8  -5.225   0.485   1.623
   66    HB3  LYS   8           HB2      LYS   8  -5.716  -1.073   2.276
   67    HG2  LYS   8           HG3      LYS   8  -4.223  -0.649   4.227
   68    HG3  LYS   8           HG2      LYS   8  -3.940   0.969   3.592
   69    HD2  LYS   8           HD3      LYS   8  -6.270   1.519   3.810
   70    HD3  LYS   8           HD2      LYS   8  -6.652  -0.139   4.278
   71    HE2  LYS   8           HE3      LYS   8  -4.900   1.770   5.818
   72    HE3  LYS   8           HE2      LYS   8  -6.564   1.348   6.217
   73    HZ1  LYS   8           HZ1      LYS   8  -4.299  -0.567   6.123
   74    HZ2  LYS   8           HZ2      LYS   8  -5.889  -0.929   6.559
   75    HZ3  LYS   8           HZ3      LYS   8  -4.955   0.093   7.531
   76    H    LEU   9           H        LEU   9  -2.235  -2.837   0.724
   77    HA   LEU   9           HA       LEU   9  -2.248  -4.458   3.157
   78    HB2  LEU   9           HB3      LEU   9  -3.509  -5.253   0.611
   79    HB3  LEU   9           HB2      LEU   9  -2.470  -6.458   1.342
   80    HG   LEU   9           HG       LEU   9  -3.890  -6.050   3.474
   81   HD11  LEU   9          HD11      LEU   9  -5.786  -5.019   1.374
   82   HD12  LEU   9          HD12      LEU   9  -5.037  -4.053   2.645
   83   HD13  LEU   9          HD13      LEU   9  -6.169  -5.339   3.065
   84   HD21  LEU   9          HD21      LEU   9  -5.522  -7.712   2.734
   85   HD22  LEU   9          HD22      LEU   9  -3.891  -8.120   2.198
   86   HD23  LEU   9          HD23      LEU   9  -5.048  -7.431   1.058
   87    H    LYS  10           H        LYS  10  -1.144  -4.624  -0.258
   88    HA   LYS  10           HA       LYS  10   1.511  -5.416   0.766
   89    HB2  LYS  10           HB3      LYS  10   0.172  -6.118  -1.839
   90    HB3  LYS  10           HB2      LYS  10   1.881  -6.393  -1.537
   91    HG2  LYS  10           HG3      LYS  10   1.101  -7.707   0.526
   92    HG3  LYS  10           HG2      LYS  10  -0.485  -7.695  -0.247
   93    HD2  LYS  10           HD3      LYS  10   2.056  -8.748  -1.490
   94    HD3  LYS  10           HD2      LYS  10   0.795  -9.738  -0.757
   95    HE2  LYS  10           HE3      LYS  10  -0.804  -8.947  -2.417
   96    HE3  LYS  10           HE2      LYS  10   0.432  -7.917  -3.132
   97    HZ1  LYS  10           HZ1      LYS  10   0.590 -10.874  -2.968
   98    HZ2  LYS  10           HZ2      LYS  10   1.690  -9.852  -3.746
   99    HZ3  LYS  10           HZ3      LYS  10   0.116 -10.011  -4.341
  100    H    GLU  11           H        GLU  11   0.046  -3.648  -1.963
  101    HA   GLU  11           HA       GLU  11   0.477  -1.597  -2.801
  102    HB2  GLU  11           HB3      GLU  11   2.150  -1.429  -0.336
  103    HB3  GLU  11           HB2      GLU  11   2.095  -0.117  -1.508
  104    HG2  GLU  11           HG3      GLU  11   0.518   0.317   0.222
  105    HG3  GLU  11           HG2      GLU  11  -0.347  -0.050  -1.266
  106    H    LYS  12           H        LYS  12   2.261  -0.091  -3.495
  107    HA   LYS  12           HA       LYS  12   4.598  -1.497  -4.473
  108    HB2  LYS  12           HB3      LYS  12   4.138  -0.988  -6.807
  109    HB3  LYS  12           HB2      LYS  12   2.825  -1.942  -6.137
  110    HG2  LYS  12           HG3      LYS  12   2.613   1.032  -6.236
  111    HG3  LYS  12           HG2      LYS  12   2.333   0.076  -7.688
  112    HD2  LYS  12           HD3      LYS  12   0.661  -1.258  -6.330
  113    HD3  LYS  12           HD2      LYS  12   0.818  -0.007  -5.087
  114    HE2  LYS  12           HE3      LYS  12  -0.019   1.661  -6.517
  115    HE3  LYS  12           HE2      LYS  12   0.193   0.647  -7.944
  116    HZ1  LYS  12           HZ1      LYS  12  -2.137   0.835  -7.264
  117    HZ2  LYS  12           HZ2      LYS  12  -1.775   0.139  -5.766
  118    HZ3  LYS  12           HZ3      LYS  12  -1.598  -0.762  -7.186
  119    H    LEU  13           H        LEU  13   2.710   1.489  -4.347
  120    HA   LEU  13           HA       LEU  13   4.784   3.027  -3.280
  121    HB2  LEU  13           HB3      LEU  13   5.572   2.734  -5.701
  122    HB3  LEU  13           HB2      LEU  13   4.212   3.740  -6.157
  123    HG   LEU  13           HG       LEU  13   5.127   5.599  -4.842
  124   HD11  LEU  13          HD11      LEU  13   7.413   5.428  -3.933
  125   HD12  LEU  13          HD12      LEU  13   7.389   3.695  -4.265
  126   HD13  LEU  13          HD13      LEU  13   6.263   4.386  -3.096
  127   HD21  LEU  13          HD21      LEU  13   5.745   5.395  -7.189
  128   HD22  LEU  13          HD22      LEU  13   7.116   4.378  -6.750
  129   HD23  LEU  13          HD23      LEU  13   7.074   6.067  -6.246
  130    H    ARG  14           H        ARG  14   3.495   5.235  -5.253
  131    HA   ARG  14           HA       ARG  14   1.714   6.612  -5.345
  132    HB2  ARG  14           HB3      ARG  14   0.325   4.561  -5.427
  133    HB3  ARG  14           HB2      ARG  14   0.213   4.598  -3.674
  134    HG2  ARG  14           HG3      ARG  14  -1.781   5.506  -4.803
  135    HG3  ARG  14           HG2      ARG  14  -0.994   6.674  -3.740
  136    HD2  ARG  14           HD3      ARG  14  -1.679   7.692  -5.862
  137    HD3  ARG  14           HD2      ARG  14   0.068   7.731  -5.653
  138    HE   ARG  14           HE       ARG  14  -1.079   5.548  -7.222
  139   HH11  ARG  14          HH11      ARG  14   0.704   8.559  -7.130
  140   HH12  ARG  14          HH12      ARG  14   1.294   8.410  -8.753
  141   HH21  ARG  14          HH22      ARG  14  -0.296   5.347  -9.369
  142   HH22  ARG  14          HH21      ARG  14   0.720   6.590 -10.025
  143    H    THR  15           H        THR  15   2.855   5.470  -2.289
  144    HA   THR  15           HA       THR  15   3.222   6.498  -0.306
  145    HB   THR  15           HB       THR  15   4.904   7.588  -1.641
  146    HG1  THR  15           HG1      THR  15   3.628   9.457   0.092
  147   HG21  THR  15          HG21      THR  15   4.603   9.790  -2.649
  148   HG22  THR  15          HG22      THR  15   2.895   9.769  -2.208
  149   HG23  THR  15          HG23      THR  15   3.518   8.611  -3.383
  150    H    VAL  16           H        VAL  16   1.128   6.289   0.538
  151    HA   VAL  16           HA       VAL  16  -0.178   8.515   1.529
  152    HB   VAL  16           HB       VAL  16  -0.613   8.799  -0.991
  153   HG11  VAL  16          HG11      VAL  16  -1.227   6.304  -1.187
  154   HG12  VAL  16          HG12      VAL  16  -2.124   7.500  -2.134
  155   HG13  VAL  16          HG13      VAL  16  -2.829   6.834  -0.662
  156   HG21  VAL  16          HG21      VAL  16  -2.925   8.811   0.940
  157   HG22  VAL  16          HG22      VAL  16  -2.939   9.577  -0.645
  158   HG23  VAL  16          HG23      VAL  16  -1.811  10.126   0.592
  159    H    ILE  17           H        ILE  17  -2.918   7.356   1.400
  160    HA   ILE  17           HA       ILE  17  -2.911   5.380   3.318
  161    HB   ILE  17           HB       ILE  17  -4.952   6.527   2.736
  162   HG12  ILE  17          HG13      ILE  17  -4.974   4.041   3.551
  163   HG13  ILE  17          HG12      ILE  17  -6.471   4.800   3.033
  164   HG21  ILE  17          HG21      ILE  17  -4.654   6.883   0.395
  165   HG22  ILE  17          HG22      ILE  17  -6.176   6.027   0.641
  166   HG23  ILE  17          HG23      ILE  17  -4.756   5.153   0.067
  167   HD11  ILE  17          HD11      ILE  17  -6.526   2.670   2.084
  168   HD12  ILE  17          HD12      ILE  17  -4.824   2.725   1.602
  169   HD13  ILE  17          HD13      ILE  17  -6.023   3.716   0.758
  170    H    THR  18           H        THR  18  -2.418   5.117  -0.129
  171    HA   THR  18           HA       THR  18  -2.672   2.378  -0.489
  172    HB   THR  18           HB       THR  18  -0.583   4.118  -1.833
  173    HG1  THR  18           HG1      THR  18  -3.364   3.776  -2.429
  174   HG21  THR  18          HG21      THR  18  -0.957   2.596  -3.732
  175   HG22  THR  18          HG22      THR  18  -2.096   1.665  -2.761
  176   HG23  THR  18          HG23      THR  18  -0.394   1.727  -2.306
  177    H    SER  19           H        SER  19   0.497   3.922  -0.480
  178    HA   SER  19           HA       SER  19   1.822   1.590   0.446
  179    HB2  SER  19           HB3      SER  19   2.823   3.315  -1.057
  180    HB3  SER  19           HB2      SER  19   2.873   4.422   0.313
  181    HG   SER  19           HG       SER  19   4.129   1.877   0.301
  182    H    HIS  20           H        HIS  20   0.255   1.529   2.365
  183    HA   HIS  20           HA       HIS  20   1.298   3.146   4.598
  184    HB2  HIS  20           HB3      HIS  20  -1.082   3.581   4.004
  185    HB3  HIS  20           HB2      HIS  20  -1.442   1.896   4.355
  186    HD1  HIS  20           HD1      HIS  20   0.513   4.505   6.331
  187    HD2  HIS  20           HD2      HIS  20  -2.653   1.839   6.754
  188    HE1  HIS  20           HE1      HIS  20  -0.212   4.680   8.737
  189    HE2  HIS  20           HE2      HIS  20  -2.201   3.147   8.937
  190    H    ILE  21           H        ILE  21  -0.368   0.021   4.045
  191    HA   ILE  21           HA       ILE  21   0.995  -1.123   6.318
  192    HB   ILE  21           HB       ILE  21  -0.718  -2.444   4.200
  193   HG12  ILE  21          HG13      ILE  21  -1.252  -1.574   7.046
  194   HG13  ILE  21          HG12      ILE  21  -2.027  -0.972   5.586
  195   HG21  ILE  21          HG21      ILE  21  -0.732  -4.395   5.699
  196   HG22  ILE  21          HG22      ILE  21   0.427  -3.583   6.752
  197   HG23  ILE  21          HG23      ILE  21   0.890  -4.029   5.109
  198   HD11  ILE  21          HD11      ILE  21  -3.073  -3.146   5.246
  199   HD12  ILE  21          HD12      ILE  21  -3.492  -2.460   6.816
  200   HD13  ILE  21          HD13      ILE  21  -2.294  -3.749   6.709
  201    H    ASP  22           H        ASP  22   0.877  -2.009   2.856
  202    HA   ASP  22           HA       ASP  22   2.534  -2.415   1.352
  203    HB2  ASP  22           HB3      ASP  22   3.455  -0.313   2.430
  204    HB3  ASP  22           HB2      ASP  22   4.445  -1.356   3.432
  205    H    LYS  23           H        LYS  23   3.881  -4.131   0.788
  206    HA   LYS  23           HA       LYS  23   4.202  -6.221   2.706
  207    HB2  LYS  23           HB3      LYS  23   5.677  -7.231   0.792
  208    HB3  LYS  23           HB2      LYS  23   3.933  -7.165   0.646
  209    HG2  LYS  23           HG3      LYS  23   4.914  -6.566  -1.447
  210    HG3  LYS  23           HG2      LYS  23   4.161  -5.136  -0.752
  211    HD2  LYS  23           HD3      LYS  23   7.026  -5.530  -0.139
  212    HD3  LYS  23           HD2      LYS  23   6.630  -5.154  -1.818
  213    HE2  LYS  23           HE3      LYS  23   5.722  -3.567   0.571
  214    HE3  LYS  23           HE2      LYS  23   7.090  -3.135  -0.440
  215    HZ1  LYS  23           HZ1      LYS  23   5.635  -2.833  -2.294
  216    HZ2  LYS  23           HZ2      LYS  23   5.031  -1.940  -0.986
  217    HZ3  LYS  23           HZ3      LYS  23   4.306  -3.409  -1.425
  218    H    VAL  24           H        VAL  24   5.539  -3.614   3.162
  219    HA   VAL  24           HA       VAL  24   7.358  -2.854   4.247
  220    HB   VAL  24           HB       VAL  24   8.105  -5.757   4.638
  221   HG11  VAL  24          HG11      VAL  24   8.820  -3.285   6.213
  222   HG12  VAL  24          HG12      VAL  24   9.908  -4.209   5.177
  223   HG13  VAL  24          HG13      VAL  24   9.254  -4.939   6.644
  224   HG21  VAL  24          HG21      VAL  24   6.894  -5.602   6.766
  225   HG22  VAL  24          HG22      VAL  24   5.821  -5.365   5.387
  226   HG23  VAL  24          HG23      VAL  24   6.359  -3.978   6.336
  227    H    LEU  25           H        LEU  25   7.937  -2.141   2.034
  228    HA   LEU  25           HA       LEU  25  10.724  -2.865   1.665
  229    HB2  LEU  25           HB3      LEU  25   9.350  -4.306   0.097
  230    HB3  LEU  25           HB2      LEU  25   8.902  -2.830  -0.732
  231    HG   LEU  25           HG       LEU  25  11.197  -2.419  -1.372
  232   HD11  LEU  25          HD11      LEU  25  12.356  -3.248   0.574
  233   HD12  LEU  25          HD12      LEU  25  12.953  -4.084  -0.858
  234   HD13  LEU  25          HD13      LEU  25  11.828  -4.894   0.229
  235   HD21  LEU  25          HD21      LEU  25   9.881  -3.861  -2.821
  236   HD22  LEU  25          HD22      LEU  25  10.372  -5.274  -1.888
  237   HD23  LEU  25          HD23      LEU  25  11.570  -4.369  -2.814
  238    H    ARG  26           H        ARG  26   7.995  -0.776   0.774
  239    HA   ARG  26           HA       ARG  26   9.691   1.495   1.273
  240    HB2  ARG  26           HB3      ARG  26   9.294   2.629  -0.864
  241    HB3  ARG  26           HB2      ARG  26  10.204   1.146  -1.080
  242    HG2  ARG  26           HG3      ARG  26   7.239   1.142  -1.460
  243    HG3  ARG  26           HG2      ARG  26   8.297   1.753  -2.731
  244    HD2  ARG  26           HD3      ARG  26   8.531  -0.972  -1.470
  245    HD3  ARG  26           HD2      ARG  26   7.691  -0.643  -2.983
  246    HE   ARG  26           HE       ARG  26  10.477   0.191  -2.820
  247   HH11  ARG  26          HH11      ARG  26   8.165  -2.189  -3.950
  248   HH12  ARG  26          HH12      ARG  26   9.259  -2.887  -5.097
  249   HH21  ARG  26          HH22      ARG  26  11.903  -0.725  -4.334
  250   HH22  ARG  26          HH21      ARG  26  11.383  -2.058  -5.315
  251    HA   PRO  27           HA       PRO  27   5.106   2.094   2.188
  252    HB2  PRO  27           HB2      PRO  27   5.984   2.220   4.998
  253    HB3  PRO  27           HB3      PRO  27   4.644   1.306   4.279
  254    HG2  PRO  27           HG3      PRO  27   6.839   0.068   5.169
  255    HG3  PRO  27           HG2      PRO  27   5.990  -0.466   3.704
  256    HD2  PRO  27           HD3      PRO  27   8.476   1.215   3.932
  257    HD3  PRO  27           HD2      PRO  27   8.165  -0.183   2.877
  258    H    GLN  28           H        GLN  28   4.795   4.229   1.721
  259    HA   GLN  28           HA       GLN  28   6.508   6.174   3.137
  260    HB2  GLN  28           HB3      GLN  28   5.245   6.838   0.511
  261    HB3  GLN  28           HB2      GLN  28   6.702   7.491   1.244
  262    HG2  GLN  28           HG3      GLN  28   7.684   5.142   0.871
  263    HG3  GLN  28           HG2      GLN  28   6.321   4.921  -0.232
  264   HE21  GLN  28          HE22      GLN  28   6.395   7.825  -0.898
  265   HE22  GLN  28          HE21      GLN  28   7.706   7.986  -2.011
  266    H    GLY  29           H        GLY  29   3.569   5.035   3.417
  267    HA2  GLY  29           HA3      GLY  29   2.375   7.703   3.828
  268    HA3  GLY  29           HA2      GLY  29   1.457   6.382   3.123