*HEADER    ANTIMICROBIAL PROTEIN                   14-AUG-03   1Q71              
*TITLE     THE STRUCTURE OF MICROCIN J25 IS A THREADED SIDECHAIN-TO-             
*TITLE    2 BACKBONE RING STRUCTURE AND NOT A HEAD-TO-TAIL CYCLIZED              
*TITLE    3 BACKBONE                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MICROCIN J25;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: MCJA;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: MC4100;                                    
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PTUC202                                   
*KEYWDS    MICROCIN J25, MCCJ25, NMR, SIDECHAIN-TO-BACKBONE LINK,                
*KEYWDS   2 ANTIMICROBIAL PEPTIDE                                                
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.J.ROSENGREN, R.CLARK, N.L.DALY, U.GORANSSON, A.JONES,               
*AUTHOR   2 D.J.CRAIK                                                            
*REVDAT   2   20-JAN-04 1Q71    5 EXPERIMENTAL DATA AND TABLE SWAPPED 
*REVDAT   1   16-DEC-03 1Q71    0                                                

assign (resid   1 and name   HN)   (resid   2 and name   HN)   2.535    0.735    0.735  
assign (resid   1 and name   HN)   (resid   8 and name  HB2)   3.340    1.540    1.540  
assign (resid   1 and name   HN)   (resid   8 and name  HB1)   3.125    1.325    1.325  
assign (resid   1 and name   HN)   (resid   8 and name  HG2)   2.815    1.015    1.015  
assign (resid   1 and name   HN)   (resid   8 and name  HG1)   2.815    1.015    1.015  
assign (resid   1 and name   HN)   (resid   8 and name  HG#)   2.690    0.890    0.890  
assign (resid   1 and name   HN)   (resid   9 and name   HN or resid 18 and name HN)   2.595    0.795    0.795  
assign (resid   1 and name   HN)   (resid  18 and name  HB2)   2.905    1.105    1.105  
assign (resid   1 and name   HN)   (resid  18 and name  HB1)   3.650    1.850    1.850  
assign (resid   2 and name   HN)   (resid   3 and name   HN)   3.185    1.385    1.585  
assign (resid   2 and name   HN)   (resid  18 and name  HB2)   3.420    1.620    1.620  
assign (resid   2 and name   HN)   (resid  18 and name  HB1)   3.555    1.755    1.755  
assign (resid   2 and name   HN)   (resid  19 and name   HN)   2.440    0.640    0.640  
assign (resid   2 and name  HA1)   (resid   3 and name   HN)   2.520    0.720    0.720  
assign (resid   2 and name  HA2)   (resid   3 and name   HN)   2.520    0.720    0.720  
assign (resid   3 and name   HA)   (resid   4 and name   HN)   2.240    0.440    0.440  
assign (resid   3 and name   HA)   (resid  19 and name  HB2)   3.110    1.310    1.310  
assign (resid   3 and name   HA)   (resid  19 and name  HB1)   3.110    1.310    1.310  
assign (resid   3 and name   HA)   (resid  19 and name  HB#)   3.030    1.230    1.230  
assign (resid   3 and name   HA)   (resid  19 and name  HD#)   4.445    2.645    2.645  
assign (resid   4 and name   HN)   (resid  19 and name  HB2)   3.045    1.245    1.245  
assign (resid   4 and name   HN)   (resid  19 and name  HB1)   3.045    1.245    1.245  
assign (resid   4 and name   HN)   (resid  19 and name  HB#)   2.970    1.170    1.170  
assign (resid   4 and name  HA1)   (resid   5 and name   HN)   2.505    0.705    0.705  
assign (resid   4 and name  HA1)   (resid  19 and name  HB2)   3.955    2.155    2.155  
assign (resid   4 and name  HA1)   (resid  19 and name  HB1)   3.955    2.155    2.155  
assign (resid   4 and name  HA2)   (resid   5 and name   HN)   2.505    0.705    0.705  
assign (resid   4 and name  HA2)   (resid  19 and name  HB2)   3.955    2.155    2.155  
assign (resid   4 and name  HA2)   (resid  19 and name  HB1)   3.955    2.155    2.155  
assign (resid   5 and name   HN)   (resid   6 and name   HN)   2.270    0.470    0.470  
assign (resid   5 and name   HA)   (resid  19 and name  HD#)   4.710    2.910    2.910  
assign (resid   5 and name  HB2)   (resid   6 and name   HN)   3.650    1.850    1.850  
assign (resid   5 and name  HB1)   (resid   6 and name   HN)   3.400    1.600    1.600  
assign (resid   6 and name   HN)   (resid  19 and name  HB#)   3.655    1.855    1.855  
assign (resid   6 and name   HN)   (resid  19 and name  HD#)   4.710    2.910    2.910  
assign (resid   6 and name   HN)   (resid  20 and name   HN)   2.470    0.670    0.670  
assign (resid   6 and name   HA)   (resid   7 and name  HD2)   2.145    0.345    0.345  
assign (resid   6 and name   HA)   (resid   7 and name  HD1)   2.240    0.440    0.440  
assign (resid   6 and name   HB)   (resid  20 and name   HN)   3.570    1.770    1.770  
assign (resid   6 and name   HB)   (resid  20 and name  HE#)   4.715    2.915    1.285  
assign (resid   6 and name  HG*)   (resid  20 and name  HE#)   5.405    3.605    1.605  
assign (resid   7 and name   HA)   (resid   8 and name   HN)   2.130    0.330    0.330  
assign (resid   7 and name   HA)   (resid  19 and name   HA)   2.410    0.610    0.610  
assign (resid   7 and name   HA)   (resid  19 and name  HD#)   3.875    2.075    2.075  
assign (resid   7 and name  HB2)   (resid  19 and name  HD#)   4.600    2.800    2.800  
assign (resid   7 and name  HG2)   (resid  19 and name  HD#)   4.600    2.800    2.800  
assign (resid   7 and name  HD2)   (resid  19 and name  HD#)   4.710    2.910    2.910  
assign (resid   8 and name   HN)   (resid   9 and name   HN)   2.455    0.655    0.655  
assign (resid   8 and name   HN)   (resid  19 and name   HA)   2.255    0.455    0.455  
assign (resid   8 and name   HN)   (resid  20 and name   HN)   3.200    1.400    1.400  
assign (resid   8 and name   HA)   (resid  20 and name  HD#)   4.690    2.890    2.890  
assign (resid   8 and name   HA)   (resid  20 and name  HE#)   4.715    2.915    2.915  
assign (resid   8 and name  HB2)   (resid   9 and name   HN)   2.985    1.185    1.185  
assign (resid   8 and name  HB2)   (resid  20 and name  HD#)   4.720    2.920    2.920  
assign (resid   8 and name  HB1)   (resid   9 and name   HN)   3.170    1.370    1.370  
assign (resid   8 and name  HB1)   (resid  20 and name  HD#)   4.720    2.920    2.920  
assign (resid   8 and name  HG2)   (resid  19 and name   HA)   3.605    1.805    1.805  
assign (resid   8 and name  HG2)   (resid  20 and name  HD#)   4.720    2.920    2.920  
assign (resid   8 and name  HG1)   (resid  19 and name   HA)   3.605    1.805    1.805  
assign (resid   8 and name  HG1)   (resid  20 and name  HD#)   4.720    2.920    2.920  
assign (resid   8 and name  HG#)   (resid   9 and name   HN)   4.025    2.225    2.225  
assign (resid   8 and name  HG#)   (resid  19 and name   HA)   3.470    1.670    1.670  
assign (resid   8 and name  HG#)   (resid  20 and name  HD#)   4.495    2.695    2.695  
assign (resid   9 and name   HA)   (resid  10 and name   HN)   2.225    0.425    0.625 
assign (resid   9 and name  HB2)   (resid  10 and name   HN)   2.860    1.060    1.060  
assign (resid   9 and name  HB1)   (resid  10 and name   HN)   3.650    1.850    1.850  
assign (resid  10 and name   HA)   (resid  11 and name   HN)   2.195    0.395    0.595 
assign (resid  10 and name   HA)   (resid  16 and name   HA)   2.800    1.000    1.000  
assign (resid  10 and name   HA)   (resid  17 and name   HN)   3.400    1.600    1.600  
assign (resid  10 and name  HB2)   (resid  11 and name   HN)   2.750    0.950    1.150
assign (resid  10 and name  HB1)   (resid  11 and name   HN)   3.340    1.540    1.540  
assign (resid  11 and name   HA)   (resid  12 and name   HN)   2.365    0.565    0.565  
assign (resid  11 and name   HB)   (resid  12 and name   HN)   2.830    1.030    1.030  
assign (resid  11 and name  HG*)   (resid  12 and name   HN)   4.945    3.145    3.145  
assign (resid  12 and name   HN)   (resid  13 and name   HN)   2.520    0.720    0.720  
assign (resid  12 and name  HA1)   (resid  13 and name   HN)   2.580    0.780    0.780  
assign (resid  12 and name  HA2)   (resid  13 and name   HN)   2.580    0.780    0.780  
assign (resid  12 and name  HA#)   (resid  13 and name   HN)   2.435    0.635    0.635  
assign (resid  13 and name   HN)   (resid  14 and name   HN)   2.780    0.980    0.980  
assign (resid  13 and name   HA)   (resid  14 and name   HN)   2.300    0.500    0.500  
assign (resid  13 and name HG2#)   (resid  14 and name   HN)   4.165    2.365    2.365  
assign (resid  14 and name   HN)   (resid  15 and name   HN)   2.550    0.750    0.750  
assign (resid  15 and name   HA)   (resid  16 and name  HD2)   2.285    0.485    0.485  
assign (resid  15 and name   HA)   (resid  16 and name  HD1)   2.270    0.470    0.470  
assign (resid  16 and name   HA)   (resid  17 and name   HN)   2.145    0.345    0.345  
assign (resid  16 and name  HB2)   (resid  19 and name  HE#)   4.710    2.910    1.510  
assign (resid  16 and name  HB1)   (resid  17 and name   HN)   2.920    1.120    1.120  
assign (resid  16 and name  HB1)   (resid  19 and name  HE#)   4.385    2.585    1.585  
assign (resid  16 and name  HG2)   (resid  19 and name  HE#)   4.710    2.910    1.510  
assign (resid  16 and name  HG1)   (resid  19 and name  HE#)   4.215    2.415    1.415  
assign (resid  17 and name   HN)   (resid  18 and name   HN)   2.340    0.540    0.540  
assign (resid  17 and name   HA)   (resid  18 and name   HN)   2.255    0.455    0.455  
assign (resid  17 and name HG2#)   (resid  18 and name   HN)   4.085    2.285    2.285  
assign (resid  17 and name HG2#)   (resid  19 and name  HE#)   5.145    3.345    3.345  
assign (resid  17 and name HG1#)   (resid  18 and name   HN)   4.090    2.290    2.290  
assign (resid  18 and name   HA)   (resid  19 and name   HN)   2.435    0.635    0.635 
assign (resid  18 and name   HA)   (resid  19 and name  HD#)   3.980    2.180    2.180  
assign (resid  18 and name  HB2)   (resid  19 and name   HN)   2.315    0.515    0.515  
assign (resid  18 and name  HB2)   (resid  19 and name  HD#)   4.710    2.910    2.910  
assign (resid  18 and name  HB1)   (resid  19 and name   HN)   2.815    1.015    1.015  
assign (resid  19 and name   HA)   (resid  20 and name   HN)   2.255    0.455    0.455  
assign (resid  19 and name  HB2)   (resid  20 and name   HN)   2.455    0.655    0.655  
assign (resid  19 and name  HB1)   (resid  20 and name   HN)   2.455    0.655    0.655  
assign (resid  19 and name  HD#)   (resid  20 and name   HN)   4.710    2.910    2.910  
assign (resid  20 and name   HA)   (resid  21 and name   HN)   2.285    0.485    0.485  
assign (resid  20 and name  HB2)   (resid  21 and name   HN)   2.620    0.820    0.820 
assign (resid  20 and name  HB1)   (resid  21 and name   HN)   2.620    0.820    0.820
assign (resid  20 and name  HD#)   (resid  21 and name   HN)   4.625    2.825    2.825  

!dihedral angles

assign (resid  9 and name C   )
       
       (resid  10 and name N   )

       (resid  10 and name CA  )

       (resid  10 and name C   )  1.0   -100.0  80.0  2

assign (resid  8 and name C   )

       (resid  9 and name N   )

       (resid  9 and name CA  )

       (resid  9 and name C   )  1.0   -100.0  80.0  2

assign (resid  14 and name C   )

       (resid  15 and name N   )

       (resid  15 and name CA  )

       (resid  15 and name C   )  1.0   -120.0  30.0  2

assign (resid  16 and name C   )

       (resid  17 and name N   )

       (resid  17 and name CA  )

       (resid  17 and name C   )  1.0   -120.0  30.0  2

assign (resid  17 and name C   )

       (resid  18 and name N   )

       (resid  18 and name CA  )

       (resid  18 and name C   )  1.0   -100.0  80.0  2

assign (resid  18 and name C   )

       (resid  19 and name N   )

       (resid  19 and name CA  )

       (resid  19 and name C   )  1.0   -120.0  30.0  2

assign (resid  19 and name C   )

       (resid  20 and name N   )

       (resid  20 and name CA  )

       (resid  20 and name C   )  1.0   -100.0  80.0  2

assign (resid   2 and name C   )

       (resid   3 and name N   )

       (resid   3 and name CA  )

       (resid   3 and name C   )  1.0   -120.0  30.0  2

assign (resid   5 and name C   )

       (resid   6 and name N   )

       (resid   6 and name CA  )

       (resid   6 and name C   )  1.0   -120.0  30.0  2

assign (resid   7 and name C   )

       (resid   8 and name N   )

       (resid   8 and name CA  )

       (resid   8 and name C   )  1.0   -120.0  30.0  2

assign (resid  10 and name C   )

       (resid  11 and name N   )

       (resid  11 and name CA  )

       (resid  11 and name C   )  1.0  -100.0  80.0  2

assign (resid  12 and name C   )

       (resid  13 and name N   )

       (resid  13 and name CA  )

       (resid  13 and name C   )  1.0  -100.0  80.0  2


!CHI1
assign (resid  18 and name N   )

       (resid  18 and name CA  )

       (resid  18 and name CB  )

       (resid  18 and name OG  )  1.0  60.0  30.0  2

assign (resid   5 and name N   )

       (resid   5 and name CA  )

       (resid   5 and name CB  )

       (resid   5 and name CG  )  1.0  -60.0  30.0  2

assign (resid   8 and name N   )

       (resid   8 and name CA  )

       (resid   8 and name CB  )

       (resid   8 and name CG  )  1.0  -60.0  30.0  2


assign (resid   9 and name N   )

       (resid   9 and name CA  )

       (resid   9 and name CB  )

       (resid   9 and name CG  )  1.0  -60.0  30.0  2

assign (resid  10 and name N   )

       (resid  10 and name CA  )

       (resid  10 and name CB  )

       (resid  10 and name CG  )  1.0  -60.0  30.0  2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   2H    GLY   1           HN2      GLY   1  -7.167  -1.069  -0.226
    2   1HA   GLY   1          2HA       GLY   1  -9.087  -1.664   0.893
    3   2HA   GLY   1          1HA       GLY   1  -9.393  -2.841  -0.374
    4    H    GLY   2           H        GLY   2  -6.565  -2.683   1.750
    5   1HA   GLY   2          2HA       GLY   2  -7.359  -4.519   3.682
    6   2HA   GLY   2          1HA       GLY   2  -6.680  -5.443   2.349
    7    H    ALA   3           H        ALA   3  -4.794  -6.142   3.194
    8    HA   ALA   3           HA       ALA   3  -2.756  -4.126   3.723
    9   1HB   ALA   3          1HB       ALA   3  -2.016  -5.574   5.730
   10   2HB   ALA   3          2HB       ALA   3  -3.677  -6.167   5.716
   11   3HB   ALA   3          3HB       ALA   3  -3.357  -4.449   5.948
   12    H    GLY   4           H        GLY   4  -0.710  -4.784   3.154
   13   1HA   GLY   4          2HA       GLY   4   0.239  -7.366   2.860
   14   2HA   GLY   4          1HA       GLY   4  -0.515  -6.944   1.329
   15    H    HIS   5           H        HIS   5   1.004  -6.418  -0.092
   16    HA   HIS   5           HA       HIS   5   3.236  -4.717   0.825
   17   1HB   HIS   5          2HB       HIS   5   3.254  -6.646  -1.508
   18   2HB   HIS   5          1HB       HIS   5   4.617  -5.702  -0.919
   19    HD1  HIS   5           1HD      HIS   5   2.395  -8.602   0.103
   20    HD2  HIS   5           2HD      HIS   5   6.072  -6.888   1.075
   21    HE1  HIS   5           1HE      HIS   5   3.484 -10.187   1.729
   22    HE2  HIS   5           2HE      HIS   5   5.643  -9.071   2.396
   23    H    VAL   6           H        VAL   6   0.889  -5.348  -1.735
   24    HA   VAL   6           HA       VAL   6   1.739  -2.990  -3.222
   25    HB   VAL   6           HB       VAL   6  -0.581  -4.860  -3.751
   26   1HG1  VAL   6          1HG1      VAL   6   0.645  -3.321  -5.941
   27   2HG1  VAL   6          2HG1      VAL   6  -0.278  -2.383  -4.769
   28   3HG1  VAL   6          3HG1      VAL   6  -1.046  -3.714  -5.635
   29   1HG2  VAL   6          1HG2      VAL   6   2.190  -4.838  -4.940
   30   2HG2  VAL   6          2HG2      VAL   6   0.859  -5.877  -5.450
   31   3HG2  VAL   6          3HG2      VAL   6   1.543  -6.047  -3.834
   32    HA   PRO   7           HA       PRO   7  -1.072  -0.466  -0.822
   33   1HB   PRO   7          2HB       PRO   7  -0.656   1.835  -2.219
   34   2HB   PRO   7          1HB       PRO   7   0.460   1.220  -0.994
   35   1HG   PRO   7          2HG       PRO   7   0.604   0.996  -3.973
   36   2HG   PRO   7          1HG       PRO   7   1.898   1.348  -2.812
   37   1HD   PRO   7          2HD       PRO   7   1.551  -1.103  -3.899
   38   2HD   PRO   7          1HD       PRO   7   2.171  -0.871  -2.252
   39    H    GLU   8           H        GLU   8  -3.170   0.043  -0.993
   40    HA   GLU   8           HA       GLU   8  -4.460  -0.326  -3.589
   41   1HB   GLU   8          2HB       GLU   8  -5.362  -0.493  -0.755
   42   2HB   GLU   8          1HB       GLU   8  -6.552  -0.068  -1.974
   43   1HG   GLU   8          2HG       GLU   8  -5.956  -2.135  -3.202
   44   2HG   GLU   8          1HG       GLU   8  -4.887  -2.570  -1.868
   45    H    TYR   9           H        TYR   9  -5.355   1.781  -0.856
   46    HA   TYR   9           HA       TYR   9  -5.848   3.912  -2.821
   47   1HB   TYR   9          2HB       TYR   9  -7.004   3.558  -0.053
   48   2HB   TYR   9          1HB       TYR   9  -7.364   4.893  -1.135
   49    HD1  TYR   9           1HD      TYR   9  -7.562   1.169  -0.934
   50    HD2  TYR   9           2HD      TYR   9  -9.170   4.745  -2.588
   51    HE1  TYR   9           1HE      TYR   9  -9.406  -0.122  -1.917
   52    HE2  TYR   9           2HE      TYR   9 -11.020   3.461  -3.576
   53    HH   TYR   9           HH       TYR   9 -11.821   1.413  -4.000
   54    H    PHE  10           H        PHE  10  -5.046   5.906  -2.591
   55    HA   PHE  10           HA       PHE  10  -3.097   6.363  -0.428
   56   1HB   PHE  10          2HB       PHE  10  -3.070   7.618  -3.183
   57   2HB   PHE  10          1HB       PHE  10  -1.853   7.804  -1.936
   58    HD1  PHE  10           1HD      PHE  10  -3.487   5.027  -3.848
   59    HD2  PHE  10           2HD      PHE  10   0.088   6.652  -2.209
   60    HE1  PHE  10           1HE      PHE  10  -2.203   3.170  -4.820
   61    HE2  PHE  10           2HE      PHE  10   1.378   4.796  -3.177
   62    HZ   PHE  10           HZ       PHE  10   0.234   3.054  -4.485
   63    H    VAL  11           H        VAL  11  -3.087   8.436   0.513
   64    HA   VAL  11           HA       VAL  11  -5.635   9.816   0.310
   65    HB   VAL  11           HB       VAL  11  -4.841  11.182   2.216
   66   1HG1  VAL  11          1HG1      VAL  11  -5.600   8.500   2.187
   67   2HG1  VAL  11          2HG1      VAL  11  -5.696   9.622   3.544
   68   3HG1  VAL  11          3HG1      VAL  11  -4.277   8.593   3.349
   69   1HG2  VAL  11          1HG2      VAL  11  -2.773  10.485   3.388
   70   2HG2  VAL  11          2HG2      VAL  11  -2.464  11.194   1.803
   71   3HG2  VAL  11          3HG2      VAL  11  -2.382   9.445   2.018
   72    H    GLY  12           H        GLY  12  -4.981  12.412   0.922
   73   1HA   GLY  12          2HA       GLY  12  -4.520  13.548  -1.568
   74   2HA   GLY  12          1HA       GLY  12  -4.427  14.410  -0.050
   75    H    ILE  13           H        ILE  13  -2.243  13.083   1.071
   76    HA   ILE  13           HA       ILE  13  -0.118  14.312  -0.465
   77    HB   ILE  13           HB       ILE  13   1.314  13.698   1.527
   78   1HG1  ILE  13          2HG1      ILE  13  -1.379  13.006   2.728
   79   2HG1  ILE  13          1HG1      ILE  13  -0.105  11.849   2.356
   80   1HG2  ILE  13          1HG2      ILE  13   0.072  15.894   1.083
   81   2HG2  ILE  13          2HG2      ILE  13   0.645  15.589   2.722
   82   3HG2  ILE  13          3HG2      ILE  13  -1.057  15.354   2.323
   83   1HD1  ILE  13          1HD1      ILE  13   0.282  14.134   4.263
   84   2HD1  ILE  13          2HD1      ILE  13   1.295  12.707   4.047
   85   3HD1  ILE  13          3HD1      ILE  13  -0.310  12.550   4.762
   86    H    GLY  14           H        GLY  14  -1.292  11.940  -1.540
   87   1HA   GLY  14          2HA       GLY  14  -0.721   9.959  -2.538
   88   2HA   GLY  14          1HA       GLY  14   0.902  10.625  -2.559
   89    H    THR  15           H        THR  15  -0.765   9.909   0.435
   90    HA   THR  15           HA       THR  15   1.240   7.831   0.946
   91    HB   THR  15           HB       THR  15  -0.548   9.199   2.964
   92    HG1  THR  15           1HG      THR  15   1.539  10.194   1.606
   93   1HG2  THR  15          1HG2      THR  15   2.108   7.943   3.535
   94   2HG2  THR  15          2HG2      THR  15   0.670   6.930   3.407
   95   3HG2  THR  15          3HG2      THR  15   0.741   8.211   4.617
   96    HA   PRO  16           HA       PRO  16  -2.202   5.012   0.536
   97   1HB   PRO  16          2HB       PRO  16  -0.777   2.732   0.600
   98   2HB   PRO  16          1HB       PRO  16  -0.804   3.789  -0.814
   99   1HG   PRO  16          2HG       PRO  16   1.295   3.471   1.279
  100   2HG   PRO  16          1HG       PRO  16   1.476   3.755  -0.461
  101   1HD   PRO  16          2HD       PRO  16   1.690   5.699   1.507
  102   2HD   PRO  16          1HD       PRO  16   1.365   6.014  -0.207
  103    H    ILE  17           H        ILE  17  -3.522   4.488   2.140
  104    HA   ILE  17           HA       ILE  17  -2.354   3.482   4.654
  105    HB   ILE  17           HB       ILE  17  -5.037   4.866   4.466
  106   1HG1  ILE  17          2HG1      ILE  17  -2.341   6.057   5.175
  107   2HG1  ILE  17          1HG1      ILE  17  -3.322   6.467   3.773
  108   1HG2  ILE  17          1HG2      ILE  17  -3.242   4.504   6.858
  109   2HG2  ILE  17          2HG2      ILE  17  -4.481   3.335   6.408
  110   3HG2  ILE  17          3HG2      ILE  17  -4.938   4.984   6.835
  111   1HD1  ILE  17          1HD1      ILE  17  -4.207   8.099   4.970
  112   2HD1  ILE  17          2HD1      ILE  17  -3.407   7.529   6.434
  113   3HD1  ILE  17          3HD1      ILE  17  -4.980   6.875   5.977
  114    H    SER  18           H        SER  18  -2.825   1.903   2.472
  115    HA   SER  18           HA       SER  18  -4.304  -0.219   3.541
  116   1HB   SER  18          2HB       SER  18  -6.086  -0.324   1.747
  117   2HB   SER  18          1HB       SER  18  -6.318   0.943   2.948
  118    HG   SER  18           HG       SER  18  -5.363   2.405   1.434
  119    H    PHE  19           H        PHE  19  -3.960  -2.107   2.375
  120    HA   PHE  19           HA       PHE  19  -2.411  -1.829  -0.113
  121   1HB   PHE  19          2HB       PHE  19  -1.737  -3.657   2.203
  122   2HB   PHE  19          1HB       PHE  19  -0.948  -3.697   0.632
  123    HD1  PHE  19           1HD      PHE  19   0.881  -2.328   0.186
  124    HD2  PHE  19           2HD      PHE  19  -1.546  -1.529   3.590
  125    HE1  PHE  19           1HE      PHE  19   2.526  -0.676   0.969
  126    HE2  PHE  19           2HE      PHE  19   0.093   0.127   4.376
  127    HZ   PHE  19           HZ       PHE  19   2.134   0.556   3.064
  128    H    TYR  20           H        TYR  20  -2.070  -4.431  -0.796
  129    HA   TYR  20           HA       TYR  20  -4.823  -5.513  -0.800
  130   1HB   TYR  20          2HB       TYR  20  -4.016  -4.489  -2.975
  131   2HB   TYR  20          1HB       TYR  20  -2.820  -5.768  -3.042
  132    HD1  TYR  20           1HD      TYR  20  -3.424  -7.127  -4.821
  133    HD2  TYR  20           2HD      TYR  20  -6.414  -5.903  -2.052
  134    HE1  TYR  20           1HE      TYR  20  -5.045  -8.610  -5.925
  135    HE2  TYR  20           2HE      TYR  20  -8.042  -7.383  -3.147
  136    HH   TYR  20           HH       TYR  20  -8.323  -9.017  -4.655
  137    H    GLY  21           H        GLY  21  -1.559  -6.454  -1.702
  138   1HA   GLY  21          2HA       GLY  21  -1.510  -8.641   0.181
  139   2HA   GLY  21          1HA       GLY  21  -1.617  -9.143  -1.504
  Start of MODEL    2
    1   2H    GLY   1           HN2      GLY   1  -7.266  -0.962  -0.381
    2   1HA   GLY   1          2HA       GLY   1  -9.112  -1.574   0.836
    3   2HA   GLY   1          1HA       GLY   1  -9.338  -2.873  -0.324
    4    H    GLY   2           H        GLY   2  -6.563  -2.400   1.817
    5   1HA   GLY   2          2HA       GLY   2  -7.298  -4.066   3.907
    6   2HA   GLY   2          1HA       GLY   2  -6.597  -5.101   2.670
    7    H    ALA   3           H        ALA   3  -4.679  -5.656   3.537
    8    HA   ALA   3           HA       ALA   3  -2.709  -3.534   3.874
    9   1HB   ALA   3          1HB       ALA   3  -3.475  -5.477   6.036
   10   2HB   ALA   3          2HB       ALA   3  -3.350  -3.720   6.129
   11   3HB   ALA   3          3HB       ALA   3  -1.891  -4.703   5.991
   12    H    GLY   4           H        GLY   4  -0.688  -4.143   3.238
   13   1HA   GLY   4          2HA       GLY   4   0.379  -6.707   3.193
   14   2HA   GLY   4          1HA       GLY   4  -0.441  -6.474   1.654
   15    H    HIS   5           H        HIS   5   1.015  -6.045   0.133
   16    HA   HIS   5           HA       HIS   5   3.195  -4.167   0.798
   17   1HB   HIS   5          2HB       HIS   5   3.341  -6.239  -1.387
   18   2HB   HIS   5          1HB       HIS   5   4.661  -5.329  -0.659
   19    HD1  HIS   5           1HD      HIS   5   4.441  -5.897   2.249
   20    HD2  HIS   5           2HD      HIS   5   3.647  -8.790  -0.622
   21    HE1  HIS   5           1HE      HIS   5   4.727  -8.101   3.419
   22    HE2  HIS   5           2HE      HIS   5   3.963  -9.805   1.729
   23    H    VAL   6           H        VAL   6   0.861  -5.182  -1.668
   24    HA   VAL   6           HA       VAL   6   1.644  -2.984  -3.415
   25    HB   VAL   6           HB       VAL   6  -0.653  -4.924  -3.751
   26   1HG1  VAL   6          1HG1      VAL   6   0.726  -3.059  -5.675
   27   2HG1  VAL   6          2HG1      VAL   6  -0.946  -2.977  -5.119
   28   3HG1  VAL   6          3HG1      VAL   6  -0.425  -4.307  -6.152
   29   1HG2  VAL   6          1HG2      VAL   6   1.068  -5.873  -5.494
   30   2HG2  VAL   6          2HG2      VAL   6   1.119  -6.378  -3.805
   31   3HG2  VAL   6          3HG2      VAL   6   2.246  -5.155  -4.394
   32    HA   PRO   7           HA       PRO   7  -1.150  -0.262  -1.204
   33   1HB   PRO   7          2HB       PRO   7  -0.492   1.540  -3.451
   34   2HB   PRO   7          1HB       PRO   7  -0.315   1.793  -1.713
   35   1HG   PRO   7          2HG       PRO   7   1.814   1.360  -3.262
   36   2HG   PRO   7          1HG       PRO   7   1.717   0.683  -1.625
   37   1HD   PRO   7          2HD       PRO   7   1.265  -0.661  -4.263
   38   2HD   PRO   7          1HD       PRO   7   2.110  -1.263  -2.821
   39    H    GLU   8           H        GLU   8  -3.248   0.144  -1.339
   40    HA   GLU   8           HA       GLU   8  -4.644  -0.406  -3.855
   41   1HB   GLU   8          2HB       GLU   8  -5.569  -0.234  -0.988
   42   2HB   GLU   8          1HB       GLU   8  -6.698  -0.281  -2.332
   43   1HG   GLU   8          2HG       GLU   8  -5.694  -2.448  -3.014
   44   2HG   GLU   8          1HG       GLU   8  -4.725  -2.404  -1.542
   45    H    TYR   9           H        TYR   9  -5.314   1.789  -1.137
   46    HA   TYR   9           HA       TYR   9  -5.809   3.930  -3.099
   47   1HB   TYR   9          2HB       TYR   9  -7.130   3.502  -0.413
   48   2HB   TYR   9          1HB       TYR   9  -7.397   4.891  -1.455
   49    HD1  TYR   9           1HD      TYR   9  -9.139   4.851  -2.986
   50    HD2  TYR   9           2HD      TYR   9  -7.679   1.165  -1.447
   51    HE1  TYR   9           1HE      TYR   9 -10.973   3.662  -4.109
   52    HE2  TYR   9           2HE      TYR   9  -9.506  -0.035  -2.571
   53    HH   TYR   9           HH       TYR   9 -11.170   0.977  -4.971
   54    H    PHE  10           H        PHE  10  -5.003   5.938  -2.708
   55    HA   PHE  10           HA       PHE  10  -3.067   6.153  -0.504
   56   1HB   PHE  10          2HB       PHE  10  -3.091   7.699  -3.103
   57   2HB   PHE  10          1HB       PHE  10  -1.861   7.783  -1.855
   58    HD1  PHE  10           1HD      PHE  10   0.065   6.588  -2.147
   59    HD2  PHE  10           2HD      PHE  10  -3.476   5.263  -4.099
   60    HE1  PHE  10           1HE      PHE  10   1.357   4.840  -3.297
   61    HE2  PHE  10           2HE      PHE  10  -2.191   3.509  -5.247
   62    HZ   PHE  10           HZ       PHE  10   0.228   3.297  -4.847
   63    H    VAL  11           H        VAL  11  -2.967   8.098   0.656
   64    HA   VAL  11           HA       VAL  11  -5.507   9.476   0.842
   65    HB   VAL  11           HB       VAL  11  -4.517  10.656   2.770
   66   1HG1  VAL  11          1HG1      VAL  11  -5.641   8.542   3.135
   67   2HG1  VAL  11          2HG1      VAL  11  -4.268   8.695   4.231
   68   3HG1  VAL  11          3HG1      VAL  11  -4.147   7.665   2.805
   69   1HG2  VAL  11          1HG2      VAL  11  -2.246  10.905   2.277
   70   2HG2  VAL  11          2HG2      VAL  11  -2.043   9.190   1.916
   71   3HG2  VAL  11          3HG2      VAL  11  -2.273   9.719   3.583
   72    H    GLY  12           H        GLY  12  -4.781  12.015   1.623
   73   1HA   GLY  12          2HA       GLY  12  -4.601  13.380  -0.796
   74   2HA   GLY  12          1HA       GLY  12  -4.365  14.103   0.779
   75    H    ILE  13           H        ILE  13  -2.068  12.711   1.549
   76    HA   ILE  13           HA       ILE  13  -0.117  14.112  -0.072
   77    HB   ILE  13           HB       ILE  13   1.510  13.365   1.711
   78   1HG1  ILE  13          2HG1      ILE  13  -1.041  12.521   3.109
   79   2HG1  ILE  13          1HG1      ILE  13   0.203  11.425   2.516
   80   1HG2  ILE  13          1HG2      ILE  13  -0.886  15.027   2.466
   81   2HG2  ILE  13          2HG2      ILE  13   0.612  15.587   1.721
   82   3HG2  ILE  13          3HG2      ILE  13   0.623  14.982   3.378
   83   1HD1  ILE  13          1HD1      ILE  13   0.719  13.546   4.580
   84   2HD1  ILE  13          2HD1      ILE  13   1.765  12.204   4.119
   85   3HD1  ILE  13          3HD1      ILE  13   0.254  11.892   4.972
   86    H    GLY  14           H        GLY  14  -1.346  11.830  -1.255
   87   1HA   GLY  14          2HA       GLY  14  -0.840   9.952  -2.468
   88   2HA   GLY  14          1HA       GLY  14   0.765  10.651  -2.568
   89    H    THR  15           H        THR  15  -0.680   9.594   0.450
   90    HA   THR  15           HA       THR  15   1.401   7.529   0.616
   91    HB   THR  15           HB       THR  15  -0.230   8.675   2.889
   92    HG1  THR  15           1HG      THR  15   1.724   9.834   1.462
   93   1HG2  THR  15          1HG2      THR  15   1.227   7.589   4.336
   94   2HG2  THR  15          2HG2      THR  15   2.482   7.420   3.109
   95   3HG2  THR  15          3HG2      THR  15   1.040   6.407   3.041
   96    HA   PRO  16           HA       PRO  16  -1.887   4.565   0.049
   97   1HB   PRO  16          2HB       PRO  16  -0.444   2.352   0.775
   98   2HB   PRO  16          1HB       PRO  16  -0.361   3.105  -0.822
   99   1HG   PRO  16          2HG       PRO  16   1.497   3.383   1.504
  100   2HG   PRO  16          1HG       PRO  16   1.875   3.237  -0.222
  101   1HD   PRO  16          2HD       PRO  16   1.935   5.606   1.070
  102   2HD   PRO  16          1HD       PRO  16   1.451   5.469  -0.633
  103    H    ILE  17           H        ILE  17  -3.488   4.199   1.429
  104    HA   ILE  17           HA       ILE  17  -2.814   3.650   4.244
  105    HB   ILE  17           HB       ILE  17  -3.967   5.837   3.828
  106   1HG1  ILE  17          2HG1      ILE  17  -5.685   5.560   5.602
  107   2HG1  ILE  17          1HG1      ILE  17  -5.497   3.814   5.477
  108   1HG2  ILE  17          1HG2      ILE  17  -5.557   4.375   2.119
  109   2HG2  ILE  17          2HG2      ILE  17  -5.831   6.038   2.638
  110   3HG2  ILE  17          3HG2      ILE  17  -6.615   4.708   3.491
  111   1HD1  ILE  17          1HD1      ILE  17  -3.333   3.876   6.368
  112   2HD1  ILE  17          2HD1      ILE  17  -4.275   4.989   7.362
  113   3HD1  ILE  17          3HD1      ILE  17  -3.190   5.616   6.121
  114    H    SER  18           H        SER  18  -3.019   1.837   2.054
  115    HA   SER  18           HA       SER  18  -4.357  -0.300   3.223
  116   1HB   SER  18          2HB       SER  18  -6.183  -0.599   1.477
  117   2HB   SER  18          1HB       SER  18  -6.466   0.681   2.654
  118    HG   SER  18           HG       SER  18  -5.872   2.194   1.129
  119    H    PHE  19           H        PHE  19  -4.018  -2.244   2.057
  120    HA   PHE  19           HA       PHE  19  -2.630  -2.012  -0.512
  121   1HB   PHE  19          2HB       PHE  19  -1.523  -3.755   1.686
  122   2HB   PHE  19          1HB       PHE  19  -0.800  -3.404   0.129
  123    HD1  PHE  19           1HD      PHE  19  -1.637  -1.925   3.419
  124    HD2  PHE  19           2HD      PHE  19   0.620  -1.566  -0.170
  125    HE1  PHE  19           1HE      PHE  19  -0.341  -0.091   4.423
  126    HE2  PHE  19           2HE      PHE  19   1.921   0.267   0.828
  127    HZ   PHE  19           HZ       PHE  19   1.441   1.007   3.126
  128    H    TYR  20           H        TYR  20  -2.242  -4.326  -1.398
  129    HA   TYR  20           HA       TYR  20  -4.788  -5.736  -1.143
  130   1HB   TYR  20          2HB       TYR  20  -2.502  -6.098  -3.090
  131   2HB   TYR  20          1HB       TYR  20  -3.972  -7.060  -3.104
  132    HD1  TYR  20           1HD      TYR  20  -6.013  -6.185  -4.010
  133    HD2  TYR  20           2HD      TYR  20  -2.558  -3.720  -3.733
  134    HE1  TYR  20           1HE      TYR  20  -7.072  -4.545  -5.504
  135    HE2  TYR  20           2HE      TYR  20  -3.610  -2.069  -5.220
  136    HH   TYR  20           HH       TYR  20  -5.404  -1.535  -6.401
  137    H    GLY  21           H        GLY  21  -1.364  -6.566  -1.228
  138   1HA   GLY  21          2HA       GLY  21  -1.438  -8.241   1.041
  139   2HA   GLY  21          1HA       GLY  21  -1.526  -9.210  -0.430
  Start of MODEL    3
    1   2H    GLY   1           HN2      GLY   1  -7.082  -1.080  -0.008
    2   1HA   GLY   1          2HA       GLY   1  -9.075  -1.801   0.966
    3   2HA   GLY   1          1HA       GLY   1  -8.884  -3.347   0.159
    4    H    GLY   2           H        GLY   2  -6.371  -4.122   1.088
    5   1HA   GLY   2          2HA       GLY   2  -6.994  -4.524   3.944
    6   2HA   GLY   2          1HA       GLY   2  -6.112  -5.663   2.937
    7    H    ALA   3           H        ALA   3  -4.162  -5.816   3.866
    8    HA   ALA   3           HA       ALA   3  -2.528  -3.406   3.965
    9   1HB   ALA   3          1HB       ALA   3  -2.837  -3.236   6.180
   10   2HB   ALA   3          2HB       ALA   3  -1.714  -4.593   6.276
   11   3HB   ALA   3          3HB       ALA   3  -3.454  -4.883   6.320
   12    H    GLY   4           H        GLY   4  -2.335  -5.300   2.061
   13   1HA   GLY   4          2HA       GLY   4  -0.401  -7.320   2.748
   14   2HA   GLY   4          1HA       GLY   4  -1.017  -6.964   1.143
   15    H    HIS   5           H        HIS   5   0.605  -6.476  -0.184
   16    HA   HIS   5           HA       HIS   5   2.845  -4.903   0.912
   17   1HB   HIS   5          2HB       HIS   5   2.816  -6.782  -1.456
   18   2HB   HIS   5          1HB       HIS   5   4.211  -5.860  -0.907
   19    HD1  HIS   5           1HD      HIS   5   1.885  -8.618   0.319
   20    HD2  HIS   5           2HD      HIS   5   5.706  -7.094   1.007
   21    HE1  HIS   5           1HE      HIS   5   2.970 -10.196   1.947
   22    HE2  HIS   5           2HE      HIS   5   5.212  -9.171   2.466
   23    H    VAL   6           H        VAL   6   0.801  -5.242  -1.998
   24    HA   VAL   6           HA       VAL   6   1.877  -2.738  -3.027
   25    HB   VAL   6           HB       VAL   6   0.225  -3.179  -4.937
   26   1HG1  VAL   6          1HG1      VAL   6   2.803  -3.932  -4.523
   27   2HG1  VAL   6          2HG1      VAL   6   1.932  -4.138  -6.043
   28   3HG1  VAL   6          3HG1      VAL   6   2.047  -5.480  -4.904
   29   1HG2  VAL   6          1HG2      VAL   6   0.212  -5.977  -3.834
   30   2HG2  VAL   6          2HG2      VAL   6  -0.718  -5.324  -5.184
   31   3HG2  VAL   6          3HG2      VAL   6  -1.103  -4.840  -3.532
   32    HA   PRO   7           HA       PRO   7  -1.159  -0.305  -0.899
   33   1HB   PRO   7          2HB       PRO   7  -0.444   1.671  -2.993
   34   2HB   PRO   7          1HB       PRO   7  -0.434   1.833  -1.234
   35   1HG   PRO   7          2HG       PRO   7   1.843   1.582  -2.587
   36   2HG   PRO   7          1HG       PRO   7   1.623   0.784  -1.018
   37   1HD   PRO   7          2HD       PRO   7   1.510  -0.381  -3.771
   38   2HD   PRO   7          1HD       PRO   7   2.200  -1.065  -2.284
   39    H    GLU   8           H        GLU   8  -3.253   0.100  -1.083
   40    HA   GLU   8           HA       GLU   8  -4.578  -0.401  -3.640
   41   1HB   GLU   8          2HB       GLU   8  -5.594  -0.240  -0.800
   42   2HB   GLU   8          1HB       GLU   8  -6.663  -0.365  -2.186
   43   1HG   GLU   8          2HG       GLU   8  -5.602  -2.498  -2.780
   44   2HG   GLU   8          1HG       GLU   8  -4.597  -2.374  -1.339
   45    H    TYR   9           H        TYR   9  -5.355   1.750  -0.921
   46    HA   TYR   9           HA       TYR   9  -5.992   3.859  -2.869
   47   1HB   TYR   9          2HB       TYR   9  -6.983   3.487  -0.034
   48   2HB   TYR   9          1HB       TYR   9  -7.400   4.841  -1.074
   49    HD1  TYR   9           1HD      TYR   9  -9.327   4.730  -2.354
   50    HD2  TYR   9           2HD      TYR   9  -7.572   1.108  -0.974
   51    HE1  TYR   9           1HE      TYR   9 -11.249   3.470  -3.228
   52    HE2  TYR   9           2HE      TYR   9  -9.485  -0.159  -1.849
   53    HH   TYR   9           HH       TYR   9 -11.548   0.900  -4.042
   54    H    PHE  10           H        PHE  10  -5.231   5.932  -2.581
   55    HA   PHE  10           HA       PHE  10  -3.157   6.269  -0.519
   56   1HB   PHE  10          2HB       PHE  10  -3.076   7.573  -3.236
   57   2HB   PHE  10          1HB       PHE  10  -1.809   7.544  -2.027
   58    HD1  PHE  10           1HD      PHE  10  -3.774   5.222  -4.196
   59    HD2  PHE  10           2HD      PHE  10  -0.082   6.056  -2.251
   60    HE1  PHE  10           1HE      PHE  10  -2.753   3.283  -5.312
   61    HE2  PHE  10           2HE      PHE  10   0.944   4.118  -3.360
   62    HZ   PHE  10           HZ       PHE  10  -0.390   2.729  -4.896
   63    H    VAL  11           H        VAL  11  -3.087   8.201   0.510
   64    HA   VAL  11           HA       VAL  11  -5.443   9.866   0.393
   65    HB   VAL  11           HB       VAL  11  -2.913  10.280   2.018
   66   1HG1  VAL  11          1HG1      VAL  11  -5.661  11.305   2.666
   67   2HG1  VAL  11          2HG1      VAL  11  -4.524  12.229   1.685
   68   3HG1  VAL  11          3HG1      VAL  11  -4.111  11.801   3.345
   69   1HG2  VAL  11          1HG2      VAL  11  -5.475   9.000   2.942
   70   2HG2  VAL  11          2HG2      VAL  11  -3.963   9.154   3.834
   71   3HG2  VAL  11          3HG2      VAL  11  -4.053   8.092   2.430
   72    H    GLY  12           H        GLY  12  -5.346  12.179  -0.030
   73   1HA   GLY  12          2HA       GLY  12  -4.156  12.902  -2.398
   74   2HA   GLY  12          1HA       GLY  12  -4.707  14.050  -1.197
   75    H    ILE  13           H        ILE  13  -2.765  13.076   0.788
   76    HA   ILE  13           HA       ILE  13  -0.526  14.674  -0.095
   77    HB   ILE  13           HB       ILE  13   0.345  14.328   2.216
   78   1HG1  ILE  13          2HG1      ILE  13  -2.295  12.903   2.640
   79   2HG1  ILE  13          1HG1      ILE  13  -0.717  12.122   2.608
   80   1HG2  ILE  13          1HG2      ILE  13  -0.915  16.030   3.019
   81   2HG2  ILE  13          2HG2      ILE  13  -2.441  15.248   2.602
   82   3HG2  ILE  13          3HG2      ILE  13  -1.493  16.059   1.354
   83   1HD1  ILE  13          1HD1      ILE  13  -1.545  12.456   4.881
   84   2HD1  ILE  13          2HD1      ILE  13  -1.589  14.197   4.604
   85   3HD1  ILE  13          3HD1      ILE  13  -0.047  13.342   4.589
   86    H    GLY  14           H        GLY  14  -0.943  12.110  -1.372
   87   1HA   GLY  14          2HA       GLY  14   0.264  10.312  -2.127
   88   2HA   GLY  14          1HA       GLY  14   1.675  11.243  -1.660
   89    H    THR  15           H        THR  15  -0.895   9.636   0.239
   90    HA   THR  15           HA       THR  15   1.211   7.988   1.469
   91    HB   THR  15           HB       THR  15  -1.019   9.275   3.050
   92    HG1  THR  15           1HG      THR  15   1.287  10.359   2.141
   93   1HG2  THR  15          1HG2      THR  15   0.710   7.146   3.627
   94   2HG2  THR  15          2HG2      THR  15  -0.319   8.024   4.759
   95   3HG2  THR  15          3HG2      THR  15   1.352   8.531   4.510
   96    HA   PRO  16           HA       PRO  16  -1.944   4.940   0.445
   97   1HB   PRO  16          2HB       PRO  16  -0.027   2.925   1.236
   98   2HB   PRO  16          1HB       PRO  16  -0.592   3.327  -0.386
   99   1HG   PRO  16          2HG       PRO  16   1.958   3.783   0.493
  100   2HG   PRO  16          1HG       PRO  16   1.173   4.719  -0.791
  101   1HD   PRO  16          2HD       PRO  16   1.563   5.412   2.095
  102   2HD   PRO  16          1HD       PRO  16   1.695   6.449   0.658
  103    H    ILE  17           H        ILE  17  -3.501   4.175   1.773
  104    HA   ILE  17           HA       ILE  17  -2.723   3.451   4.518
  105    HB   ILE  17           HB       ILE  17  -4.838   4.273   5.385
  106   1HG1  ILE  17          2HG1      ILE  17  -6.153   3.961   3.255
  107   2HG1  ILE  17          1HG1      ILE  17  -6.465   5.466   4.106
  108   1HG2  ILE  17          1HG2      ILE  17  -3.431   5.978   5.744
  109   2HG2  ILE  17          2HG2      ILE  17  -4.426   6.798   4.541
  110   3HG2  ILE  17          3HG2      ILE  17  -2.906   6.043   4.061
  111   1HD1  ILE  17          1HD1      ILE  17  -5.514   6.743   2.464
  112   2HD1  ILE  17          2HD1      ILE  17  -6.178   5.415   1.513
  113   3HD1  ILE  17          3HD1      ILE  17  -4.459   5.443   1.908
  114    H    SER  18           H        SER  18  -2.916   1.753   2.284
  115    HA   SER  18           HA       SER  18  -4.266  -0.433   3.351
  116   1HB   SER  18          2HB       SER  18  -6.065  -0.665   1.564
  117   2HB   SER  18          1HB       SER  18  -6.371   0.563   2.792
  118    HG   SER  18           HG       SER  18  -5.910   2.137   1.357
  119    H    PHE  19           H        PHE  19  -3.976  -2.340   2.047
  120    HA   PHE  19           HA       PHE  19  -2.532  -1.997  -0.473
  121   1HB   PHE  19          2HB       PHE  19  -1.398  -3.821   1.641
  122   2HB   PHE  19          1HB       PHE  19  -0.676  -3.365   0.115
  123    HD1  PHE  19           1HD      PHE  19   0.824  -1.609  -0.015
  124    HD2  PHE  19           2HD      PHE  19  -1.635  -1.982   3.435
  125    HE1  PHE  19           1HE      PHE  19   2.125   0.154   1.099
  126    HE2  PHE  19           2HE      PHE  19  -0.346  -0.212   4.552
  127    HZ   PHE  19           HZ       PHE  19   1.539   0.859   3.384
  128    H    TYR  20           H        TYR  20  -2.193  -4.188  -1.516
  129    HA   TYR  20           HA       TYR  20  -4.660  -5.720  -1.222
  130   1HB   TYR  20          2HB       TYR  20  -2.476  -5.891  -3.316
  131   2HB   TYR  20          1HB       TYR  20  -3.946  -6.853  -3.322
  132    HD1  TYR  20           1HD      TYR  20  -2.537  -3.503  -3.850
  133    HD2  TYR  20           2HD      TYR  20  -6.057  -5.888  -3.986
  134    HE1  TYR  20           1HE      TYR  20  -3.668  -1.748  -5.147
  135    HE2  TYR  20           2HE      TYR  20  -7.199  -4.138  -5.282
  136    HH   TYR  20           HH       TYR  20  -5.579  -1.071  -6.053
  137    H    GLY  21           H        GLY  21  -2.288  -7.617  -2.587
  138   1HA   GLY  21          2HA       GLY  21  -2.117  -9.258  -0.176
  139   2HA   GLY  21          1HA       GLY  21  -1.679  -9.754  -1.809
  Start of MODEL    4
    1   2H    GLY   1           HN2      GLY   1  -7.405  -1.044  -0.144
    2   1HA   GLY   1          2HA       GLY   1  -9.170  -1.625   1.199
    3   2HA   GLY   1          1HA       GLY   1  -9.488  -2.926   0.063
    4    H    GLY   2           H        GLY   2  -6.545  -2.516   1.966
    5   1HA   GLY   2          2HA       GLY   2  -7.172  -4.151   4.126
    6   2HA   GLY   2          1HA       GLY   2  -6.562  -5.196   2.850
    7    H    ALA   3           H        ALA   3  -4.615  -5.772   3.659
    8    HA   ALA   3           HA       ALA   3  -2.604  -3.663   3.843
    9   1HB   ALA   3          1HB       ALA   3  -2.227  -5.671   5.921
   10   2HB   ALA   3          2HB       ALA   3  -3.686  -4.707   6.148
   11   3HB   ALA   3          3HB       ALA   3  -2.117  -3.913   6.012
   12    H    GLY   4           H        GLY   4  -0.610  -4.296   3.132
   13   1HA   GLY   4          2HA       GLY   4   0.399  -6.882   2.994
   14   2HA   GLY   4          1HA       GLY   4  -0.463  -6.588   1.490
   15    H    HIS   5           H        HIS   5   0.980  -6.176  -0.055
   16    HA   HIS   5           HA       HIS   5   3.224  -4.382   0.604
   17   1HB   HIS   5          2HB       HIS   5   3.095  -6.502  -1.551
   18   2HB   HIS   5          1HB       HIS   5   4.469  -5.452  -1.226
   19    HD1  HIS   5           1HD      HIS   5   2.497  -8.280   0.372
   20    HD2  HIS   5           2HD      HIS   5   6.191  -6.369   0.690
   21    HE1  HIS   5           1HE      HIS   5   3.830  -9.631   2.024
   22    HE2  HIS   5           2HE      HIS   5   6.003  -8.386   2.297
   23    H    VAL   6           H        VAL   6   0.853  -5.215  -1.932
   24    HA   VAL   6           HA       VAL   6   1.593  -2.804  -3.398
   25    HB   VAL   6           HB       VAL   6  -0.265  -3.591  -4.984
   26   1HG1  VAL   6          1HG1      VAL   6   1.216  -5.152  -6.078
   27   2HG1  VAL   6          2HG1      VAL   6   2.104  -5.413  -4.577
   28   3HG1  VAL   6          3HG1      VAL   6   2.166  -3.842  -5.376
   29   1HG2  VAL   6          1HG2      VAL   6  -0.427  -6.210  -4.726
   30   2HG2  VAL   6          2HG2      VAL   6  -1.556  -5.141  -3.893
   31   3HG2  VAL   6          3HG2      VAL   6  -0.187  -5.830  -3.020
   32    HA   PRO   7           HA       PRO   7  -1.386  -0.446  -1.084
   33   1HB   PRO   7          2HB       PRO   7  -0.805   1.583  -3.146
   34   2HB   PRO   7          1HB       PRO   7  -0.637   1.677  -1.391
   35   1HG   PRO   7          2HG       PRO   7   1.505   1.493  -2.979
   36   2HG   PRO   7          1HG       PRO   7   1.450   0.680  -1.403
   37   1HD   PRO   7          2HD       PRO   7   1.062  -0.465  -4.143
   38   2HD   PRO   7          1HD       PRO   7   1.936  -1.141  -2.751
   39    H    GLU   8           H        GLU   8  -3.489  -0.055  -1.219
   40    HA   GLU   8           HA       GLU   8  -4.872  -0.600  -3.731
   41   1HB   GLU   8          2HB       GLU   8  -5.803  -0.328  -0.873
   42   2HB   GLU   8          1HB       GLU   8  -6.928  -0.418  -2.220
   43   1HG   GLU   8          2HG       GLU   8  -5.974  -2.608  -2.824
   44   2HG   GLU   8          1HG       GLU   8  -4.936  -2.515  -1.402
   45    H    TYR   9           H        TYR   9  -5.547   1.688  -1.095
   46    HA   TYR   9           HA       TYR   9  -6.077   3.746  -3.135
   47   1HB   TYR   9          2HB       TYR   9  -7.229   3.531  -0.346
   48   2HB   TYR   9          1HB       TYR   9  -7.585   4.803  -1.504
   49    HD1  TYR   9           1HD      TYR   9  -9.375   4.577  -2.977
   50    HD2  TYR   9           2HD      TYR   9  -7.856   1.114  -1.026
   51    HE1  TYR   9           1HE      TYR   9 -11.260   3.261  -3.853
   52    HE2  TYR   9           2HE      TYR   9  -9.732  -0.210  -1.902
   53    HH   TYR   9           HH       TYR   9 -11.607   0.667  -4.377
   54    H    PHE  10           H        PHE  10  -5.156   5.718  -2.941
   55    HA   PHE  10           HA       PHE  10  -3.152   6.020  -0.811
   56   1HB   PHE  10          2HB       PHE  10  -3.162   7.396  -3.498
   57   2HB   PHE  10          1HB       PHE  10  -1.888   7.450  -2.297
   58    HD1  PHE  10           1HD      PHE  10  -0.054   6.127  -2.603
   59    HD2  PHE  10           2HD      PHE  10  -3.747   4.937  -4.352
   60    HE1  PHE  10           1HE      PHE  10   1.080   4.251  -3.715
   61    HE2  PHE  10           2HE      PHE  10  -2.619   3.053  -5.460
   62    HZ   PHE  10           HZ       PHE  10  -0.203   2.709  -5.143
   63    H    VAL  11           H        VAL  11  -3.011   7.919   0.282
   64    HA   VAL  11           HA       VAL  11  -5.391   9.586   0.282
   65    HB   VAL  11           HB       VAL  11  -2.931   9.763   2.046
   66   1HG1  VAL  11          1HG1      VAL  11  -4.537  11.772   1.801
   67   2HG1  VAL  11          2HG1      VAL  11  -4.087  11.237   3.420
   68   3HG1  VAL  11          3HG1      VAL  11  -5.656  10.789   2.747
   69   1HG2  VAL  11          1HG2      VAL  11  -3.853   8.300   3.533
   70   2HG2  VAL  11          2HG2      VAL  11  -4.474   7.621   2.028
   71   3HG2  VAL  11          3HG2      VAL  11  -5.505   8.649   3.024
   72    H    GLY  12           H        GLY  12  -5.305  11.873  -0.007
   73   1HA   GLY  12          2HA       GLY  12  -3.882  12.788  -2.187
   74   2HA   GLY  12          1HA       GLY  12  -4.639  13.830  -1.000
   75    H    ILE  13           H        ILE  13  -2.830  12.632   1.098
   76    HA   ILE  13           HA       ILE  13  -0.670  14.513   0.740
   77    HB   ILE  13           HB       ILE  13  -0.861  12.595   3.048
   78   1HG1  ILE  13          2HG1      ILE  13  -2.386  15.199   2.783
   79   2HG1  ILE  13          1HG1      ILE  13  -3.112  13.599   2.684
   80   1HG2  ILE  13          1HG2      ILE  13   0.600  15.034   2.400
   81   2HG2  ILE  13          2HG2      ILE  13   0.941  13.800   3.611
   82   3HG2  ILE  13          3HG2      ILE  13  -0.191  15.101   3.974
   83   1HD1  ILE  13          1HD1      ILE  13  -2.131  15.101   5.035
   84   2HD1  ILE  13          2HD1      ILE  13  -1.942  13.347   5.051
   85   3HD1  ILE  13          3HD1      ILE  13  -3.544  14.060   4.856
   86    H    GLY  14           H        GLY  14  -0.743  12.290  -1.068
   87   1HA   GLY  14          2HA       GLY  14   0.617  10.721  -2.038
   88   2HA   GLY  14          1HA       GLY  14   1.918  11.651  -1.325
   89    H    THR  15           H        THR  15  -0.573   9.553   0.165
   90    HA   THR  15           HA       THR  15   1.490   7.640   0.865
   91    HB   THR  15           HB       THR  15   1.724   9.216   2.687
   92    HG1  THR  15           1HG      THR  15   1.897   7.583   4.000
   93   1HG2  THR  15          1HG2      THR  15  -0.194  10.445   2.951
   94   2HG2  THR  15          2HG2      THR  15  -0.372   9.309   4.288
   95   3HG2  THR  15          3HG2      THR  15  -1.249   9.042   2.783
   96    HA   PRO  16           HA       PRO  16  -2.149   5.121   0.369
   97   1HB   PRO  16          2HB       PRO  16  -0.920   2.741   0.322
   98   2HB   PRO  16          1HB       PRO  16  -0.767   3.890  -1.011
   99   1HG   PRO  16          2HG       PRO  16   1.178   3.205   1.130
  100   2HG   PRO  16          1HG       PRO  16   1.474   3.663  -0.554
  101   1HD   PRO  16          2HD       PRO  16   1.667   5.346   1.687
  102   2HD   PRO  16          1HD       PRO  16   1.632   5.858  -0.009
  103    H    ILE  17           H        ILE  17  -3.578   4.397   1.842
  104    HA   ILE  17           HA       ILE  17  -2.523   3.408   4.408
  105    HB   ILE  17           HB       ILE  17  -4.690   4.124   5.421
  106   1HG1  ILE  17          2HG1      ILE  17  -5.072   5.638   2.828
  107   2HG1  ILE  17          1HG1      ILE  17  -5.957   4.178   3.260
  108   1HG2  ILE  17          1HG2      ILE  17  -3.755   6.071   6.014
  109   2HG2  ILE  17          2HG2      ILE  17  -3.670   6.650   4.351
  110   3HG2  ILE  17          3HG2      ILE  17  -2.426   5.566   4.971
  111   1HD1  ILE  17          1HD1      ILE  17  -7.023   6.507   3.650
  112   2HD1  ILE  17          2HD1      ILE  17  -6.001   6.534   5.087
  113   3HD1  ILE  17          3HD1      ILE  17  -7.193   5.252   4.877
  114    H    SER  18           H        SER  18  -2.901   1.796   2.148
  115    HA   SER  18           HA       SER  18  -4.284  -0.376   3.258
  116   1HB   SER  18          2HB       SER  18  -6.113  -0.544   1.515
  117   2HB   SER  18          1HB       SER  18  -6.344   0.726   2.712
  118    HG   SER  18           HG       SER  18  -5.489   2.205   1.167
  119    H    PHE  19           H        PHE  19  -3.983  -2.275   2.063
  120    HA   PHE  19           HA       PHE  19  -2.625  -2.054  -0.523
  121   1HB   PHE  19          2HB       PHE  19  -1.513  -3.846   1.634
  122   2HB   PHE  19          1HB       PHE  19  -0.801  -3.465   0.078
  123    HD1  PHE  19           1HD      PHE  19  -1.576  -2.073   3.419
  124    HD2  PHE  19           2HD      PHE  19   0.628  -1.623  -0.194
  125    HE1  PHE  19           1HE      PHE  19  -0.249  -0.280   4.456
  126    HE2  PHE  19           2HE      PHE  19   1.959   0.170   0.837
  127    HZ   PHE  19           HZ       PHE  19   1.521   0.843   3.164
  128    H    TYR  20           H        TYR  20  -2.302  -4.404  -1.414
  129    HA   TYR  20           HA       TYR  20  -4.876  -5.763  -1.029
  130   1HB   TYR  20          2HB       TYR  20  -2.754  -6.147  -3.151
  131   2HB   TYR  20          1HB       TYR  20  -4.258  -7.047  -3.071
  132    HD1  TYR  20           1HD      TYR  20  -2.761  -3.752  -3.749
  133    HD2  TYR  20           2HD      TYR  20  -6.317  -6.083  -3.827
  134    HE1  TYR  20           1HE      TYR  20  -3.848  -2.035  -5.133
  135    HE2  TYR  20           2HE      TYR  20  -7.416  -4.371  -5.210
  136    HH   TYR  20           HH       TYR  20  -5.707  -1.398  -6.152
  137    H    GLY  21           H        GLY  21  -1.483  -6.618  -1.418
  138   1HA   GLY  21          2HA       GLY  21  -1.410  -8.362   0.812
  139   2HA   GLY  21          1HA       GLY  21  -1.560  -9.271  -0.692
  Start of MODEL    5
    1   2H    GLY   1           HN2      GLY   1  -7.123  -0.741  -0.192
    2   1HA   GLY   1          2HA       GLY   1  -9.190  -1.368   0.683
    3   2HA   GLY   1          1HA       GLY   1  -8.834  -3.036   0.268
    4    H    GLY   2           H        GLY   2  -6.432  -3.412   1.632
    5   1HA   GLY   2          2HA       GLY   2  -6.990  -2.706   4.419
    6   2HA   GLY   2          1HA       GLY   2  -6.987  -4.412   4.000
    7    H    ALA   3           H        ALA   3  -5.152  -5.412   4.396
    8    HA   ALA   3           HA       ALA   3  -2.649  -3.864   4.266
    9   1HB   ALA   3          1HB       ALA   3  -3.691  -5.039   6.507
   10   2HB   ALA   3          2HB       ALA   3  -1.988  -4.653   6.258
   11   3HB   ALA   3          3HB       ALA   3  -2.585  -6.278   5.918
   12    H    GLY   4           H        GLY   4  -0.871  -4.827   3.318
   13   1HA   GLY   4          2HA       GLY   4  -0.687  -7.513   2.523
   14   2HA   GLY   4          1HA       GLY   4  -1.339  -6.575   1.184
   15    H    HIS   5           H        HIS   5   0.287  -6.328  -0.241
   16    HA   HIS   5           HA       HIS   5   2.840  -5.297   0.835
   17   1HB   HIS   5          2HB       HIS   5   2.747  -6.855  -1.732
   18   2HB   HIS   5          1HB       HIS   5   4.118  -6.548  -0.675
   19    HD1  HIS   5           1HD      HIS   5   3.103  -7.660   1.972
   20    HD2  HIS   5           2HD      HIS   5   2.471  -9.516  -1.683
   21    HE1  HIS   5           1HE      HIS   5   2.682 -10.079   2.510
   22    HE2  HIS   5           2HE      HIS   5   1.933 -11.057   0.311
   23    H    VAL   6           H        VAL   6   0.761  -5.444  -2.046
   24    HA   VAL   6           HA       VAL   6   2.003  -3.030  -3.102
   25    HB   VAL   6           HB       VAL   6  -0.257  -4.669  -4.268
   26   1HG1  VAL   6          1HG1      VAL   6   0.657  -2.134  -4.968
   27   2HG1  VAL   6          2HG1      VAL   6  -0.359  -3.201  -5.939
   28   3HG1  VAL   6          3HG1      VAL   6   1.394  -3.222  -6.145
   29   1HG2  VAL   6          1HG2      VAL   6   1.629  -5.443  -5.827
   30   2HG2  VAL   6          2HG2      VAL   6   1.550  -6.146  -4.212
   31   3HG2  VAL   6          3HG2      VAL   6   2.720  -4.875  -4.564
   32    HA   PRO   7           HA       PRO   7  -0.929  -0.364  -1.097
   33   1HB   PRO   7          2HB       PRO   7  -0.623   1.783  -2.798
   34   2HB   PRO   7          1HB       PRO   7   0.450   1.406  -1.445
   35   1HG   PRO   7          2HG       PRO   7   0.780   0.797  -4.354
   36   2HG   PRO   7          1HG       PRO   7   1.986   1.363  -3.183
   37   1HD   PRO   7          2HD       PRO   7   1.871  -1.204  -3.936
   38   2HD   PRO   7          1HD       PRO   7   2.267  -0.750  -2.266
   39    H    GLU   8           H        GLU   8  -3.033   0.012  -1.244
   40    HA   GLU   8           HA       GLU   8  -4.426  -0.692  -3.701
   41   1HB   GLU   8          2HB       GLU   8  -5.475   0.011  -0.953
   42   2HB   GLU   8          1HB       GLU   8  -6.472  -0.493  -2.308
   43   1HG   GLU   8          2HG       GLU   8  -5.207  -2.638  -2.337
   44   2HG   GLU   8          1HG       GLU   8  -4.414  -2.121  -0.851
   45    H    TYR   9           H        TYR   9  -5.113   1.850  -1.309
   46    HA   TYR   9           HA       TYR   9  -5.381   3.752  -3.543
   47   1HB   TYR   9          2HB       TYR   9  -7.128   3.544  -1.085
   48   2HB   TYR   9          1HB       TYR   9  -7.203   4.857  -2.250
   49    HD1  TYR   9           1HD      TYR   9  -8.606   4.696  -4.101
   50    HD2  TYR   9           2HD      TYR   9  -7.586   1.156  -1.975
   51    HE1  TYR   9           1HE      TYR   9 -10.240   3.432  -5.432
   52    HE2  TYR   9           2HE      TYR   9  -9.213  -0.120  -3.304
   53    HH   TYR   9           HH       TYR   9 -10.853   1.289  -6.047
   54    H    PHE  10           H        PHE  10  -4.680   5.804  -3.231
   55    HA   PHE  10           HA       PHE  10  -3.028   6.266  -0.847
   56   1HB   PHE  10          2HB       PHE  10  -2.930   7.676  -3.520
   57   2HB   PHE  10          1HB       PHE  10  -1.854   7.968  -2.169
   58    HD1  PHE  10           1HD      PHE  10  -2.997   4.957  -4.095
   59    HD2  PHE  10           2HD      PHE  10   0.249   7.176  -2.469
   60    HE1  PHE  10           1HE      PHE  10  -1.420   3.291  -4.979
   61    HE2  PHE  10           2HE      PHE  10   1.831   5.513  -3.349
   62    HZ   PHE  10           HZ       PHE  10   0.998   3.568  -4.608
   63    H    VAL  11           H        VAL  11  -3.183   8.245   0.245
   64    HA   VAL  11           HA       VAL  11  -5.791   9.527  -0.054
   65    HB   VAL  11           HB       VAL  11  -5.335  10.621   2.097
   66   1HG1  VAL  11          1HG1      VAL  11  -6.019   8.028   1.666
   67   2HG1  VAL  11          2HG1      VAL  11  -6.069   8.835   3.234
   68   3HG1  VAL  11          3HG1      VAL  11  -4.672   7.853   2.792
   69   1HG2  VAL  11          1HG2      VAL  11  -2.656   9.381   1.717
   70   2HG2  VAL  11          2HG2      VAL  11  -3.294   9.527   3.354
   71   3HG2  VAL  11          3HG2      VAL  11  -3.086  10.966   2.357
   72    H    GLY  12           H        GLY  12  -5.623  12.003   0.639
   73   1HA   GLY  12          2HA       GLY  12  -4.541  13.352  -1.553
   74   2HA   GLY  12          1HA       GLY  12  -5.114  14.116  -0.083
   75    H    ILE  13           H        ILE  13  -3.089  12.568   1.490
   76    HA   ILE  13           HA       ILE  13  -0.947  14.484   1.179
   77    HB   ILE  13           HB       ILE  13  -0.955  12.227   3.176
   78   1HG1  ILE  13          2HG1      ILE  13  -3.156  13.343   3.299
   79   2HG1  ILE  13          1HG1      ILE  13  -2.187  13.653   4.735
   80   1HG2  ILE  13          1HG2      ILE  13   1.041  13.780   2.812
   81   2HG2  ILE  13          2HG2      ILE  13   0.459  13.587   4.465
   82   3HG2  ILE  13          3HG2      ILE  13   0.046  15.036   3.549
   83   1HD1  ILE  13          1HD1      ILE  13  -3.520  15.577   3.617
   84   2HD1  ILE  13          2HD1      ILE  13  -2.165  15.614   2.488
   85   3HD1  ILE  13          3HD1      ILE  13  -1.886  15.872   4.211
   86    H    GLY  14           H        GLY  14  -1.314  12.539  -0.912
   87   1HA   GLY  14          2HA       GLY  14  -0.166  11.034  -2.219
   88   2HA   GLY  14          1HA       GLY  14   1.226  11.965  -1.700
   89    H    THR  15           H        THR  15  -0.847   9.780   0.185
   90    HA   THR  15           HA       THR  15   1.371   7.890   0.388
   91    HB   THR  15           HB       THR  15   0.586   7.871   2.972
   92    HG1  THR  15           1HG      THR  15   0.610  10.636   2.297
   93   1HG2  THR  15          1HG2      THR  15   2.586   9.472   3.336
   94   2HG2  THR  15          2HG2      THR  15   2.751   9.410   1.580
   95   3HG2  THR  15          3HG2      THR  15   2.872   7.929   2.532
   96    HA   PRO  16           HA       PRO  16  -2.116   5.159   0.204
   97   1HB   PRO  16          2HB       PRO  16  -0.771   2.839   0.149
   98   2HB   PRO  16          1HB       PRO  16  -0.764   3.955  -1.219
   99   1HG   PRO  16          2HG       PRO  16   1.344   3.430   0.810
  100   2HG   PRO  16          1HG       PRO  16   1.511   3.861  -0.899
  101   1HD   PRO  16          2HD       PRO  16   1.754   5.606   1.288
  102   2HD   PRO  16          1HD       PRO  16   1.579   6.074  -0.413
  103    H    ILE  17           H        ILE  17  -3.418   4.544   1.803
  104    HA   ILE  17           HA       ILE  17  -2.200   3.519   4.282
  105    HB   ILE  17           HB       ILE  17  -4.903   4.871   4.137
  106   1HG1  ILE  17          2HG1      ILE  17  -2.213   6.065   4.857
  107   2HG1  ILE  17          1HG1      ILE  17  -3.215   6.508   3.479
  108   1HG2  ILE  17          1HG2      ILE  17  -3.195   4.689   6.578
  109   2HG2  ILE  17          2HG2      ILE  17  -4.089   3.263   6.053
  110   3HG2  ILE  17          3HG2      ILE  17  -4.952   4.752   6.438
  111   1HD1  ILE  17          1HD1      ILE  17  -4.272   8.014   4.699
  112   2HD1  ILE  17          2HD1      ILE  17  -3.204   7.633   6.049
  113   3HD1  ILE  17          3HD1      ILE  17  -4.739   6.785   5.875
  114    H    SER  18           H        SER  18  -2.658   1.951   2.098
  115    HA   SER  18           HA       SER  18  -4.167  -0.165   3.184
  116   1HB   SER  18          2HB       SER  18  -5.837  -0.317   1.287
  117   2HB   SER  18          1HB       SER  18  -6.140   0.964   2.456
  118    HG   SER  18           HG       SER  18  -5.163   2.426   0.984
  119    H    PHE  19           H        PHE  19  -3.732  -2.079   2.151
  120    HA   PHE  19           HA       PHE  19  -2.283  -2.064  -0.383
  121   1HB   PHE  19          2HB       PHE  19  -1.123  -3.466   2.033
  122   2HB   PHE  19          1HB       PHE  19  -0.406  -3.330   0.443
  123    HD1  PHE  19           1HD      PHE  19   0.923  -1.471  -0.150
  124    HD2  PHE  19           2HD      PHE  19  -1.238  -1.461   3.516
  125    HE1  PHE  19           1HE      PHE  19   2.190   0.504   0.589
  126    HE2  PHE  19           2HE      PHE  19   0.018   0.520   4.256
  127    HZ   PHE  19           HZ       PHE  19   1.736   1.505   2.791
  128    H    TYR  20           H        TYR  20  -1.759  -4.455  -0.944
  129    HA   TYR  20           HA       TYR  20  -3.533  -6.398   0.228
  130   1HB   TYR  20          2HB       TYR  20  -4.544  -7.022  -2.010
  131   2HB   TYR  20          1HB       TYR  20  -5.173  -5.583  -1.244
  132    HD1  TYR  20           1HD      TYR  20  -6.003  -4.352  -3.045
  133    HD2  TYR  20           2HD      TYR  20  -2.061  -5.929  -3.284
  134    HE1  TYR  20           1HE      TYR  20  -5.631  -3.091  -5.122
  135    HE2  TYR  20           2HE      TYR  20  -1.679  -4.666  -5.357
  136    HH   TYR  20           HH       TYR  20  -3.122  -2.204  -6.300
  137    H    GLY  21           H        GLY  21  -3.410  -8.492  -0.961
  138   1HA   GLY  21          2HA       GLY  21  -2.200 -10.212  -1.917
  139   2HA   GLY  21          1HA       GLY  21  -1.071  -9.020  -2.543
  Start of MODEL    6
    1   2H    GLY   1           HN2      GLY   1  -7.346  -0.872  -0.349
    2   1HA   GLY   1          2HA       GLY   1  -9.122  -1.279   1.045
    3   2HA   GLY   1          1HA       GLY   1  -9.468  -2.677   0.040
    4    H    GLY   2           H        GLY   2  -6.534  -2.132   1.930
    5   1HA   GLY   2          2HA       GLY   2  -7.197  -3.527   4.234
    6   2HA   GLY   2          1HA       GLY   2  -6.627  -4.719   3.072
    7    H    ALA   3           H        ALA   3  -4.690  -5.271   3.905
    8    HA   ALA   3           HA       ALA   3  -2.620  -3.211   3.905
    9   1HB   ALA   3          1HB       ALA   3  -2.193  -5.042   6.103
   10   2HB   ALA   3          2HB       ALA   3  -3.705  -4.153   6.290
   11   3HB   ALA   3          3HB       ALA   3  -2.187  -3.278   6.092
   12    H    GLY   4           H        GLY   4  -0.641  -3.961   3.227
   13   1HA   GLY   4          2HA       GLY   4   0.262  -6.587   3.251
   14   2HA   GLY   4          1HA       GLY   4  -0.615  -6.367   1.745
   15    H    HIS   5           H        HIS   5   0.886  -6.245   0.201
   16    HA   HIS   5           HA       HIS   5   3.239  -4.529   0.658
   17   1HB   HIS   5          2HB       HIS   5   2.874  -6.661  -1.458
   18   2HB   HIS   5          1HB       HIS   5   4.360  -5.809  -1.067
   19    HD1  HIS   5           1HD      HIS   5   4.434  -8.806  -1.031
   20    HD2  HIS   5           2HD      HIS   5   3.421  -6.568   2.316
   21    HE1  HIS   5           1HE      HIS   5   4.905 -10.292   0.936
   22    HE2  HIS   5           2HE      HIS   5   4.036  -9.003   2.916
   23    H    VAL   6           H        VAL   6   0.820  -5.397  -1.825
   24    HA   VAL   6           HA       VAL   6   1.618  -3.086  -3.409
   25    HB   VAL   6           HB       VAL   6  -0.237  -3.923  -4.968
   26   1HG1  VAL   6          1HG1      VAL   6   2.440  -4.659  -4.626
   27   2HG1  VAL   6          2HG1      VAL   6   1.466  -4.808  -6.090
   28   3HG1  VAL   6          3HG1      VAL   6   1.574  -6.158  -4.960
   29   1HG2  VAL   6          1HG2      VAL   6  -0.165  -6.122  -2.933
   30   2HG2  VAL   6          2HG2      VAL   6  -0.574  -6.462  -4.614
   31   3HG2  VAL   6          3HG2      VAL   6  -1.559  -5.339  -3.676
   32    HA   PRO   7           HA       PRO   7  -1.324  -0.480  -1.350
   33   1HB   PRO   7          2HB       PRO   7  -0.739   1.332  -3.603
   34   2HB   PRO   7          1HB       PRO   7  -0.539   1.588  -1.868
   35   1HG   PRO   7          2HG       PRO   7   1.570   1.219  -3.474
   36   2HG   PRO   7          1HG       PRO   7   1.537   0.573  -1.822
   37   1HD   PRO   7          2HD       PRO   7   1.087  -0.844  -4.420
   38   2HD   PRO   7          1HD       PRO   7   1.973  -1.383  -2.978
   39    H    GLU   8           H        GLU   8  -3.425  -0.096  -1.509
   40    HA   GLU   8           HA       GLU   8  -4.826  -0.816  -3.969
   41   1HB   GLU   8          2HB       GLU   8  -5.773  -0.253  -1.155
   42   2HB   GLU   8          1HB       GLU   8  -6.874  -0.502  -2.499
   43   1HG   GLU   8          2HG       GLU   8  -5.914  -2.745  -2.827
   44   2HG   GLU   8          1HG       GLU   8  -4.896  -2.485  -1.410
   45    H    TYR   9           H        TYR   9  -5.312   1.694  -1.503
   46    HA   TYR   9           HA       TYR   9  -5.597   3.683  -3.651
   47   1HB   TYR   9          2HB       TYR   9  -7.324   3.452  -1.178
   48   2HB   TYR   9          1HB       TYR   9  -7.374   4.790  -2.314
   49    HD1  TYR   9           1HD      TYR   9  -8.742   4.694  -4.210
   50    HD2  TYR   9           2HD      TYR   9  -7.932   1.119  -2.048
   51    HE1  TYR   9           1HE      TYR   9 -10.432   3.509  -5.545
   52    HE2  TYR   9           2HE      TYR   9  -9.616  -0.076  -3.382
   53    HH   TYR   9           HH       TYR   9 -10.629   0.386  -5.908
   54    H    PHE  10           H        PHE  10  -4.769   5.685  -3.230
   55    HA   PHE  10           HA       PHE  10  -3.002   5.846  -0.906
   56   1HB   PHE  10          2HB       PHE  10  -3.079   7.520  -3.419
   57   2HB   PHE  10          1HB       PHE  10  -1.946   7.747  -2.103
   58    HD1  PHE  10           1HD      PHE  10  -3.117   4.814  -4.125
   59    HD2  PHE  10           2HD      PHE  10   0.161   7.053  -2.592
   60    HE1  PHE  10           1HE      PHE  10  -1.553   3.236  -5.177
   61    HE2  PHE  10           2HE      PHE  10   1.730   5.478  -3.642
   62    HZ   PHE  10           HZ       PHE  10   0.875   3.567  -4.936
   63    H    VAL  11           H        VAL  11  -2.941   7.673   0.398
   64    HA   VAL  11           HA       VAL  11  -5.513   9.003   0.686
   65    HB   VAL  11           HB       VAL  11  -4.255   7.978   2.645
   66   1HG1  VAL  11          1HG1      VAL  11  -2.698  10.302   3.254
   67   2HG1  VAL  11          2HG1      VAL  11  -2.180   9.605   1.719
   68   3HG1  VAL  11          3HG1      VAL  11  -2.206   8.610   3.175
   69   1HG2  VAL  11          1HG2      VAL  11  -4.966   9.658   4.206
   70   2HG2  VAL  11          2HG2      VAL  11  -6.128   9.577   2.881
   71   3HG2  VAL  11          3HG2      VAL  11  -4.953  10.891   2.945
   72    H    GLY  12           H        GLY  12  -5.454  11.388   1.198
   73   1HA   GLY  12          2HA       GLY  12  -4.498  12.844  -0.957
   74   2HA   GLY  12          1HA       GLY  12  -5.024  13.546   0.559
   75    H    ILE  13           H        ILE  13  -2.820  11.999   1.941
   76    HA   ILE  13           HA       ILE  13  -0.809  14.047   1.647
   77    HB   ILE  13           HB       ILE  13  -0.501  11.640   3.423
   78   1HG1  ILE  13          2HG1      ILE  13  -2.114  14.122   4.076
   79   2HG1  ILE  13          1HG1      ILE  13  -2.805  12.540   3.728
   80   1HG2  ILE  13          1HG2      ILE  13   1.328  13.342   3.139
   81   2HG2  ILE  13          2HG2      ILE  13   0.779  13.112   4.799
   82   3HG2  ILE  13          3HG2      ILE  13   0.253  14.523   3.883
   83   1HD1  ILE  13          1HD1      ILE  13  -0.797  12.680   5.892
   84   2HD1  ILE  13          2HD1      ILE  13  -2.263  11.709   5.759
   85   3HD1  ILE  13          3HD1      ILE  13  -2.372  13.414   6.196
   86    H    GLY  14           H        GLY  14  -1.170  12.314  -0.605
   87   1HA   GLY  14          2HA       GLY  14  -0.009  11.038  -2.125
   88   2HA   GLY  14          1HA       GLY  14   1.368  11.950  -1.538
   89    H    THR  15           H        THR  15  -0.558   9.472   0.132
   90    HA   THR  15           HA       THR  15   1.685   7.615  -0.016
   91    HB   THR  15           HB       THR  15   1.135   7.320   2.609
   92    HG1  THR  15           1HG      THR  15   1.056  10.141   2.215
   93   1HG2  THR  15          1HG2      THR  15   3.264   8.099   3.001
   94   2HG2  THR  15          2HG2      THR  15   3.083   9.467   1.903
   95   3HG2  THR  15          3HG2      THR  15   3.332   7.846   1.257
   96    HA   PRO  16           HA       PRO  16  -1.670   4.752  -0.397
   97   1HB   PRO  16          2HB       PRO  16  -0.357   2.459   0.313
   98   2HB   PRO  16          1HB       PRO  16  -0.204   3.224  -1.271
   99   1HG   PRO  16          2HG       PRO  16   1.624   3.369   1.090
  100   2HG   PRO  16          1HG       PRO  16   2.025   3.222  -0.632
  101   1HD   PRO  16          2HD       PRO  16   2.189   5.569   0.701
  102   2HD   PRO  16          1HD       PRO  16   1.752   5.479  -1.016
  103    H    ILE  17           H        ILE  17  -3.297   4.448   0.994
  104    HA   ILE  17           HA       ILE  17  -2.623   3.921   3.810
  105    HB   ILE  17           HB       ILE  17  -3.712   6.127   3.361
  106   1HG1  ILE  17          2HG1      ILE  17  -5.446   5.932   5.135
  107   2HG1  ILE  17          1HG1      ILE  17  -5.301   4.180   5.046
  108   1HG2  ILE  17          1HG2      ILE  17  -5.136   5.556   1.518
  109   2HG2  ILE  17          2HG2      ILE  17  -6.129   6.158   2.844
  110   3HG2  ILE  17          3HG2      ILE  17  -6.049   4.427   2.519
  111   1HD1  ILE  17          1HD1      ILE  17  -2.873   5.822   5.573
  112   2HD1  ILE  17          2HD1      ILE  17  -3.241   4.166   6.057
  113   3HD1  ILE  17          3HD1      ILE  17  -4.025   5.519   6.873
  114    H    SER  18           H        SER  18  -2.858   2.012   1.723
  115    HA   SER  18           HA       SER  18  -4.291  -0.011   2.982
  116   1HB   SER  18          2HB       SER  18  -6.107  -0.353   1.255
  117   2HB   SER  18          1HB       SER  18  -6.346   1.036   2.311
  118    HG   SER  18           HG       SER  18  -5.494   2.351   0.632
  119    H    PHE  19           H        PHE  19  -3.990  -2.023   1.964
  120    HA   PHE  19           HA       PHE  19  -2.624  -2.051  -0.624
  121   1HB   PHE  19          2HB       PHE  19  -1.491  -3.616   1.690
  122   2HB   PHE  19          1HB       PHE  19  -0.786  -3.375   0.105
  123    HD1  PHE  19           1HD      PHE  19  -1.577  -1.672   3.297
  124    HD2  PHE  19           2HD      PHE  19   0.645  -1.572  -0.331
  125    HE1  PHE  19           1HE      PHE  19  -0.257   0.214   4.163
  126    HE2  PHE  19           2HE      PHE  19   1.968   0.315   0.528
  127    HZ   PHE  19           HZ       PHE  19   1.518   1.211   2.777
  128    H    TYR  20           H        TYR  20  -2.285  -4.477  -1.277
  129    HA   TYR  20           HA       TYR  20  -4.842  -5.812  -0.729
  130   1HB   TYR  20          2HB       TYR  20  -2.753  -6.385  -2.841
  131   2HB   TYR  20          1HB       TYR  20  -4.259  -7.271  -2.655
  132    HD1  TYR  20           1HD      TYR  20  -2.770  -4.049  -3.649
  133    HD2  TYR  20           2HD      TYR  20  -6.326  -6.377  -3.467
  134    HE1  TYR  20           1HE      TYR  20  -3.880  -2.463  -5.165
  135    HE2  TYR  20           2HE      TYR  20  -7.446  -4.796  -4.982
  136    HH   TYR  20           HH       TYR  20  -5.732  -1.960  -6.267
  137    H    GLY  21           H        GLY  21  -1.455  -6.730  -1.119
  138   1HA   GLY  21          2HA       GLY  21  -1.299  -8.213   1.280
  139   2HA   GLY  21          1HA       GLY  21  -1.576  -9.294  -0.086
  Start of MODEL    7
    1   2H    GLY   1           HN2      GLY   1  -7.358  -0.993  -0.124
    2   1HA   GLY   1          2HA       GLY   1  -9.116  -1.550   1.241
    3   2HA   GLY   1          1HA       GLY   1  -9.477  -2.828   0.093
    4    H    GLY   2           H        GLY   2  -6.515  -2.501   1.986
    5   1HA   GLY   2          2HA       GLY   2  -7.171  -4.167   4.119
    6   2HA   GLY   2          1HA       GLY   2  -6.563  -5.193   2.826
    7    H    ALA   3           H        ALA   3  -4.624  -5.799   3.637
    8    HA   ALA   3           HA       ALA   3  -2.597  -3.712   3.865
    9   1HB   ALA   3          1HB       ALA   3  -2.981  -3.871   6.136
   10   2HB   ALA   3          2HB       ALA   3  -1.706  -5.068   5.910
   11   3HB   ALA   3          3HB       ALA   3  -3.387  -5.585   6.057
   12    H    GLY   4           H        GLY   4  -0.610  -4.350   3.148
   13   1HA   GLY   4          2HA       GLY   4   0.389  -6.939   2.986
   14   2HA   GLY   4          1HA       GLY   4  -0.473  -6.631   1.485
   15    H    HIS   5           H        HIS   5   0.979  -6.222  -0.053
   16    HA   HIS   5           HA       HIS   5   3.223  -4.432   0.616
   17   1HB   HIS   5          2HB       HIS   5   3.097  -6.542  -1.548
   18   2HB   HIS   5          1HB       HIS   5   4.472  -5.497  -1.213
   19    HD1  HIS   5           1HD      HIS   5   2.491  -8.330   0.364
   20    HD2  HIS   5           2HD      HIS   5   6.186  -6.424   0.705
   21    HE1  HIS   5           1HE      HIS   5   3.815  -9.692   2.014
   22    HE2  HIS   5           2HE      HIS   5   5.990  -8.452   2.300
   23    H    VAL   6           H        VAL   6   0.855  -5.256  -1.924
   24    HA   VAL   6           HA       VAL   6   1.598  -2.841  -3.384
   25    HB   VAL   6           HB       VAL   6  -0.257  -3.623  -4.974
   26   1HG1  VAL   6          1HG1      VAL   6   1.296  -5.637  -5.687
   27   2HG1  VAL   6          2HG1      VAL   6   2.361  -4.939  -4.465
   28   3HG1  VAL   6          3HG1      VAL   6   1.834  -3.964  -5.837
   29   1HG2  VAL   6          1HG2      VAL   6  -1.553  -5.155  -3.841
   30   2HG2  VAL   6          2HG2      VAL   6  -0.169  -5.890  -3.033
   31   3HG2  VAL   6          3HG2      VAL   6  -0.473  -6.222  -4.739
   32    HA   PRO   7           HA       PRO   7  -1.387  -0.496  -1.064
   33   1HB   PRO   7          2HB       PRO   7  -0.776   1.561  -3.086
   34   2HB   PRO   7          1HB       PRO   7  -0.612   1.622  -1.329
   35   1HG   PRO   7          2HG       PRO   7   1.532   1.449  -2.919
   36   2HG   PRO   7          1HG       PRO   7   1.469   0.616  -1.354
   37   1HD   PRO   7          2HD       PRO   7   1.079  -0.493  -4.109
   38   2HD   PRO   7          1HD       PRO   7   1.947  -1.188  -2.725
   39    H    GLU   8           H        GLU   8  -3.482  -0.061  -1.219
   40    HA   GLU   8           HA       GLU   8  -4.846  -0.585  -3.745
   41   1HB   GLU   8          2HB       GLU   8  -5.818  -0.278  -0.904
   42   2HB   GLU   8          1HB       GLU   8  -6.914  -0.403  -2.271
   43   1HG   GLU   8          2HG       GLU   8  -5.950  -2.601  -2.806
   44   2HG   GLU   8          1HG       GLU   8  -4.923  -2.471  -1.379
   45    H    TYR   9           H        TYR   9  -5.472   1.722  -1.110
   46    HA   TYR   9           HA       TYR   9  -5.946   3.791  -3.154
   47   1HB   TYR   9          2HB       TYR   9  -7.239   3.503  -0.435
   48   2HB   TYR   9          1HB       TYR   9  -7.495   4.850  -1.535
   49    HD1  TYR   9           1HD      TYR   9  -9.227   4.769  -3.083
   50    HD2  TYR   9           2HD      TYR   9  -7.866   1.143  -1.322
   51    HE1  TYR   9           1HE      TYR   9 -11.090   3.561  -4.140
   52    HE2  TYR   9           2HE      TYR   9  -9.723  -0.074  -2.379
   53    HH   TYR   9           HH       TYR   9 -11.292   0.696  -4.788
   54    H    PHE  10           H        PHE  10  -5.092   5.795  -2.864
   55    HA   PHE  10           HA       PHE  10  -3.150   6.069  -0.669
   56   1HB   PHE  10          2HB       PHE  10  -3.060   7.455  -3.352
   57   2HB   PHE  10          1HB       PHE  10  -1.837   7.524  -2.097
   58    HD1  PHE  10           1HD      PHE  10  -3.588   4.968  -4.200
   59    HD2  PHE  10           2HD      PHE  10   0.031   6.248  -2.362
   60    HE1  PHE  10           1HE      PHE  10  -2.392   3.099  -5.261
   61    HE2  PHE  10           2HE      PHE  10   1.232   4.380  -3.418
   62    HZ   PHE  10           HZ       PHE  10   0.021   2.804  -4.872
   63    H    VAL  11           H        VAL  11  -3.018   7.994   0.407
   64    HA   VAL  11           HA       VAL  11  -5.407   9.641   0.386
   65    HB   VAL  11           HB       VAL  11  -2.916   9.928   2.092
   66   1HG1  VAL  11          1HG1      VAL  11  -4.637  11.035   3.647
   67   2HG1  VAL  11          2HG1      VAL  11  -5.642  11.173   2.205
   68   3HG1  VAL  11          3HG1      VAL  11  -4.060  11.954   2.256
   69   1HG2  VAL  11          1HG2      VAL  11  -3.568   7.972   2.970
   70   2HG2  VAL  11          2HG2      VAL  11  -5.179   8.075   2.259
   71   3HG2  VAL  11          3HG2      VAL  11  -4.819   8.937   3.756
   72    H    GLY  12           H        GLY  12  -5.326  11.948   0.074
   73   1HA   GLY  12          2HA       GLY  12  -3.955  12.810  -2.171
   74   2HA   GLY  12          1HA       GLY  12  -4.687  13.877  -0.988
   75    H    ILE  13           H        ILE  13  -2.832  12.689   1.087
   76    HA   ILE  13           HA       ILE  13  -0.675  14.563   0.662
   77    HB   ILE  13           HB       ILE  13  -0.831  12.684   3.005
   78   1HG1  ILE  13          2HG1      ILE  13  -2.353  15.289   2.725
   79   2HG1  ILE  13          1HG1      ILE  13  -3.085  13.689   2.664
   80   1HG2  ILE  13          1HG2      ILE  13   0.002  15.576   2.926
   81   2HG2  ILE  13          2HG2      ILE  13   1.121  14.256   2.588
   82   3HG2  ILE  13          3HG2      ILE  13   0.347  14.372   4.167
   83   1HD1  ILE  13          1HD1      ILE  13  -1.760  15.023   5.006
   84   2HD1  ILE  13          2HD1      ILE  13  -2.198  13.314   4.981
   85   3HD1  ILE  13          3HD1      ILE  13  -3.450  14.547   4.835
   86    H    GLY  14           H        GLY  14  -0.802  12.295  -1.099
   87   1HA   GLY  14          2HA       GLY  14   0.534  10.704  -2.066
   88   2HA   GLY  14          1HA       GLY  14   1.853  11.648  -1.403
   89    H    THR  15           H        THR  15  -0.606   9.529   0.126
   90    HA   THR  15           HA       THR  15   1.500   7.677   0.861
   91    HB   THR  15           HB       THR  15   1.681   9.272   2.670
   92    HG1  THR  15           1HG      THR  15   1.867   7.669   4.021
   93   1HG2  THR  15          1HG2      THR  15  -1.237   9.230   2.549
   94   2HG2  THR  15          2HG2      THR  15  -0.147  10.472   3.165
   95   3HG2  THR  15          3HG2      THR  15  -0.602   9.110   4.190
   96    HA   PRO  16           HA       PRO  16  -2.030   5.030   0.268
   97   1HB   PRO  16          2HB       PRO  16  -0.757   2.677   0.491
   98   2HB   PRO  16          1HB       PRO  16  -0.538   3.728  -0.914
   99   1HG   PRO  16          2HG       PRO  16   1.246   3.315   1.444
  100   2HG   PRO  16          1HG       PRO  16   1.673   3.532  -0.263
  101   1HD   PRO  16          2HD       PRO  16   1.773   5.521   1.658
  102   2HD   PRO  16          1HD       PRO  16   1.653   5.806  -0.089
  103    H    ILE  17           H        ILE  17  -3.549   4.268   1.634
  104    HA   ILE  17           HA       ILE  17  -2.684   3.504   4.341
  105    HB   ILE  17           HB       ILE  17  -5.107   4.195   4.981
  106   1HG1  ILE  17          2HG1      ILE  17  -5.781   6.262   3.621
  107   2HG1  ILE  17          1HG1      ILE  17  -4.694   5.666   2.375
  108   1HG2  ILE  17          1HG2      ILE  17  -2.610   5.590   4.878
  109   2HG2  ILE  17          2HG2      ILE  17  -3.875   5.649   6.105
  110   3HG2  ILE  17          3HG2      ILE  17  -3.944   6.732   4.714
  111   1HD1  ILE  17          1HD1      ILE  17  -6.289   4.359   1.591
  112   2HD1  ILE  17          2HD1      ILE  17  -7.392   4.998   2.810
  113   3HD1  ILE  17          3HD1      ILE  17  -6.439   3.555   3.153
  114    H    SER  18           H        SER  18  -2.931   1.772   2.120
  115    HA   SER  18           HA       SER  18  -4.266  -0.390   3.272
  116   1HB   SER  18          2HB       SER  18  -6.113  -0.650   1.554
  117   2HB   SER  18          1HB       SER  18  -6.365   0.640   2.728
  118    HG   SER  18           HG       SER  18  -5.672   2.128   1.173
  119    H    PHE  19           H        PHE  19  -3.979  -2.315   2.074
  120    HA   PHE  19           HA       PHE  19  -2.615  -2.091  -0.509
  121   1HB   PHE  19          2HB       PHE  19  -1.515  -3.886   1.653
  122   2HB   PHE  19          1HB       PHE  19  -0.797  -3.508   0.098
  123    HD1  PHE  19           1HD      PHE  19  -1.590  -2.098   3.430
  124    HD2  PHE  19           2HD      PHE  19   0.649  -1.684  -0.166
  125    HE1  PHE  19           1HE      PHE  19  -0.261  -0.308   4.468
  126    HE2  PHE  19           2HE      PHE  19   1.981   0.107   0.868
  127    HZ   PHE  19           HZ       PHE  19   1.528   0.796   3.188
  128    H    TYR  20           H        TYR  20  -2.296  -4.443  -1.402
  129    HA   TYR  20           HA       TYR  20  -4.876  -5.794  -1.016
  130   1HB   TYR  20          2HB       TYR  20  -2.765  -6.164  -3.152
  131   2HB   TYR  20          1HB       TYR  20  -4.270  -7.067  -3.070
  132    HD1  TYR  20           1HD      TYR  20  -6.340  -6.091  -3.794
  133    HD2  TYR  20           2HD      TYR  20  -2.771  -3.775  -3.748
  134    HE1  TYR  20           1HE      TYR  20  -7.440  -4.380  -5.175
  135    HE2  TYR  20           2HE      TYR  20  -3.865  -2.053  -5.121
  136    HH   TYR  20           HH       TYR  20  -5.732  -1.407  -6.120
  137    H    GLY  21           H        GLY  21  -1.486  -6.654  -1.425
  138   1HA   GLY  21          2HA       GLY  21  -1.415  -8.416   0.793
  139   2HA   GLY  21          1HA       GLY  21  -1.562  -9.311  -0.721
  Start of MODEL    8
    1   2H    GLY   1           HN2      GLY   1  -7.299  -0.954  -0.534
    2   1HA   GLY   1          2HA       GLY   1  -9.173  -1.555   0.643
    3   2HA   GLY   1          1HA       GLY   1  -9.333  -2.904  -0.468
    4    H    GLY   2           H        GLY   2  -6.630  -2.296   1.727
    5   1HA   GLY   2          2HA       GLY   2  -7.389  -3.856   3.878
    6   2HA   GLY   2          1HA       GLY   2  -6.678  -4.957   2.707
    7    H    ALA   3           H        ALA   3  -4.765  -5.473   3.585
    8    HA   ALA   3           HA       ALA   3  -2.800  -3.338   3.881
    9   1HB   ALA   3          1HB       ALA   3  -2.033  -4.097   6.038
   10   2HB   ALA   3          2HB       ALA   3  -3.220  -5.401   6.045
   11   3HB   ALA   3          3HB       ALA   3  -3.753  -3.722   6.144
   12    H    GLY   4           H        GLY   4  -0.742  -3.980   3.309
   13   1HA   GLY   4          2HA       GLY   4   0.279  -6.553   3.283
   14   2HA   GLY   4          1HA       GLY   4  -0.531  -6.332   1.741
   15    H    HIS   5           H        HIS   5   1.033  -6.091   0.279
   16    HA   HIS   5           HA       HIS   5   3.282  -4.285   0.896
   17   1HB   HIS   5          2HB       HIS   5   3.133  -6.371  -1.292
   18   2HB   HIS   5          1HB       HIS   5   4.555  -5.479  -0.775
   19    HD1  HIS   5           1HD      HIS   5   4.705  -8.484  -0.836
   20    HD2  HIS   5           2HD      HIS   5   3.466  -6.373   2.518
   21    HE1  HIS   5           1HE      HIS   5   5.114 -10.017   1.109
   22    HE2  HIS   5           2HE      HIS   5   4.113  -8.811   3.078
   23    H    VAL   6           H        VAL   6   0.957  -5.166  -1.655
   24    HA   VAL   6           HA       VAL   6   1.779  -2.887  -3.268
   25    HB   VAL   6           HB       VAL   6  -0.471  -4.845  -3.773
   26   1HG1  VAL   6          1HG1      VAL   6  -0.205  -4.116  -6.126
   27   2HG1  VAL   6          2HG1      VAL   6   0.944  -2.891  -5.584
   28   3HG1  VAL   6          3HG1      VAL   6  -0.737  -2.821  -5.054
   29   1HG2  VAL   6          1HG2      VAL   6   0.963  -6.313  -4.716
   30   2HG2  VAL   6          2HG2      VAL   6   2.119  -5.557  -3.620
   31   3HG2  VAL   6          3HG2      VAL   6   2.041  -5.048  -5.306
   32    HA   PRO   7           HA       PRO   7  -1.163  -0.256  -1.167
   33   1HB   PRO   7          2HB       PRO   7  -0.821   1.890  -2.833
   34   2HB   PRO   7          1HB       PRO   7   0.260   1.488  -1.495
   35   1HG   PRO   7          2HG       PRO   7   0.559   0.907  -4.413
   36   2HG   PRO   7          1HG       PRO   7   1.777   1.464  -3.252
   37   1HD   PRO   7          2HD       PRO   7   1.628  -1.105  -4.028
   38   2HD   PRO   7          1HD       PRO   7   2.090  -0.652  -2.374
   39    H    GLU   8           H        GLU   8  -3.260   0.129  -1.375
   40    HA   GLU   8           HA       GLU   8  -4.566  -0.467  -3.924
   41   1HB   GLU   8          2HB       GLU   8  -5.595  -0.222  -1.099
   42   2HB   GLU   8          1HB       GLU   8  -6.668  -0.337  -2.483
   43   1HG   GLU   8          2HG       GLU   8  -5.607  -2.509  -3.045
   44   2HG   GLU   8          1HG       GLU   8  -4.688  -2.394  -1.544
   45    H    TYR   9           H        TYR   9  -5.331   1.789  -1.284
   46    HA   TYR   9           HA       TYR   9  -5.783   3.878  -3.314
   47   1HB   TYR   9          2HB       TYR   9  -7.197   3.526  -0.660
   48   2HB   TYR   9          1HB       TYR   9  -7.467   4.845  -1.791
   49    HD1  TYR   9           1HD      TYR   9  -7.704   1.136  -1.491
   50    HD2  TYR   9           2HD      TYR   9  -9.084   4.645  -3.458
   51    HE1  TYR   9           1HE      TYR   9  -9.447  -0.185  -2.612
   52    HE2  TYR   9           2HE      TYR   9 -10.832   3.334  -4.585
   53    HH   TYR   9           HH       TYR   9 -11.012   0.677  -5.229
   54    H    PHE  10           H        PHE  10  -5.011   5.906  -2.935
   55    HA   PHE  10           HA       PHE  10  -3.205   6.199  -0.626
   56   1HB   PHE  10          2HB       PHE  10  -3.027   7.843  -3.136
   57   2HB   PHE  10          1HB       PHE  10  -1.798   7.589  -1.913
   58    HD1  PHE  10           1HD      PHE  10  -3.675   5.820  -4.597
   59    HD2  PHE  10           2HD      PHE  10  -0.164   5.970  -2.197
   60    HE1  PHE  10           1HE      PHE  10  -2.676   4.028  -5.954
   61    HE2  PHE  10           2HE      PHE  10   0.840   4.179  -3.548
   62    HZ   PHE  10           HZ       PHE  10  -0.415   3.206  -5.430
   63    H    VAL  11           H        VAL  11  -3.462   7.941   0.682
   64    HA   VAL  11           HA       VAL  11  -5.271  10.101  -0.111
   65    HB   VAL  11           HB       VAL  11  -5.675   8.607   2.487
   66   1HG1  VAL  11          1HG1      VAL  11  -6.241  11.209   1.960
   67   2HG1  VAL  11          2HG1      VAL  11  -7.091  10.213   3.143
   68   3HG1  VAL  11          3HG1      VAL  11  -7.759  10.424   1.524
   69   1HG2  VAL  11          1HG2      VAL  11  -6.505   7.683   0.075
   70   2HG2  VAL  11          2HG2      VAL  11  -7.884   8.672   0.554
   71   3HG2  VAL  11          3HG2      VAL  11  -7.328   7.366   1.603
   72    H    GLY  12           H        GLY  12  -4.733  12.020   0.742
   73   1HA   GLY  12          2HA       GLY  12  -3.897  13.363   2.571
   74   2HA   GLY  12          1HA       GLY  12  -2.699  12.115   2.859
   75    H    ILE  13           H        ILE  13  -1.318  11.672   0.954
   76    HA   ILE  13           HA       ILE  13  -0.745  13.863  -0.846
   77    HB   ILE  13           HB       ILE  13   1.728  13.840  -0.079
   78   1HG1  ILE  13          2HG1      ILE  13   0.399  12.995   2.505
   79   2HG1  ILE  13          1HG1      ILE  13   1.471  11.990   1.536
   80   1HG2  ILE  13          1HG2      ILE  13  -0.498  15.302   1.279
   81   2HG2  ILE  13          2HG2      ILE  13   0.652  15.883   0.074
   82   3HG2  ILE  13          3HG2      ILE  13   1.182  15.591   1.732
   83   1HD1  ILE  13          1HD1      ILE  13   3.345  13.208   2.119
   84   2HD1  ILE  13          2HD1      ILE  13   2.399  13.213   3.608
   85   3HD1  ILE  13          3HD1      ILE  13   2.407  14.633   2.562
   86    H    GLY  14           H        GLY  14  -1.565  11.353  -1.434
   87   1HA   GLY  14          2HA       GLY  14  -1.022   9.694  -2.956
   88   2HA   GLY  14          1HA       GLY  14   0.605  10.364  -3.039
   89    H    THR  15           H        THR  15  -0.601   9.756   0.068
   90    HA   THR  15           HA       THR  15   1.317   7.630   0.480
   91    HB   THR  15           HB       THR  15   0.219   7.962   2.902
   92    HG1  THR  15           1HG      THR  15  -1.277   9.499   2.577
   93   1HG2  THR  15          1HG2      THR  15   2.481   9.048   1.485
   94   2HG2  THR  15          2HG2      THR  15   2.346   8.581   3.182
   95   3HG2  THR  15          3HG2      THR  15   1.888  10.207   2.674
   96    HA   PRO  16           HA       PRO  16  -1.851   4.538  -0.049
   97   1HB   PRO  16          2HB       PRO  16   0.089   2.728   1.215
   98   2HB   PRO  16          1HB       PRO  16  -0.607   2.669  -0.407
   99   1HG   PRO  16          2HG       PRO  16   1.966   3.333   0.015
  100   2HG   PRO  16          1HG       PRO  16   1.009   4.054  -1.293
  101   1HD   PRO  16          2HD       PRO  16   1.745   5.201   1.371
  102   2HD   PRO  16          1HD       PRO  16   1.689   5.990  -0.220
  103    H    ILE  17           H        ILE  17  -3.517   4.212   1.266
  104    HA   ILE  17           HA       ILE  17  -2.975   3.813   4.134
  105    HB   ILE  17           HB       ILE  17  -4.105   5.986   3.585
  106   1HG1  ILE  17          2HG1      ILE  17  -5.906   5.769   5.288
  107   2HG1  ILE  17          1HG1      ILE  17  -5.705   4.020   5.237
  108   1HG2  ILE  17          1HG2      ILE  17  -5.902   6.137   2.292
  109   2HG2  ILE  17          2HG2      ILE  17  -6.739   4.862   3.176
  110   3HG2  ILE  17          3HG2      ILE  17  -5.629   4.445   1.872
  111   1HD1  ILE  17          1HD1      ILE  17  -4.578   5.080   7.151
  112   2HD1  ILE  17          2HD1      ILE  17  -3.555   5.972   6.025
  113   3HD1  ILE  17          3HD1      ILE  17  -3.466   4.211   6.094
  114    H    SER  18           H        SER  18  -3.095   1.949   1.971
  115    HA   SER  18           HA       SER  18  -4.460  -0.172   3.139
  116   1HB   SER  18          2HB       SER  18  -6.225  -0.516   1.337
  117   2HB   SER  18          1HB       SER  18  -6.556   0.782   2.481
  118    HG   SER  18           HG       SER  18  -5.894   2.272   0.949
  119    H    PHE  19           H        PHE  19  -4.071  -2.141   2.014
  120    HA   PHE  19           HA       PHE  19  -2.620  -1.951  -0.523
  121   1HB   PHE  19          2HB       PHE  19  -1.513  -3.604   1.742
  122   2HB   PHE  19          1HB       PHE  19  -0.767  -3.272   0.193
  123    HD1  PHE  19           1HD      PHE  19   0.646  -1.439  -0.105
  124    HD2  PHE  19           2HD      PHE  19  -1.727  -1.714   3.416
  125    HE1  PHE  19           1HE      PHE  19   1.908   0.423   0.887
  126    HE2  PHE  19           2HE      PHE  19  -0.477   0.156   4.411
  127    HZ   PHE  19           HZ       PHE  19   1.345   1.227   3.146
  128    H    TYR  20           H        TYR  20  -2.140  -4.299  -1.312
  129    HA   TYR  20           HA       TYR  20  -4.653  -5.776  -1.041
  130   1HB   TYR  20          2HB       TYR  20  -2.352  -6.155  -2.972
  131   2HB   TYR  20          1HB       TYR  20  -3.834  -7.100  -2.979
  132    HD1  TYR  20           1HD      TYR  20  -2.387  -3.780  -3.652
  133    HD2  TYR  20           2HD      TYR  20  -5.850  -6.232  -3.933
  134    HE1  TYR  20           1HE      TYR  20  -3.412  -2.146  -5.172
  135    HE2  TYR  20           2HE      TYR  20  -6.887  -4.602  -5.455
  136    HH   TYR  20           HH       TYR  20  -5.202  -1.606  -6.362
  137    H    GLY  21           H        GLY  21  -1.216  -6.561  -1.190
  138   1HA   GLY  21          2HA       GLY  21  -1.177  -8.138   1.147
  139   2HA   GLY  21          1HA       GLY  21  -1.331  -9.172  -0.273
  Start of MODEL    9
    1   2H    GLY   1           HN2      GLY   1  -7.034  -1.018  -0.507
    2   1HA   GLY   1          2HA       GLY   1  -8.863  -1.639   0.733
    3   2HA   GLY   1          1HA       GLY   1  -9.056  -2.975  -0.391
    4    H    GLY   2           H        GLY   2  -6.346  -2.321   1.793
    5   1HA   GLY   2          2HA       GLY   2  -7.066  -4.042   3.866
    6   2HA   GLY   2          1HA       GLY   2  -6.179  -4.991   2.678
    7    H    ALA   3           H        ALA   3  -4.317  -5.349   3.827
    8    HA   ALA   3           HA       ALA   3  -2.564  -3.048   4.116
    9   1HB   ALA   3          1HB       ALA   3  -2.775  -2.875   6.321
   10   2HB   ALA   3          2HB       ALA   3  -2.114  -4.503   6.475
   11   3HB   ALA   3          3HB       ALA   3  -3.858  -4.266   6.367
   12    H    GLY   4           H        GLY   4  -2.403  -4.977   2.224
   13   1HA   GLY   4          2HA       GLY   4  -0.599  -7.079   3.030
   14   2HA   GLY   4          1HA       GLY   4  -1.148  -6.738   1.397
   15    H    HIS   5           H        HIS   5   0.559  -6.393   0.129
   16    HA   HIS   5           HA       HIS   5   2.789  -4.812   1.248
   17   1HB   HIS   5          2HB       HIS   5   3.044  -6.650  -1.122
   18   2HB   HIS   5          1HB       HIS   5   4.317  -6.018  -0.083
   19    HD1  HIS   5           1HD      HIS   5   3.418  -6.841   2.665
   20    HD2  HIS   5           2HD      HIS   5   2.989  -9.296  -0.654
   21    HE1  HIS   5           1HE      HIS   5   3.232  -9.175   3.574
   22    HE2  HIS   5           2HE      HIS   5   2.636 -10.566   1.562
   23    H    VAL   6           H        VAL   6   0.884  -5.347  -1.712
   24    HA   VAL   6           HA       VAL   6   2.086  -2.986  -2.919
   25    HB   VAL   6           HB       VAL   6   1.821  -4.774  -4.450
   26   1HG1  VAL   6          1HG1      VAL   6  -1.026  -5.111  -4.568
   27   2HG1  VAL   6          2HG1      VAL   6  -0.435  -5.441  -2.939
   28   3HG1  VAL   6          3HG1      VAL   6   0.237  -6.315  -4.316
   29   1HG2  VAL   6          1HG2      VAL   6   0.131  -2.401  -4.795
   30   2HG2  VAL   6          2HG2      VAL   6  -0.266  -3.752  -5.859
   31   3HG2  VAL   6          3HG2      VAL   6   1.367  -3.083  -5.854
   32    HA   PRO   7           HA       PRO   7  -0.899  -0.213  -1.172
   33   1HB   PRO   7          2HB       PRO   7  -0.137   1.405  -3.549
   34   2HB   PRO   7          1HB       PRO   7  -0.157   1.849  -1.839
   35   1HG   PRO   7          2HG       PRO   7   2.142   1.355  -3.068
   36   2HG   PRO   7          1HG       PRO   7   1.869   0.797  -1.406
   37   1HD   PRO   7          2HD       PRO   7   1.803  -0.751  -3.963
   38   2HD   PRO   7          1HD       PRO   7   2.431  -1.227  -2.372
   39    H    GLU   8           H        GLU   8  -2.993   0.175  -1.398
   40    HA   GLU   8           HA       GLU   8  -4.306  -0.568  -3.911
   41   1HB   GLU   8          2HB       GLU   8  -5.285  -0.301  -1.076
   42   2HB   GLU   8          1HB       GLU   8  -6.405  -0.372  -2.427
   43   1HG   GLU   8          2HG       GLU   8  -5.409  -2.549  -3.063
   44   2HG   GLU   8          1HG       GLU   8  -4.431  -2.478  -1.597
   45    H    TYR   9           H        TYR   9  -5.136   1.761  -1.351
   46    HA   TYR   9           HA       TYR   9  -5.581   3.767  -3.463
   47   1HB   TYR   9          2HB       TYR   9  -7.079   3.464  -0.855
   48   2HB   TYR   9          1HB       TYR   9  -7.336   4.741  -2.032
   49    HD1  TYR   9           1HD      TYR   9  -8.863   4.452  -3.778
   50    HD2  TYR   9           2HD      TYR   9  -7.521   1.045  -1.611
   51    HE1  TYR   9           1HE      TYR   9 -10.544   3.068  -4.921
   52    HE2  TYR   9           2HE      TYR   9  -9.193  -0.347  -2.752
   53    HH   TYR   9           HH       TYR   9 -10.587   0.265  -5.420
   54    H    PHE  10           H        PHE  10  -4.851   5.789  -3.168
   55    HA   PHE  10           HA       PHE  10  -3.109   6.259  -0.843
   56   1HB   PHE  10          2HB       PHE  10  -3.021   7.737  -3.477
   57   2HB   PHE  10          1HB       PHE  10  -1.821   7.763  -2.199
   58    HD1  PHE  10           1HD      PHE  10  -3.424   5.392  -4.601
   59    HD2  PHE  10           2HD      PHE  10   0.052   6.447  -2.384
   60    HE1  PHE  10           1HE      PHE  10  -2.167   3.606  -5.731
   61    HE2  PHE  10           2HE      PHE  10   1.314   4.662  -3.510
   62    HZ   PHE  10           HZ       PHE  10   0.206   3.239  -5.185
   63    H    VAL  11           H        VAL  11  -3.300   8.233   0.270
   64    HA   VAL  11           HA       VAL  11  -5.090  10.281  -0.603
   65    HB   VAL  11           HB       VAL  11  -6.730   8.585   0.120
   66   1HG1  VAL  11          1HG1      VAL  11  -4.988   8.374   2.385
   67   2HG1  VAL  11          2HG1      VAL  11  -6.329   7.336   1.901
   68   3HG1  VAL  11          3HG1      VAL  11  -6.629   8.752   2.909
   69   1HG2  VAL  11          1HG2      VAL  11  -6.797  10.887   2.047
   70   2HG2  VAL  11          2HG2      VAL  11  -8.152  10.047   1.294
   71   3HG2  VAL  11          3HG2      VAL  11  -7.106  11.080   0.321
   72    H    GLY  12           H        GLY  12  -5.078  12.106   0.715
   73   1HA   GLY  12          2HA       GLY  12  -4.469  13.341   2.653
   74   2HA   GLY  12          1HA       GLY  12  -3.280  12.107   3.029
   75    H    ILE  13           H        ILE  13  -1.722  11.816   1.135
   76    HA   ILE  13           HA       ILE  13  -0.957  14.219  -0.277
   77    HB   ILE  13           HB       ILE  13   1.446  14.005   0.675
   78   1HG1  ILE  13          2HG1      ILE  13  -0.120  12.880   3.007
   79   2HG1  ILE  13          1HG1      ILE  13   0.997  11.966   2.000
   80   1HG2  ILE  13          1HG2      ILE  13  -0.849  15.342   2.057
   81   2HG2  ILE  13          2HG2      ILE  13   0.376  16.042   1.000
   82   3HG2  ILE  13          3HG2      ILE  13   0.807  15.534   2.633
   83   1HD1  ILE  13          1HD1      ILE  13   1.658  14.243   3.847
   84   2HD1  ILE  13          2HD1      ILE  13   2.805  13.509   2.727
   85   3HD1  ILE  13          3HD1      ILE  13   2.104  12.547   4.027
   86    H    GLY  14           H        GLY  14  -1.781  11.733  -1.155
   87   1HA   GLY  14          2HA       GLY  14  -1.191  10.262  -2.835
   88   2HA   GLY  14          1HA       GLY  14   0.411  10.988  -2.844
   89    H    THR  15           H        THR  15  -0.600  10.046   0.222
   90    HA   THR  15           HA       THR  15   1.305   7.863   0.262
   91    HB   THR  15           HB       THR  15   0.555   7.914   2.773
   92    HG1  THR  15           1HG      THR  15  -1.214   9.277   2.598
   93   1HG2  THR  15          1HG2      THR  15   2.604   8.785   2.904
   94   2HG2  THR  15          2HG2      THR  15   1.923  10.379   2.573
   95   3HG2  THR  15          3HG2      THR  15   2.489   9.369   1.243
   96    HA   PRO  16           HA       PRO  16  -1.994   4.897  -0.130
   97   1HB   PRO  16          2HB       PRO  16  -0.525   2.663   0.290
   98   2HB   PRO  16          1HB       PRO  16  -0.480   3.569  -1.226
   99   1HG   PRO  16          2HG       PRO  16   1.460   3.567   1.043
  100   2HG   PRO  16          1HG       PRO  16   1.773   3.634  -0.700
  101   1HD   PRO  16          2HD       PRO  16   1.839   5.820   0.957
  102   2HD   PRO  16          1HD       PRO  16   1.494   5.902  -0.781
  103    H    ILE  17           H        ILE  17  -3.452   4.543   1.399
  104    HA   ILE  17           HA       ILE  17  -2.517   3.796   4.094
  105    HB   ILE  17           HB       ILE  17  -5.204   5.045   3.488
  106   1HG1  ILE  17          2HG1      ILE  17  -3.406   6.598   2.788
  107   2HG1  ILE  17          1HG1      ILE  17  -4.295   7.202   4.181
  108   1HG2  ILE  17          1HG2      ILE  17  -5.020   3.851   5.615
  109   2HG2  ILE  17          2HG2      ILE  17  -5.196   5.587   5.873
  110   3HG2  ILE  17          3HG2      ILE  17  -3.616   4.825   6.046
  111   1HD1  ILE  17          1HD1      ILE  17  -2.472   6.430   5.643
  112   2HD1  ILE  17          2HD1      ILE  17  -1.940   7.619   4.453
  113   3HD1  ILE  17          3HD1      ILE  17  -1.578   5.910   4.216
  114    H    SER  18           H        SER  18  -2.772   2.008   1.998
  115    HA   SER  18           HA       SER  18  -4.197  -0.094   3.139
  116   1HB   SER  18          2HB       SER  18  -5.970  -0.375   1.359
  117   2HB   SER  18          1HB       SER  18  -6.252   0.961   2.473
  118    HG   SER  18           HG       SER  18  -5.463   2.380   0.892
  119    H    PHE  19           H        PHE  19  -3.820  -2.041   2.045
  120    HA   PHE  19           HA       PHE  19  -2.397  -1.904  -0.512
  121   1HB   PHE  19          2HB       PHE  19  -1.303  -3.608   1.718
  122   2HB   PHE  19          1HB       PHE  19  -0.556  -3.229   0.181
  123    HD1  PHE  19           1HD      PHE  19   0.846  -1.373  -0.074
  124    HD2  PHE  19           2HD      PHE  19  -1.478  -1.791   3.467
  125    HE1  PHE  19           1HE      PHE  19   2.115   0.455   0.970
  126    HE2  PHE  19           2HE      PHE  19  -0.218   0.042   4.515
  127    HZ   PHE  19           HZ       PHE  19   1.582   1.168   3.266
  128    H    TYR  20           H        TYR  20  -2.092  -4.188  -1.390
  129    HA   TYR  20           HA       TYR  20  -4.623  -5.580  -1.099
  130   1HB   TYR  20          2HB       TYR  20  -2.284  -6.050  -2.961
  131   2HB   TYR  20          1HB       TYR  20  -3.744  -7.030  -2.958
  132    HD1  TYR  20           1HD      TYR  20  -2.346  -3.718  -3.753
  133    HD2  TYR  20           2HD      TYR  20  -5.782  -6.220  -3.935
  134    HE1  TYR  20           1HE      TYR  20  -3.390  -2.159  -5.340
  135    HE2  TYR  20           2HE      TYR  20  -6.836  -4.666  -5.523
  136    HH   TYR  20           HH       TYR  20  -5.173  -1.704  -6.570
  137    H    GLY  21           H        GLY  21  -2.247  -7.746  -2.000
  138   1HA   GLY  21          2HA       GLY  21  -2.353  -9.032   0.637
  139   2HA   GLY  21          1HA       GLY  21  -2.029  -9.849  -0.888
  Start of MODEL   10
    1   2H    GLY   1           HN2      GLY   1  -7.363  -1.128  -0.234
    2   1HA   GLY   1          2HA       GLY   1  -9.176  -1.826   0.982
    3   2HA   GLY   1          1HA       GLY   1  -9.370  -3.115  -0.195
    4    H    GLY   2           H        GLY   2  -6.574  -2.570   1.905
    5   1HA   GLY   2          2HA       GLY   2  -7.199  -4.267   3.995
    6   2HA   GLY   2          1HA       GLY   2  -6.528  -5.287   2.730
    7    H    ALA   3           H        ALA   3  -4.576  -5.821   3.523
    8    HA   ALA   3           HA       ALA   3  -2.619  -3.681   3.806
    9   1HB   ALA   3          1HB       ALA   3  -2.088  -5.584   5.872
   10   2HB   ALA   3          2HB       ALA   3  -3.729  -4.966   6.062
   11   3HB   ALA   3          3HB       ALA   3  -2.366  -3.847   6.009
   12    H    GLY   4           H        GLY   4  -0.593  -4.283   3.128
   13   1HA   GLY   4          2HA       GLY   4   0.474  -6.837   3.012
   14   2HA   GLY   4          1HA       GLY   4  -0.400  -6.599   1.505
   15    H    HIS   5           H        HIS   5   1.016  -6.176  -0.059
   16    HA   HIS   5           HA       HIS   5   3.241  -4.332   0.557
   17   1HB   HIS   5          2HB       HIS   5   3.243  -6.270  -1.748
   18   2HB   HIS   5          1HB       HIS   5   4.611  -5.464  -0.993
   19    HD1  HIS   5           1HD      HIS   5   4.416  -6.238   1.879
   20    HD2  HIS   5           2HD      HIS   5   3.496  -8.880  -1.188
   21    HE1  HIS   5           1HE      HIS   5   4.649  -8.533   2.876
   22    HE2  HIS   5           2HE      HIS   5   3.795 -10.076   1.078
   23    H    VAL   6           H        VAL   6   0.819  -5.218  -1.892
   24    HA   VAL   6           HA       VAL   6   1.538  -2.905  -3.511
   25    HB   VAL   6           HB       VAL   6  -0.730  -4.860  -3.934
   26   1HG1  VAL   6          1HG1      VAL   6  -1.318  -3.271  -5.415
   27   2HG1  VAL   6          2HG1      VAL   6  -0.021  -3.965  -6.389
   28   3HG1  VAL   6          3HG1      VAL   6   0.282  -2.529  -5.411
   29   1HG2  VAL   6          1HG2      VAL   6   0.711  -6.044  -5.468
   30   2HG2  VAL   6          2HG2      VAL   6   1.476  -5.977  -3.881
   31   3HG2  VAL   6          3HG2      VAL   6   2.022  -4.903  -5.168
   32    HA   PRO   7           HA       PRO   7  -1.297  -0.404  -1.104
   33   1HB   PRO   7          2HB       PRO   7  -0.998   1.847  -2.634
   34   2HB   PRO   7          1HB       PRO   7   0.117   1.354  -1.356
   35   1HG   PRO   7          2HG       PRO   7   0.333   0.971  -4.314
   36   2HG   PRO   7          1HG       PRO   7   1.587   1.440  -3.149
   37   1HD   PRO   7          2HD       PRO   7   1.396  -1.069  -4.100
   38   2HD   PRO   7          1HD       PRO   7   1.910  -0.734  -2.433
   39    H    GLU   8           H        GLU   8  -3.394   0.064  -1.213
   40    HA   GLU   8           HA       GLU   8  -4.798  -0.394  -3.742
   41   1HB   GLU   8          2HB       GLU   8  -5.722  -0.329  -0.870
   42   2HB   GLU   8          1HB       GLU   8  -6.846  -0.363  -2.218
   43   1HG   GLU   8          2HG       GLU   8  -5.816  -2.488  -2.957
   44   2HG   GLU   8          1HG       GLU   8  -4.814  -2.460  -1.508
   45    H    TYR   9           H        TYR   9  -5.552   1.685  -0.957
   46    HA   TYR   9           HA       TYR   9  -6.215   3.840  -2.842
   47   1HB   TYR   9          2HB       TYR   9  -7.087   3.451   0.028
   48   2HB   TYR   9          1HB       TYR   9  -7.545   4.807  -0.992
   49    HD1  TYR   9           1HD      TYR   9  -7.717   1.071  -0.913
   50    HD2  TYR   9           2HD      TYR   9  -9.536   4.708  -2.164
   51    HE1  TYR   9           1HE      TYR   9  -9.669  -0.188  -1.716
   52    HE2  TYR   9           2HE      TYR   9 -11.493   3.458  -2.970
   53    HH   TYR   9           HH       TYR   9 -12.083   1.218  -3.681
   54    H    PHE  10           H        PHE  10  -5.375   5.869  -2.608
   55    HA   PHE  10           HA       PHE  10  -3.221   6.168  -0.621
   56   1HB   PHE  10          2HB       PHE  10  -3.285   7.520  -3.317
   57   2HB   PHE  10          1HB       PHE  10  -1.959   7.486  -2.174
   58    HD1  PHE  10           1HD      PHE  10  -0.237   6.013  -2.503
   59    HD2  PHE  10           2HD      PHE  10  -4.021   5.176  -4.261
   60    HE1  PHE  10           1HE      PHE  10   0.745   4.104  -3.703
   61    HE2  PHE  10           2HE      PHE  10  -3.047   3.261  -5.456
   62    HZ   PHE  10           HZ       PHE  10  -0.661   2.723  -5.180
   63    H    VAL  11           H        VAL  11  -3.055   8.096   0.423
   64    HA   VAL  11           HA       VAL  11  -5.409   9.799   0.408
   65    HB   VAL  11           HB       VAL  11  -2.902  10.068   2.092
   66   1HG1  VAL  11          1HG1      VAL  11  -3.839  12.007   2.674
   67   2HG1  VAL  11          2HG1      VAL  11  -5.048  11.044   3.524
   68   3HG1  VAL  11          3HG1      VAL  11  -5.361  11.604   1.880
   69   1HG2  VAL  11          1HG2      VAL  11  -5.393   8.965   3.245
   70   2HG2  VAL  11          2HG2      VAL  11  -3.710   8.618   3.637
   71   3HG2  VAL  11          3HG2      VAL  11  -4.445   7.904   2.203
   72    H    GLY  12           H        GLY  12  -5.255  12.106   0.085
   73   1HA   GLY  12          2HA       GLY  12  -3.957  12.908  -2.204
   74   2HA   GLY  12          1HA       GLY  12  -4.565  14.011  -0.988
   75    H    ILE  13           H        ILE  13  -2.686  12.876   1.028
   76    HA   ILE  13           HA       ILE  13  -0.451  14.573   0.358
   77    HB   ILE  13           HB       ILE  13   0.379  13.992   2.650
   78   1HG1  ILE  13          2HG1      ILE  13  -2.302  12.601   2.870
   79   2HG1  ILE  13          1HG1      ILE  13  -0.740  11.789   2.828
   80   1HG2  ILE  13          1HG2      ILE  13  -2.352  15.185   2.259
   81   2HG2  ILE  13          2HG2      ILE  13  -0.804  16.017   2.397
   82   3HG2  ILE  13          3HG2      ILE  13  -1.507  15.223   3.807
   83   1HD1  ILE  13          1HD1      ILE  13  -0.834  13.805   4.894
   84   2HD1  ILE  13          2HD1      ILE  13  -0.441  12.090   5.003
   85   3HD1  ILE  13          3HD1      ILE  13  -2.123  12.615   5.074
   86    H    GLY  14           H        GLY  14  -0.755  12.178  -1.195
   87   1HA   GLY  14          2HA       GLY  14   0.507  10.509  -2.116
   88   2HA   GLY  14          1HA       GLY  14   1.877  11.418  -1.516
   89    H    THR  15           H        THR  15  -0.647   9.410   0.077
   90    HA   THR  15           HA       THR  15   1.416   7.535   0.860
   91    HB   THR  15           HB       THR  15   1.589   9.212   2.635
   92    HG1  THR  15           1HG      THR  15   1.952   7.556   3.875
   93   1HG2  THR  15          1HG2      THR  15  -0.640  10.148   2.616
   94   2HG2  THR  15          2HG2      THR  15  -0.281   9.526   4.227
   95   3HG2  THR  15          3HG2      THR  15  -1.326   8.610   3.140
   96    HA   PRO  16           HA       PRO  16  -2.199   4.990   0.377
   97   1HB   PRO  16          2HB       PRO  16  -0.958   2.616   0.404
   98   2HB   PRO  16          1HB       PRO  16  -0.793   3.734  -0.953
   99   1HG   PRO  16          2HG       PRO  16   1.124   3.113   1.235
  100   2HG   PRO  16          1HG       PRO  16   1.441   3.525  -0.458
  101   1HD   PRO  16          2HD       PRO  16   1.601   5.271   1.733
  102   2HD   PRO  16          1HD       PRO  16   1.575   5.738   0.024
  103    H    ILE  17           H        ILE  17  -3.647   4.333   1.850
  104    HA   ILE  17           HA       ILE  17  -2.639   3.405   4.454
  105    HB   ILE  17           HB       ILE  17  -4.670   4.178   5.510
  106   1HG1  ILE  17          2HG1      ILE  17  -6.204   3.835   3.563
  107   2HG1  ILE  17          1HG1      ILE  17  -6.432   5.372   4.381
  108   1HG2  ILE  17          1HG2      ILE  17  -3.290   5.923   5.746
  109   2HG2  ILE  17          2HG2      ILE  17  -4.422   6.718   4.651
  110   3HG2  ILE  17          3HG2      ILE  17  -2.932   6.013   4.022
  111   1HD1  ILE  17          1HD1      ILE  17  -5.242   6.514   2.606
  112   2HD1  ILE  17          2HD1      ILE  17  -6.583   5.574   1.954
  113   3HD1  ILE  17          3HD1      ILE  17  -4.931   4.976   1.803
  114    H    SER  18           H        SER  18  -2.973   1.759   2.186
  115    HA   SER  18           HA       SER  18  -4.267  -0.448   3.325
  116   1HB   SER  18          2HB       SER  18  -6.127  -0.674   1.609
  117   2HB   SER  18          1HB       SER  18  -6.376   0.575   2.829
  118    HG   SER  18           HG       SER  18  -5.667   2.112   1.308
  119    H    PHE  19           H        PHE  19  -3.969  -2.344   2.092
  120    HA   PHE  19           HA       PHE  19  -2.642  -2.056  -0.503
  121   1HB   PHE  19          2HB       PHE  19  -1.486  -3.852   1.628
  122   2HB   PHE  19          1HB       PHE  19  -0.802  -3.473   0.060
  123    HD1  PHE  19           1HD      PHE  19  -1.536  -2.066   3.405
  124    HD2  PHE  19           2HD      PHE  19   0.615  -1.628  -0.242
  125    HE1  PHE  19           1HE      PHE  19  -0.204  -0.261   4.412
  126    HE2  PHE  19           2HE      PHE  19   1.951   0.178   0.760
  127    HZ   PHE  19           HZ       PHE  19   1.543   0.864   3.090
  128    H    TYR  20           H        TYR  20  -2.274  -4.391  -1.420
  129    HA   TYR  20           HA       TYR  20  -4.838  -5.762  -1.141
  130   1HB   TYR  20          2HB       TYR  20  -2.584  -6.141  -3.122
  131   2HB   TYR  20          1HB       TYR  20  -4.066  -7.086  -3.122
  132    HD1  TYR  20           1HD      TYR  20  -6.088  -6.206  -4.035
  133    HD2  TYR  20           2HD      TYR  20  -2.643  -3.733  -3.706
  134    HE1  TYR  20           1HE      TYR  20  -7.149  -4.544  -5.501
  135    HE2  TYR  20           2HE      TYR  20  -3.697  -2.061  -5.166
  136    HH   TYR  20           HH       TYR  20  -5.524  -1.482  -6.282
  137    H    GLY  21           H        GLY  21  -1.428  -6.652  -1.282
  138   1HA   GLY  21          2HA       GLY  21  -1.480  -8.324   0.983
  139   2HA   GLY  21          1HA       GLY  21  -1.646  -9.298  -0.476
  Start of MODEL   11
    1   2H    GLY   1           HN2      GLY   1  -6.986  -0.694  -0.394
    2   1HA   GLY   1          2HA       GLY   1  -8.760  -1.184   0.978
    3   2HA   GLY   1          1HA       GLY   1  -9.039  -2.537  -0.104
    4    H    GLY   2           H        GLY   2  -6.310  -1.963   2.099
    5   1HA   GLY   2          2HA       GLY   2  -7.089  -3.522   4.235
    6   2HA   GLY   2          1HA       GLY   2  -6.391  -4.636   3.067
    7    H    ALA   3           H        ALA   3  -4.562  -5.174   4.190
    8    HA   ALA   3           HA       ALA   3  -2.529  -3.082   4.337
    9   1HB   ALA   3          1HB       ALA   3  -3.847  -3.990   6.625
   10   2HB   ALA   3          2HB       ALA   3  -2.356  -3.048   6.556
   11   3HB   ALA   3          3HB       ALA   3  -2.284  -4.808   6.634
   12    H    GLY   4           H        GLY   4  -2.649  -4.893   2.372
   13   1HA   GLY   4          2HA       GLY   4  -1.123  -7.264   2.956
   14   2HA   GLY   4          1HA       GLY   4  -1.616  -6.702   1.365
   15    H    HIS   5           H        HIS   5   0.093  -6.375   0.103
   16    HA   HIS   5           HA       HIS   5   2.476  -5.137   1.322
   17   1HB   HIS   5          2HB       HIS   5   2.399  -7.204  -0.885
   18   2HB   HIS   5          1HB       HIS   5   3.850  -6.376  -0.332
   19    HD1  HIS   5           1HD      HIS   5   1.199  -8.776   0.951
   20    HD2  HIS   5           2HD      HIS   5   5.091  -7.551   1.794
   21    HE1  HIS   5           1HE      HIS   5   2.002 -10.277   2.803
   22    HE2  HIS   5           2HE      HIS   5   4.287  -9.410   3.404
   23    H    VAL   6           H        VAL   6   0.605  -5.487  -1.677
   24    HA   VAL   6           HA       VAL   6   2.004  -3.223  -2.865
   25    HB   VAL   6           HB       VAL   6  -0.322  -4.790  -4.000
   26   1HG1  VAL   6          1HG1      VAL   6   0.082  -3.777  -6.032
   27   2HG1  VAL   6          2HG1      VAL   6   1.741  -3.354  -5.613
   28   3HG1  VAL   6          3HG1      VAL   6   0.398  -2.458  -4.906
   29   1HG2  VAL   6          1HG2      VAL   6   2.632  -5.232  -4.427
   30   2HG2  VAL   6          2HG2      VAL   6   1.326  -6.082  -5.251
   31   3HG2  VAL   6          3HG2      VAL   6   1.551  -6.284  -3.514
   32    HA   PRO   7           HA       PRO   7  -0.827  -0.239  -1.177
   33   1HB   PRO   7          2HB       PRO   7  -0.392   1.692  -3.117
   34   2HB   PRO   7          1HB       PRO   7   0.593   1.456  -1.670
   35   1HG   PRO   7          2HG       PRO   7   1.066   0.509  -4.463
   36   2HG   PRO   7          1HG       PRO   7   2.225   1.145  -3.280
   37   1HD   PRO   7          2HD       PRO   7   2.044  -1.478  -3.773
   38   2HD   PRO   7          1HD       PRO   7   2.345  -0.870  -2.132
   39    H    GLU   8           H        GLU   8  -2.922   0.154  -1.394
   40    HA   GLU   8           HA       GLU   8  -4.262  -0.639  -3.865
   41   1HB   GLU   8          2HB       GLU   8  -5.332   0.028  -1.116
   42   2HB   GLU   8          1HB       GLU   8  -6.343  -0.393  -2.491
   43   1HG   GLU   8          2HG       GLU   8  -5.174  -2.573  -2.611
   44   2HG   GLU   8          1HG       GLU   8  -4.314  -2.142  -1.134
   45    H    TYR   9           H        TYR   9  -5.004   1.921  -1.509
   46    HA   TYR   9           HA       TYR   9  -5.227   3.802  -3.765
   47   1HB   TYR   9          2HB       TYR   9  -7.020   3.628  -1.339
   48   2HB   TYR   9          1HB       TYR   9  -7.069   4.924  -2.523
   49    HD1  TYR   9           1HD      TYR   9  -7.460   1.226  -2.212
   50    HD2  TYR   9           2HD      TYR   9  -8.435   4.743  -4.397
   51    HE1  TYR   9           1HE      TYR   9  -9.052  -0.066  -3.568
   52    HE2  TYR   9           2HE      TYR   9 -10.031   3.460  -5.759
   53    HH   TYR   9           HH       TYR   9 -10.497   1.205  -6.415
   54    H    PHE  10           H        PHE  10  -4.490   5.836  -3.471
   55    HA   PHE  10           HA       PHE  10  -2.938   6.324  -1.022
   56   1HB   PHE  10          2HB       PHE  10  -2.618   7.819  -3.614
   57   2HB   PHE  10          1HB       PHE  10  -1.496   7.735  -2.272
   58    HD1  PHE  10           1HD      PHE  10  -3.083   5.521  -4.834
   59    HD2  PHE  10           2HD      PHE  10   0.322   6.348  -2.420
   60    HE1  PHE  10           1HE      PHE  10  -1.853   3.712  -5.957
   61    HE2  PHE  10           2HE      PHE  10   1.557   4.539  -3.538
   62    HZ   PHE  10           HZ       PHE  10   0.471   3.219  -5.310
   63    H    VAL  11           H        VAL  11  -3.336   8.114   0.164
   64    HA   VAL  11           HA       VAL  11  -4.986  10.277  -0.841
   65    HB   VAL  11           HB       VAL  11  -6.511  10.130   1.213
   66   1HG1  VAL  11          1HG1      VAL  11  -7.823   9.748  -0.564
   67   2HG1  VAL  11          2HG1      VAL  11  -7.776   8.071  -0.019
   68   3HG1  VAL  11          3HG1      VAL  11  -6.684   8.617  -1.293
   69   1HG2  VAL  11          1HG2      VAL  11  -4.944   7.775   1.620
   70   2HG2  VAL  11          2HG2      VAL  11  -6.639   7.327   1.417
   71   3HG2  VAL  11          3HG2      VAL  11  -6.175   8.488   2.662
   72    H    GLY  12           H        GLY  12  -5.502  11.729   1.264
   73   1HA   GLY  12          2HA       GLY  12  -4.707  12.980   3.017
   74   2HA   GLY  12          1HA       GLY  12  -3.475  11.765   3.281
   75    H    ILE  13           H        ILE  13  -2.113  11.750   1.030
   76    HA   ILE  13           HA       ILE  13  -1.421  14.269  -0.058
   77    HB   ILE  13           HB       ILE  13  -0.541  14.594   2.252
   78   1HG1  ILE  13          2HG1      ILE  13   1.730  15.353   1.587
   79   2HG1  ILE  13          1HG1      ILE  13   1.553  14.475   0.072
   80   1HG2  ILE  13          1HG2      ILE  13   1.822  13.187   2.333
   81   2HG2  ILE  13          2HG2      ILE  13   0.659  12.003   1.733
   82   3HG2  ILE  13          3HG2      ILE  13   0.363  12.835   3.261
   83   1HD1  ILE  13          1HD1      ILE  13  -0.142  15.924  -0.679
   84   2HD1  ILE  13          2HD1      ILE  13   1.118  16.955  -0.002
   85   3HD1  ILE  13          3HD1      ILE  13  -0.350  16.634   0.921
   86    H    GLY  14           H        GLY  14  -2.020  11.699  -0.975
   87   1HA   GLY  14          2HA       GLY  14  -1.332  10.410  -2.764
   88   2HA   GLY  14          1HA       GLY  14   0.204  11.262  -2.739
   89    H    THR  15           H        THR  15  -0.672   9.993   0.282
   90    HA   THR  15           HA       THR  15   1.313   7.875  -0.043
   91    HB   THR  15           HB       THR  15   1.725   9.375   1.830
   92    HG1  THR  15           1HG      THR  15   0.790   6.886   2.852
   93   1HG2  THR  15          1HG2      THR  15   0.200   9.478   3.753
   94   2HG2  THR  15          2HG2      THR  15  -0.976   8.510   2.864
   95   3HG2  THR  15          3HG2      THR  15  -0.545  10.121   2.290
   96    HA   PRO  16           HA       PRO  16  -1.923   4.876  -0.221
   97   1HB   PRO  16          2HB       PRO  16  -0.465   2.650   0.322
   98   2HB   PRO  16          1HB       PRO  16  -0.419   3.481  -1.236
   99   1HG   PRO  16          2HG       PRO  16   1.511   3.612   1.042
  100   2HG   PRO  16          1HG       PRO  16   1.835   3.559  -0.700
  101   1HD   PRO  16          2HD       PRO  16   1.926   5.852   0.768
  102   2HD   PRO  16          1HD       PRO  16   1.500   5.817  -0.955
  103    H    ILE  17           H        ILE  17  -3.416   4.575   1.281
  104    HA   ILE  17           HA       ILE  17  -2.554   3.897   4.019
  105    HB   ILE  17           HB       ILE  17  -5.189   5.204   3.297
  106   1HG1  ILE  17          2HG1      ILE  17  -3.306   6.692   2.682
  107   2HG1  ILE  17          1HG1      ILE  17  -4.246   7.332   4.025
  108   1HG2  ILE  17          1HG2      ILE  17  -3.749   5.064   5.946
  109   2HG2  ILE  17          2HG2      ILE  17  -5.040   3.967   5.454
  110   3HG2  ILE  17          3HG2      ILE  17  -5.371   5.689   5.644
  111   1HD1  ILE  17          1HD1      ILE  17  -2.322   7.609   5.088
  112   2HD1  ILE  17          2HD1      ILE  17  -1.445   6.666   3.881
  113   3HD1  ILE  17          3HD1      ILE  17  -2.235   5.854   5.233
  114    H    SER  18           H        SER  18  -2.774   2.056   1.978
  115    HA   SER  18           HA       SER  18  -4.274   0.014   3.128
  116   1HB   SER  18          2HB       SER  18  -5.963  -0.299   1.261
  117   2HB   SER  18          1HB       SER  18  -6.292   1.038   2.361
  118    HG   SER  18           HG       SER  18  -5.496   2.465   0.821
  119    H    PHE  19           H        PHE  19  -3.819  -1.965   2.164
  120    HA   PHE  19           HA       PHE  19  -2.390  -1.993  -0.384
  121   1HB   PHE  19          2HB       PHE  19  -1.153  -3.401   1.972
  122   2HB   PHE  19          1HB       PHE  19  -0.444  -3.081   0.405
  123    HD1  PHE  19           1HD      PHE  19   0.789  -1.126  -0.008
  124    HD2  PHE  19           2HD      PHE  19  -1.434  -1.509   3.601
  125    HE1  PHE  19           1HE      PHE  19   1.925   0.857   0.898
  126    HE2  PHE  19           2HE      PHE  19  -0.306   0.479   4.509
  127    HZ   PHE  19           HZ       PHE  19   1.375   1.665   3.157
  128    H    TYR  20           H        TYR  20  -1.912  -4.277  -1.045
  129    HA   TYR  20           HA       TYR  20  -3.559  -6.310   0.206
  130   1HB   TYR  20          2HB       TYR  20  -4.471  -7.025  -2.063
  131   2HB   TYR  20          1HB       TYR  20  -5.218  -5.640  -1.304
  132    HD1  TYR  20           1HD      TYR  20  -6.160  -4.663  -3.245
  133    HD2  TYR  20           2HD      TYR  20  -2.002  -5.549  -3.159
  134    HE1  TYR  20           1HE      TYR  20  -5.850  -3.375  -5.314
  135    HE2  TYR  20           2HE      TYR  20  -1.681  -4.258  -5.226
  136    HH   TYR  20           HH       TYR  20  -3.170  -2.162  -6.333
  137    H    GLY  21           H        GLY  21  -3.274  -8.431  -0.993
  138   1HA   GLY  21          2HA       GLY  21  -1.842 -10.114  -1.634
  139   2HA   GLY  21          1HA       GLY  21  -1.028  -8.907  -2.618
  Start of MODEL   12
    1   2H    GLY   1           HN2      GLY   1  -6.989  -0.713  -0.361
    2   1HA   GLY   1          2HA       GLY   1  -8.765  -1.229   0.997
    3   2HA   GLY   1          1HA       GLY   1  -9.033  -2.574  -0.099
    4    H    GLY   2           H        GLY   2  -6.310  -2.004   2.112
    5   1HA   GLY   2          2HA       GLY   2  -7.085  -3.588   4.233
    6   2HA   GLY   2          1HA       GLY   2  -6.376  -4.687   3.056
    7    H    ALA   3           H        ALA   3  -4.542  -5.221   4.172
    8    HA   ALA   3           HA       ALA   3  -2.525  -3.115   4.343
    9   1HB   ALA   3          1HB       ALA   3  -3.182  -3.053   6.574
   10   2HB   ALA   3          2HB       ALA   3  -1.815  -4.169   6.591
   11   3HB   ALA   3          3HB       ALA   3  -3.465  -4.793   6.642
   12    H    GLY   4           H        GLY   4  -2.633  -4.911   2.363
   13   1HA   GLY   4          2HA       GLY   4  -1.090  -7.275   2.925
   14   2HA   GLY   4          1HA       GLY   4  -1.586  -6.701   1.340
   15    H    HIS   5           H        HIS   5   0.117  -6.343   0.078
   16    HA   HIS   5           HA       HIS   5   2.489  -5.095   1.309
   17   1HB   HIS   5          2HB       HIS   5   2.440  -7.147  -0.911
   18   2HB   HIS   5          1HB       HIS   5   3.882  -6.314  -0.338
   19    HD1  HIS   5           1HD      HIS   5   1.240  -8.746   0.901
   20    HD2  HIS   5           2HD      HIS   5   5.115  -7.499   1.786
   21    HE1  HIS   5           1HE      HIS   5   2.040 -10.261   2.742
   22    HE2  HIS   5           2HE      HIS   5   4.314  -9.382   3.369
   23    H    VAL   6           H        VAL   6   0.619  -5.445  -1.687
   24    HA   VAL   6           HA       VAL   6   2.002  -3.170  -2.871
   25    HB   VAL   6           HB       VAL   6  -0.315  -4.748  -4.005
   26   1HG1  VAL   6          1HG1      VAL   6   1.080  -3.876  -6.134
   27   2HG1  VAL   6          2HG1      VAL   6   1.390  -2.558  -5.002
   28   3HG1  VAL   6          3HG1      VAL   6  -0.268  -2.990  -5.420
   29   1HG2  VAL   6          1HG2      VAL   6   2.250  -5.696  -3.481
   30   2HG2  VAL   6          2HG2      VAL   6   2.252  -5.309  -5.201
   31   3HG2  VAL   6          3HG2      VAL   6   1.048  -6.419  -4.550
   32    HA   PRO   7           HA       PRO   7  -0.810  -0.182  -1.160
   33   1HB   PRO   7          2HB       PRO   7  -0.031   1.339  -3.593
   34   2HB   PRO   7          1HB       PRO   7   0.022   1.822  -1.895
   35   1HG   PRO   7          2HG       PRO   7   2.254   1.186  -3.191
   36   2HG   PRO   7          1HG       PRO   7   2.015   0.702  -1.501
   37   1HD   PRO   7          2HD       PRO   7   1.804  -0.936  -3.993
   38   2HD   PRO   7          1HD       PRO   7   2.446  -1.381  -2.399
   39    H    GLU   8           H        GLU   8  -2.915   0.186  -1.361
   40    HA   GLU   8           HA       GLU   8  -4.265  -0.612  -3.825
   41   1HB   GLU   8          2HB       GLU   8  -5.315   0.019  -1.062
   42   2HB   GLU   8          1HB       GLU   8  -6.343  -0.375  -2.431
   43   1HG   GLU   8          2HG       GLU   8  -5.167  -2.554  -2.601
   44   2HG   GLU   8          1HG       GLU   8  -4.307  -2.149  -1.117
   45    H    TYR   9           H        TYR   9  -5.030   1.927  -1.455
   46    HA   TYR   9           HA       TYR   9  -5.297   3.809  -3.704
   47   1HB   TYR   9          2HB       TYR   9  -7.022   3.656  -1.227
   48   2HB   TYR   9          1HB       TYR   9  -7.124   4.916  -2.445
   49    HD1  TYR   9           1HD      TYR   9  -7.479   1.233  -1.993
   50    HD2  TYR   9           2HD      TYR   9  -8.517   4.656  -4.296
   51    HE1  TYR   9           1HE      TYR   9  -9.090  -0.119  -3.264
   52    HE2  TYR   9           2HE      TYR   9 -10.133   3.313  -5.573
   53    HH   TYR   9           HH       TYR   9 -10.636   1.066  -6.119
   54    H    PHE  10           H        PHE  10  -4.535   5.834  -3.442
   55    HA   PHE  10           HA       PHE  10  -2.962   6.344  -1.010
   56   1HB   PHE  10          2HB       PHE  10  -2.633   7.794  -3.626
   57   2HB   PHE  10          1HB       PHE  10  -1.510   7.719  -2.285
   58    HD1  PHE  10           1HD      PHE  10  -3.126   5.475  -4.802
   59    HD2  PHE  10           2HD      PHE  10   0.299   6.318  -2.421
   60    HE1  PHE  10           1HE      PHE  10  -1.914   3.639  -5.901
   61    HE2  PHE  10           2HE      PHE  10   1.515   4.482  -3.516
   62    HZ   PHE  10           HZ       PHE  10   0.409   3.140  -5.258
   63    H    VAL  11           H        VAL  11  -3.350   8.147   0.151
   64    HA   VAL  11           HA       VAL  11  -4.961  10.322  -0.887
   65    HB   VAL  11           HB       VAL  11  -6.505  10.223   1.153
   66   1HG1  VAL  11          1HG1      VAL  11  -7.783   9.847  -0.659
   67   2HG1  VAL  11          2HG1      VAL  11  -7.816   8.194  -0.045
   68   3HG1  VAL  11          3HG1      VAL  11  -6.680   8.639  -1.319
   69   1HG2  VAL  11          1HG2      VAL  11  -6.851   8.204   2.290
   70   2HG2  VAL  11          2HG2      VAL  11  -5.098   8.386   2.224
   71   3HG2  VAL  11          3HG2      VAL  11  -5.912   7.280   1.117
   72    H    GLY  12           H        GLY  12  -5.458  11.819   1.182
   73   1HA   GLY  12          2HA       GLY  12  -4.652  13.076   2.928
   74   2HA   GLY  12          1HA       GLY  12  -3.450  11.835   3.221
   75    H    ILE  13           H        ILE  13  -2.068  11.759   0.984
   76    HA   ILE  13           HA       ILE  13  -1.307  14.244  -0.133
   77    HB   ILE  13           HB       ILE  13  -0.443  14.597   2.173
   78   1HG1  ILE  13          2HG1      ILE  13   1.736  14.337   0.087
   79   2HG1  ILE  13          1HG1      ILE  13   0.629  15.698   0.240
   80   1HG2  ILE  13          1HG2      ILE  13   0.486  12.921   3.275
   81   2HG2  ILE  13          2HG2      ILE  13   1.885  13.038   2.206
   82   3HG2  ILE  13          3HG2      ILE  13   0.561  11.939   1.811
   83   1HD1  ILE  13          1HD1      ILE  13   2.020  15.133   2.719
   84   2HD1  ILE  13          2HD1      ILE  13   1.875  16.642   1.816
   85   3HD1  ILE  13          3HD1      ILE  13   3.122  15.472   1.385
   86    H    GLY  14           H        GLY  14  -1.956  11.689  -1.031
   87   1HA   GLY  14          2HA       GLY  14  -1.280  10.349  -2.785
   88   2HA   GLY  14          1HA       GLY  14   0.272  11.170  -2.762
   89    H    THR  15           H        THR  15  -0.676   9.952   0.268
   90    HA   THR  15           HA       THR  15   1.280   7.801  -0.005
   91    HB   THR  15           HB       THR  15   1.697   9.314   1.856
   92    HG1  THR  15           1HG      THR  15   0.704   6.854   2.895
   93   1HG2  THR  15          1HG2      THR  15  -1.161   8.782   2.477
   94   2HG2  THR  15          2HG2      THR  15  -0.236  10.278   2.600
   95   3HG2  THR  15          3HG2      THR  15  -0.051   9.023   3.826
   96    HA   PRO  16           HA       PRO  16  -2.019   4.870  -0.180
   97   1HB   PRO  16          2HB       PRO  16  -0.599   2.616   0.332
   98   2HB   PRO  16          1HB       PRO  16  -0.540   3.461  -1.217
   99   1HG   PRO  16          2HG       PRO  16   1.397   3.528   1.058
  100   2HG   PRO  16          1HG       PRO  16   1.715   3.492  -0.686
  101   1HD   PRO  16          2HD       PRO  16   1.847   5.763   0.818
  102   2HD   PRO  16          1HD       PRO  16   1.437   5.758  -0.907
  103    H    ILE  17           H        ILE  17  -3.508   4.566   1.325
  104    HA   ILE  17           HA       ILE  17  -2.637   3.897   4.062
  105    HB   ILE  17           HB       ILE  17  -5.293   5.153   3.337
  106   1HG1  ILE  17          2HG1      ILE  17  -3.446   6.673   2.698
  107   2HG1  ILE  17          1HG1      ILE  17  -4.386   7.304   4.045
  108   1HG2  ILE  17          1HG2      ILE  17  -4.153   4.109   5.759
  109   2HG2  ILE  17          2HG2      ILE  17  -5.780   4.721   5.465
  110   3HG2  ILE  17          3HG2      ILE  17  -4.494   5.829   5.941
  111   1HD1  ILE  17          1HD1      ILE  17  -1.741   5.891   4.301
  112   2HD1  ILE  17          2HD1      ILE  17  -2.660   6.653   5.599
  113   3HD1  ILE  17          3HD1      ILE  17  -1.967   7.641   4.313
  114    H    SER  18           H        SER  18  -2.836   2.052   2.019
  115    HA   SER  18           HA       SER  18  -4.292  -0.017   3.174
  116   1HB   SER  18          2HB       SER  18  -5.992  -0.348   1.315
  117   2HB   SER  18          1HB       SER  18  -6.334   0.971   2.431
  118    HG   SER  18           HG       SER  18  -5.613   2.429   0.901
  119    H    PHE  19           H        PHE  19  -3.823  -1.990   2.190
  120    HA   PHE  19           HA       PHE  19  -2.401  -1.976  -0.366
  121   1HB   PHE  19          2HB       PHE  19  -1.145  -3.405   1.965
  122   2HB   PHE  19          1HB       PHE  19  -0.441  -3.042   0.407
  123    HD1  PHE  19           1HD      PHE  19   0.763  -1.060   0.034
  124    HD2  PHE  19           2HD      PHE  19  -1.450  -1.553   3.636
  125    HE1  PHE  19           1HE      PHE  19   1.872   0.919   0.982
  126    HE2  PHE  19           2HE      PHE  19  -0.350   0.431   4.587
  127    HZ   PHE  19           HZ       PHE  19   1.313   1.669   3.261
  128    H    TYR  20           H        TYR  20  -1.911  -4.245  -1.061
  129    HA   TYR  20           HA       TYR  20  -3.538  -6.304   0.178
  130   1HB   TYR  20          2HB       TYR  20  -4.445  -7.008  -2.095
  131   2HB   TYR  20          1HB       TYR  20  -5.202  -5.634  -1.326
  132    HD1  TYR  20           1HD      TYR  20  -1.988  -5.519  -3.191
  133    HD2  TYR  20           2HD      TYR  20  -6.148  -4.639  -3.251
  134    HE1  TYR  20           1HE      TYR  20  -1.679  -4.224  -5.255
  135    HE2  TYR  20           2HE      TYR  20  -5.847  -3.336  -5.313
  136    HH   TYR  20           HH       TYR  20  -3.189  -2.115  -6.343
  137    H    GLY  21           H        GLY  21  -3.238  -8.413  -1.038
  138   1HA   GLY  21          2HA       GLY  21  -1.796 -10.081  -1.694
  139   2HA   GLY  21          1HA       GLY  21  -0.985  -8.859  -2.663
  Start of MODEL   13
    1   2H    GLY   1           HN2      GLY   1  -7.189  -0.801  -0.260
    2   1HA   GLY   1          2HA       GLY   1  -9.263  -1.302   0.698
    3   2HA   GLY   1          1HA       GLY   1  -9.101  -2.956   0.136
    4    H    GLY   2           H        GLY   2  -6.660  -3.674   1.271
    5   1HA   GLY   2          2HA       GLY   2  -7.269  -3.406   4.153
    6   2HA   GLY   2          1HA       GLY   2  -6.781  -4.927   3.425
    7    H    ALA   3           H        ALA   3  -4.811  -5.427   4.070
    8    HA   ALA   3           HA       ALA   3  -2.710  -3.387   3.897
    9   1HB   ALA   3          1HB       ALA   3  -1.917  -3.725   6.018
   10   2HB   ALA   3          2HB       ALA   3  -2.563  -5.362   6.119
   11   3HB   ALA   3          3HB       ALA   3  -3.639  -3.976   6.301
   12    H    GLY   4           H        GLY   4  -0.720  -4.157   3.216
   13   1HA   GLY   4          2HA       GLY   4   0.092  -6.823   3.140
   14   2HA   GLY   4          1HA       GLY   4  -0.741  -6.485   1.630
   15    H    HIS   5           H        HIS   5   0.822  -6.370   0.140
   16    HA   HIS   5           HA       HIS   5   3.208  -4.745   0.739
   17   1HB   HIS   5          2HB       HIS   5   2.854  -6.782  -1.469
   18   2HB   HIS   5          1HB       HIS   5   4.349  -5.989  -0.998
   19    HD1  HIS   5           1HD      HIS   5   4.335  -8.986  -1.079
   20    HD2  HIS   5           2HD      HIS   5   3.281  -6.852   2.320
   21    HE1  HIS   5           1HE      HIS   5   4.696 -10.563   0.839
   22    HE2  HIS   5           2HE      HIS   5   3.797  -9.329   2.839
   23    H    VAL   6           H        VAL   6   0.834  -5.440  -1.837
   24    HA   VAL   6           HA       VAL   6   1.748  -3.103  -3.311
   25    HB   VAL   6           HB       VAL   6  -0.090  -3.817  -4.948
   26   1HG1  VAL   6          1HG1      VAL   6   2.480  -5.114  -4.340
   27   2HG1  VAL   6          2HG1      VAL   6   1.909  -4.367  -5.832
   28   3HG1  VAL   6          3HG1      VAL   6   1.416  -6.010  -5.423
   29   1HG2  VAL   6          1HG2      VAL   6  -0.347  -6.456  -4.572
   30   2HG2  VAL   6          2HG2      VAL   6  -1.524  -5.284  -3.977
   31   3HG2  VAL   6          3HG2      VAL   6  -0.298  -5.932  -2.889
   32    HA   PRO   7           HA       PRO   7  -1.166  -0.463  -1.259
   33   1HB   PRO   7          2HB       PRO   7  -0.844   1.666  -2.951
   34   2HB   PRO   7          1HB       PRO   7   0.258   1.269  -1.629
   35   1HG   PRO   7          2HG       PRO   7   0.497   0.656  -4.548
   36   2HG   PRO   7          1HG       PRO   7   1.742   1.219  -3.415
   37   1HD   PRO   7          2HD       PRO   7   1.570  -1.356  -4.155
   38   2HD   PRO   7          1HD       PRO   7   2.053  -0.889  -2.512
   39    H    GLU   8           H        GLU   8  -3.255  -0.001  -1.425
   40    HA   GLU   8           HA       GLU   8  -4.650  -0.689  -3.897
   41   1HB   GLU   8          2HB       GLU   8  -5.602  -0.154  -1.083
   42   2HB   GLU   8          1HB       GLU   8  -6.705  -0.362  -2.434
   43   1HG   GLU   8          2HG       GLU   8  -5.746  -2.608  -2.808
   44   2HG   GLU   8          1HG       GLU   8  -4.760  -2.387  -1.364
   45    H    TYR   9           H        TYR   9  -5.224   1.811  -1.431
   46    HA   TYR   9           HA       TYR   9  -5.441   3.794  -3.596
   47   1HB   TYR   9          2HB       TYR   9  -7.262   3.544  -1.195
   48   2HB   TYR   9          1HB       TYR   9  -7.282   4.882  -2.334
   49    HD1  TYR   9           1HD      TYR   9  -7.791   1.200  -2.097
   50    HD2  TYR   9           2HD      TYR   9  -8.575   4.767  -4.280
   51    HE1  TYR   9           1HE      TYR   9  -9.386  -0.023  -3.511
   52    HE2  TYR   9           2HE      TYR   9 -10.174   3.552  -5.698
   53    HH   TYR   9           HH       TYR   9 -10.292   0.387  -6.040
   54    H    PHE  10           H        PHE  10  -4.673   5.805  -3.170
   55    HA   PHE  10           HA       PHE  10  -3.011   6.054  -0.775
   56   1HB   PHE  10          2HB       PHE  10  -3.014   7.679  -3.323
   57   2HB   PHE  10          1HB       PHE  10  -1.946   7.956  -1.963
   58    HD1  PHE  10           1HD      PHE  10   0.198   7.349  -2.412
   59    HD2  PHE  10           2HD      PHE  10  -2.955   4.924  -3.925
   60    HE1  PHE  10           1HE      PHE  10   1.852   5.809  -3.380
   61    HE2  PHE  10           2HE      PHE  10  -1.306   3.377  -4.892
   62    HZ   PHE  10           HZ       PHE  10   1.101   3.819  -4.620
   63    H    VAL  11           H        VAL  11  -3.072   7.914   0.499
   64    HA   VAL  11           HA       VAL  11  -5.705   9.147   0.608
   65    HB   VAL  11           HB       VAL  11  -4.503   8.216   2.648
   66   1HG1  VAL  11          1HG1      VAL  11  -3.086  10.252   3.654
   67   2HG1  VAL  11          2HG1      VAL  11  -2.689  10.419   1.944
   68   3HG1  VAL  11          3HG1      VAL  11  -2.373   8.898   2.781
   69   1HG2  VAL  11          1HG2      VAL  11  -6.458   9.887   2.588
   70   2HG2  VAL  11          2HG2      VAL  11  -5.256  11.083   3.068
   71   3HG2  VAL  11          3HG2      VAL  11  -5.566   9.685   4.097
   72    H    GLY  12           H        GLY  12  -5.631  11.594   1.256
   73   1HA   GLY  12          2HA       GLY  12  -4.589  12.999  -0.973
   74   2HA   GLY  12          1HA       GLY  12  -5.437  13.692   0.387
   75    H    ILE  13           H        ILE  13  -2.394  11.930   0.397
   76    HA   ILE  13           HA       ILE  13  -0.872  14.355   0.683
   77    HB   ILE  13           HB       ILE  13  -1.776  13.924   3.002
   78   1HG1  ILE  13          2HG1      ILE  13   0.406  14.347   4.121
   79   2HG1  ILE  13          1HG1      ILE  13   1.223  13.934   2.616
   80   1HG2  ILE  13          1HG2      ILE  13  -0.621  12.211   4.352
   81   2HG2  ILE  13          2HG2      ILE  13   0.091  11.570   2.871
   82   3HG2  ILE  13          3HG2      ILE  13  -1.658  11.533   3.097
   83   1HD1  ILE  13          1HD1      ILE  13   0.989  16.368   3.024
   84   2HD1  ILE  13          2HD1      ILE  13  -0.759  16.177   2.896
   85   3HD1  ILE  13          3HD1      ILE  13   0.272  15.822   1.509
   86    H    GLY  14           H        GLY  14  -1.035  12.094  -1.060
   87   1HA   GLY  14          2HA       GLY  14   0.350  10.785  -2.319
   88   2HA   GLY  14          1HA       GLY  14   1.657  11.739  -1.650
   89    H    THR  15           H        THR  15  -0.511   9.408  -0.017
   90    HA   THR  15           HA       THR  15   1.651   7.504   0.140
   91    HB   THR  15           HB       THR  15   2.134   9.013   2.049
   92    HG1  THR  15           1HG      THR  15   2.784   7.298   3.101
   93   1HG2  THR  15          1HG2      THR  15  -0.618   8.175   2.924
   94   2HG2  THR  15          2HG2      THR  15   0.027   9.807   2.748
   95   3HG2  THR  15          3HG2      THR  15   0.596   8.769   4.056
   96    HA   PRO  16           HA       PRO  16  -1.902   4.893  -0.054
   97   1HB   PRO  16          2HB       PRO  16  -0.681   2.506   0.173
   98   2HB   PRO  16          1HB       PRO  16  -0.535   3.507  -1.276
   99   1HG   PRO  16          2HG       PRO  16   1.389   3.141   0.979
  100   2HG   PRO  16          1HG       PRO  16   1.710   3.265  -0.759
  101   1HD   PRO  16          2HD       PRO  16   2.013   5.336   1.020
  102   2HD   PRO  16          1HD       PRO  16   1.707   5.549  -0.713
  103    H    ILE  17           H        ILE  17  -3.368   4.461   1.454
  104    HA   ILE  17           HA       ILE  17  -2.440   3.566   4.105
  105    HB   ILE  17           HB       ILE  17  -5.075   4.955   3.583
  106   1HG1  ILE  17          2HG1      ILE  17  -3.217   6.462   2.949
  107   2HG1  ILE  17          1HG1      ILE  17  -4.073   7.031   4.376
  108   1HG2  ILE  17          1HG2      ILE  17  -5.306   5.120   5.885
  109   2HG2  ILE  17          2HG2      ILE  17  -3.579   4.914   6.176
  110   3HG2  ILE  17          3HG2      ILE  17  -4.564   3.532   5.693
  111   1HD1  ILE  17          1HD1      ILE  17  -1.300   6.473   4.043
  112   2HD1  ILE  17          2HD1      ILE  17  -1.959   5.421   5.296
  113   3HD1  ILE  17          3HD1      ILE  17  -2.137   7.172   5.429
  114    H    SER  18           H        SER  18  -2.783   1.867   1.949
  115    HA   SER  18           HA       SER  18  -4.347  -0.182   3.027
  116   1HB   SER  18          2HB       SER  18  -6.082  -0.322   1.193
  117   2HB   SER  18          1HB       SER  18  -6.315   1.003   2.330
  118    HG   SER  18           HG       SER  18  -5.399   2.408   0.806
  119    H    PHE  19           H        PHE  19  -4.050  -2.127   1.926
  120    HA   PHE  19           HA       PHE  19  -2.593  -2.083  -0.609
  121   1HB   PHE  19          2HB       PHE  19  -1.548  -3.738   1.685
  122   2HB   PHE  19          1HB       PHE  19  -0.798  -3.466   0.126
  123    HD1  PHE  19           1HD      PHE  19  -1.615  -1.870   3.361
  124    HD2  PHE  19           2HD      PHE  19   0.645  -1.646  -0.238
  125    HE1  PHE  19           1HE      PHE  19  -0.289  -0.029   4.312
  126    HE2  PHE  19           2HE      PHE  19   1.973   0.195   0.707
  127    HZ   PHE  19           HZ       PHE  19   1.507   1.006   2.985
  128    H    TYR  20           H        TYR  20  -2.270  -4.483  -1.341
  129    HA   TYR  20           HA       TYR  20  -4.858  -5.800  -0.908
  130   1HB   TYR  20          2HB       TYR  20  -2.736  -6.319  -3.001
  131   2HB   TYR  20          1HB       TYR  20  -4.271  -7.170  -2.891
  132    HD1  TYR  20           1HD      TYR  20  -6.289  -6.188  -3.716
  133    HD2  TYR  20           2HD      TYR  20  -2.678  -3.938  -3.675
  134    HE1  TYR  20           1HE      TYR  20  -7.324  -4.508  -5.185
  135    HE2  TYR  20           2HE      TYR  20  -3.706  -2.251  -5.137
  136    HH   TYR  20           HH       TYR  20  -5.511  -1.646  -6.264
  137    H    GLY  21           H        GLY  21  -1.482  -6.768  -1.275
  138   1HA   GLY  21          2HA       GLY  21  -1.414  -8.358   1.062
  139   2HA   GLY  21          1HA       GLY  21  -1.672  -9.369  -0.359
  Start of MODEL   14
    1   2H    GLY   1           HN2      GLY   1  -7.215  -0.874  -0.112
    2   1HA   GLY   1          2HA       GLY   1  -9.284  -1.508   0.776
    3   2HA   GLY   1          1HA       GLY   1  -8.924  -3.176   0.369
    4    H    GLY   2           H        GLY   2  -6.509  -3.549   1.700
    5   1HA   GLY   2          2HA       GLY   2  -7.128  -2.885   4.501
    6   2HA   GLY   2          1HA       GLY   2  -6.921  -4.568   4.045
    7    H    ALA   3           H        ALA   3  -4.998  -5.337   4.553
    8    HA   ALA   3           HA       ALA   3  -2.656  -3.571   4.300
    9   1HB   ALA   3          1HB       ALA   3  -1.690  -4.511   6.280
   10   2HB   ALA   3          2HB       ALA   3  -3.006  -5.674   6.434
   11   3HB   ALA   3          3HB       ALA   3  -3.315  -3.956   6.680
   12    H    GLY   4           H        GLY   4  -0.795  -4.511   3.472
   13   1HA   GLY   4          2HA       GLY   4  -0.377  -7.265   3.129
   14   2HA   GLY   4          1HA       GLY   4  -1.135  -6.634   1.675
   15    H    HIS   5           H        HIS   5   0.338  -6.318   0.133
   16    HA   HIS   5           HA       HIS   5   2.944  -5.200   0.961
   17   1HB   HIS   5          2HB       HIS   5   2.424  -7.010  -1.406
   18   2HB   HIS   5          1HB       HIS   5   3.987  -6.382  -0.897
   19    HD1  HIS   5           1HD      HIS   5   4.199  -7.045   1.967
   20    HD2  HIS   5           2HD      HIS   5   2.340  -9.609  -0.721
   21    HE1  HIS   5           1HE      HIS   5   4.282  -9.319   3.039
   22    HE2  HIS   5           2HE      HIS   5   2.992 -10.811   1.469
   23    H    VAL   6           H        VAL   6   0.869  -5.483  -1.946
   24    HA   VAL   6           HA       VAL   6   1.965  -2.970  -2.934
   25    HB   VAL   6           HB       VAL   6  -0.132  -4.760  -4.173
   26   1HG1  VAL   6          1HG1      VAL   6   0.600  -3.579  -6.281
   27   2HG1  VAL   6          2HG1      VAL   6   1.428  -2.419  -5.242
   28   3HG1  VAL   6          3HG1      VAL   6  -0.323  -2.603  -5.137
   29   1HG2  VAL   6          1HG2      VAL   6   1.762  -5.469  -5.659
   30   2HG2  VAL   6          2HG2      VAL   6   1.876  -6.023  -3.988
   31   3HG2  VAL   6          3HG2      VAL   6   2.854  -4.661  -4.535
   32    HA   PRO   7           HA       PRO   7  -1.145  -0.486  -1.002
   33   1HB   PRO   7          2HB       PRO   7  -0.858   1.692  -2.663
   34   2HB   PRO   7          1HB       PRO   7   0.173   1.337  -1.274
   35   1HG   PRO   7          2HG       PRO   7   0.640   0.780  -4.175
   36   2HG   PRO   7          1HG       PRO   7   1.776   1.374  -2.949
   37   1HD   PRO   7          2HD       PRO   7   1.791  -1.183  -3.735
   38   2HD   PRO   7          1HD       PRO   7   2.095  -0.737  -2.043
   39    H    GLU   8           H        GLU   8  -3.233  -0.073  -1.213
   40    HA   GLU   8           HA       GLU   8  -4.573  -0.789  -3.701
   41   1HB   GLU   8          2HB       GLU   8  -5.686  -0.117  -0.966
   42   2HB   GLU   8          1HB       GLU   8  -6.641  -0.644  -2.344
   43   1HG   GLU   8          2HG       GLU   8  -5.373  -2.769  -2.342
   44   2HG   GLU   8          1HG       GLU   8  -4.562  -2.234  -0.871
   45    H    TYR   9           H        TYR   9  -5.217   1.729  -1.267
   46    HA   TYR   9           HA       TYR   9  -5.524   3.665  -3.468
   47   1HB   TYR   9          2HB       TYR   9  -7.211   3.427  -0.971
   48   2HB   TYR   9          1HB       TYR   9  -7.291   4.775  -2.094
   49    HD1  TYR   9           1HD      TYR   9  -8.742   4.696  -3.909
   50    HD2  TYR   9           2HD      TYR   9  -7.720   1.073  -1.926
   51    HE1  TYR   9           1HE      TYR   9 -10.426   3.497  -5.242
   52    HE2  TYR   9           2HE      TYR   9  -9.396  -0.135  -3.258
   53    HH   TYR   9           HH       TYR   9 -10.956   1.276  -5.973
   54    H    PHE  10           H        PHE  10  -4.814   5.724  -3.127
   55    HA   PHE  10           HA       PHE  10  -3.095   6.118  -0.775
   56   1HB   PHE  10          2HB       PHE  10  -2.988   7.522  -3.451
   57   2HB   PHE  10          1HB       PHE  10  -1.892   7.793  -2.112
   58    HD1  PHE  10           1HD      PHE  10  -3.123   4.798  -4.008
   59    HD2  PHE  10           2HD      PHE  10   0.190   6.958  -2.434
   60    HE1  PHE  10           1HE      PHE  10  -1.592   3.096  -4.904
   61    HE2  PHE  10           2HE      PHE  10   1.725   5.256  -3.326
   62    HZ   PHE  10           HZ       PHE  10   0.836   3.324  -4.563
   63    H    VAL  11           H        VAL  11  -3.145   8.120   0.299
   64    HA   VAL  11           HA       VAL  11  -5.713   9.495   0.060
   65    HB   VAL  11           HB       VAL  11  -5.138  10.613   2.181
   66   1HG1  VAL  11          1HG1      VAL  11  -6.402   8.760   2.620
   67   2HG1  VAL  11          2HG1      VAL  11  -4.947   8.378   3.542
   68   3HG1  VAL  11          3HG1      VAL  11  -5.204   7.647   1.957
   69   1HG2  VAL  11          1HG2      VAL  11  -2.782  10.760   2.133
   70   2HG2  VAL  11          2HG2      VAL  11  -2.602   9.017   1.930
   71   3HG2  VAL  11          3HG2      VAL  11  -3.173   9.672   3.465
   72    H    GLY  12           H        GLY  12  -5.496  11.958   0.626
   73   1HA   GLY  12          2HA       GLY  12  -4.302  13.208  -1.575
   74   2HA   GLY  12          1HA       GLY  12  -4.933  14.032  -0.163
   75    H    ILE  13           H        ILE  13  -2.956  12.393   1.484
   76    HA   ILE  13           HA       ILE  13  -0.823  14.333   1.330
   77    HB   ILE  13           HB       ILE  13  -0.806  11.977   3.198
   78   1HG1  ILE  13          2HG1      ILE  13  -2.352  14.549   3.621
   79   2HG1  ILE  13          1HG1      ILE  13  -3.083  12.990   3.253
   80   1HG2  ILE  13          1HG2      ILE  13   1.107  13.636   3.009
   81   2HG2  ILE  13          2HG2      ILE  13   0.447  13.388   4.625
   82   3HG2  ILE  13          3HG2      ILE  13   0.012  14.830   3.708
   83   1HD1  ILE  13          1HD1      ILE  13  -1.369  12.676   5.498
   84   2HD1  ILE  13          2HD1      ILE  13  -3.120  12.493   5.403
   85   3HD1  ILE  13          3HD1      ILE  13  -2.419  14.069   5.770
   86    H    GLY  14           H        GLY  14  -1.133  12.433  -0.844
   87   1HA   GLY  14          2HA       GLY  14   0.100  11.057  -2.209
   88   2HA   GLY  14          1HA       GLY  14   1.459  11.969  -1.580
   89    H    THR  15           H        THR  15  -0.648   9.607   0.063
   90    HA   THR  15           HA       THR  15   1.518   7.686   0.107
   91    HB   THR  15           HB       THR  15   2.108   9.033   2.034
   92    HG1  THR  15           1HG      THR  15   0.844   6.704   3.061
   93   1HG2  THR  15          1HG2      THR  15   0.500   9.074   4.005
   94   2HG2  THR  15          2HG2      THR  15  -0.755   8.618   2.853
   95   3HG2  THR  15          3HG2      THR  15   0.118  10.136   2.649
   96    HA   PRO  16           HA       PRO  16  -1.939   4.950  -0.121
   97   1HB   PRO  16          2HB       PRO  16  -0.695   2.632   0.541
   98   2HB   PRO  16          1HB       PRO  16  -0.494   3.417  -1.030
   99   1HG   PRO  16          2HG       PRO  16   1.301   3.474   1.363
  100   2HG   PRO  16          1HG       PRO  16   1.724   3.313  -0.352
  101   1HD   PRO  16          2HD       PRO  16   1.938   5.653   0.999
  102   2HD   PRO  16          1HD       PRO  16   1.561   5.576  -0.734
  103    H    ILE  17           H        ILE  17  -3.502   4.212   1.224
  104    HA   ILE  17           HA       ILE  17  -2.802   3.907   4.068
  105    HB   ILE  17           HB       ILE  17  -4.063   6.024   3.571
  106   1HG1  ILE  17          2HG1      ILE  17  -5.542   4.032   5.307
  107   2HG1  ILE  17          1HG1      ILE  17  -4.130   4.958   5.802
  108   1HG2  ILE  17          1HG2      ILE  17  -5.465   5.311   1.770
  109   2HG2  ILE  17          2HG2      ILE  17  -6.499   5.808   3.109
  110   3HG2  ILE  17          3HG2      ILE  17  -6.238   4.094   2.786
  111   1HD1  ILE  17          1HD1      ILE  17  -6.011   6.815   4.848
  112   2HD1  ILE  17          2HD1      ILE  17  -5.482   6.554   6.510
  113   3HD1  ILE  17          3HD1      ILE  17  -6.884   5.686   5.884
  114    H    SER  18           H        SER  18  -2.920   1.976   1.978
  115    HA   SER  18           HA       SER  18  -4.228  -0.131   3.251
  116   1HB   SER  18          2HB       SER  18  -5.995  -0.573   1.471
  117   2HB   SER  18          1HB       SER  18  -6.339   0.758   2.573
  118    HG   SER  18           HG       SER  18  -5.804   2.206   0.996
  119    H    PHE  19           H        PHE  19  -3.854  -2.135   2.205
  120    HA   PHE  19           HA       PHE  19  -2.440  -2.126  -0.351
  121   1HB   PHE  19          2HB       PHE  19  -1.238  -3.583   2.002
  122   2HB   PHE  19          1HB       PHE  19  -0.526  -3.315   0.424
  123    HD1  PHE  19           1HD      PHE  19  -1.454  -1.648   3.596
  124    HD2  PHE  19           2HD      PHE  19   0.796  -1.428  -0.010
  125    HE1  PHE  19           1HE      PHE  19  -0.257   0.317   4.468
  126    HE2  PHE  19           2HE      PHE  19   1.996   0.539   0.856
  127    HZ   PHE  19           HZ       PHE  19   1.469   1.412   3.097
  128    H    TYR  20           H        TYR  20  -1.966  -4.511  -0.957
  129    HA   TYR  20           HA       TYR  20  -3.885  -6.352   0.227
  130   1HB   TYR  20          2HB       TYR  20  -4.549  -7.103  -2.154
  131   2HB   TYR  20          1HB       TYR  20  -5.307  -5.681  -1.473
  132    HD1  TYR  20           1HD      TYR  20  -2.034  -6.118  -3.277
  133    HD2  TYR  20           2HD      TYR  20  -5.867  -4.282  -3.190
  134    HE1  TYR  20           1HE      TYR  20  -1.472  -4.842  -5.303
  135    HE2  TYR  20           2HE      TYR  20  -5.307  -2.997  -5.205
  136    HH   TYR  20           HH       TYR  20  -2.786  -2.227  -6.250
  137    H    GLY  21           H        GLY  21  -2.950  -7.607  -2.702
  138   1HA   GLY  21          2HA       GLY  21  -1.357  -9.615  -1.584
  139   2HA   GLY  21          1HA       GLY  21  -1.449  -9.232  -3.297
  Start of MODEL   15
    1   2H    GLY   1           HN2      GLY   1  -7.090  -0.693  -0.357
    2   1HA   GLY   1          2HA       GLY   1  -8.929  -1.098   0.954
    3   2HA   GLY   1          1HA       GLY   1  -9.333  -2.382  -0.171
    4    H    GLY   2           H        GLY   2  -6.431  -2.186   1.828
    5   1HA   GLY   2          2HA       GLY   2  -7.294  -3.781   3.957
    6   2HA   GLY   2          1HA       GLY   2  -6.624  -4.839   2.721
    7    H    ALA   3           H        ALA   3  -4.733  -5.471   3.615
    8    HA   ALA   3           HA       ALA   3  -2.693  -3.419   3.959
    9   1HB   ALA   3          1HB       ALA   3  -2.006  -4.890   6.075
   10   2HB   ALA   3          2HB       ALA   3  -3.753  -5.122   6.142
   11   3HB   ALA   3          3HB       ALA   3  -3.075  -3.494   6.201
   12    H    GLY   4           H        GLY   4  -0.703  -4.092   3.308
   13   1HA   GLY   4          2HA       GLY   4   0.281  -6.691   3.295
   14   2HA   GLY   4          1HA       GLY   4  -0.524  -6.445   1.754
   15    H    HIS   5           H        HIS   5   0.982  -6.124   0.252
   16    HA   HIS   5           HA       HIS   5   3.199  -4.282   0.895
   17   1HB   HIS   5          2HB       HIS   5   3.338  -6.403  -1.239
   18   2HB   HIS   5          1HB       HIS   5   4.661  -5.527  -0.481
   19    HD1  HIS   5           1HD      HIS   5   4.321  -6.049   2.428
   20    HD2  HIS   5           2HD      HIS   5   3.543  -8.953  -0.437
   21    HE1  HIS   5           1HE      HIS   5   4.503  -8.249   3.631
   22    HE2  HIS   5           2HE      HIS   5   3.749  -9.949   1.934
   23    H    VAL   6           H        VAL   6   0.848  -5.293  -1.548
   24    HA   VAL   6           HA       VAL   6   1.726  -3.201  -3.373
   25    HB   VAL   6           HB       VAL   6  -0.650  -5.053  -3.643
   26   1HG1  VAL   6          1HG1      VAL   6   0.223  -4.430  -6.161
   27   2HG1  VAL   6          2HG1      VAL   6   0.468  -2.915  -5.291
   28   3HG1  VAL   6          3HG1      VAL   6  -1.130  -3.661  -5.330
   29   1HG2  VAL   6          1HG2      VAL   6   0.723  -6.497  -4.977
   30   2HG2  VAL   6          2HG2      VAL   6   1.519  -6.257  -3.421
   31   3HG2  VAL   6          3HG2      VAL   6   2.092  -5.393  -4.847
   32    HA   PRO   7           HA       PRO   7  -0.961  -0.266  -1.319
   33   1HB   PRO   7          2HB       PRO   7  -0.588   1.729  -3.170
   34   2HB   PRO   7          1HB       PRO   7   0.513   1.387  -1.831
   35   1HG   PRO   7          2HG       PRO   7   0.700   0.562  -4.700
   36   2HG   PRO   7          1HG       PRO   7   1.977   1.143  -3.615
   37   1HD   PRO   7          2HD       PRO   7   1.690  -1.464  -4.181
   38   2HD   PRO   7          1HD       PRO   7   2.198  -0.911  -2.571
   39    H    GLU   8           H        GLU   8  -3.072   0.090  -1.449
   40    HA   GLU   8           HA       GLU   8  -4.488  -0.613  -3.897
   41   1HB   GLU   8          2HB       GLU   8  -5.336  -0.145  -1.053
   42   2HB   GLU   8          1HB       GLU   8  -6.522  -0.146  -2.350
   43   1HG   GLU   8          2HG       GLU   8  -5.736  -2.427  -2.966
   44   2HG   GLU   8          1HG       GLU   8  -4.724  -2.408  -1.523
   45    H    TYR   9           H        TYR   9  -5.074   1.937  -1.487
   46    HA   TYR   9           HA       TYR   9  -5.306   3.863  -3.701
   47   1HB   TYR   9          2HB       TYR   9  -7.135   3.638  -1.303
   48   2HB   TYR   9          1HB       TYR   9  -7.162   4.964  -2.458
   49    HD1  TYR   9           1HD      TYR   9  -7.645   1.283  -2.172
   50    HD2  TYR   9           2HD      TYR   9  -8.427   4.808  -4.422
   51    HE1  TYR   9           1HE      TYR   9  -9.218   0.027  -3.583
   52    HE2  TYR   9           2HE      TYR   9 -10.002   3.561  -5.839
   53    HH   TYR   9           HH       TYR   9 -10.094   0.404  -6.145
   54    H    PHE  10           H        PHE  10  -4.615   5.925  -3.310
   55    HA   PHE  10           HA       PHE  10  -3.076   6.315  -0.830
   56   1HB   PHE  10          2HB       PHE  10  -2.688   7.948  -3.317
   57   2HB   PHE  10          1HB       PHE  10  -1.562   7.674  -2.002
   58    HD1  PHE  10           1HD      PHE  10  -3.228   5.935  -4.844
   59    HD2  PHE  10           2HD      PHE  10   0.093   6.065  -2.186
   60    HE1  PHE  10           1HE      PHE  10  -2.126   4.160  -6.139
   61    HE2  PHE  10           2HE      PHE  10   1.199   4.290  -3.477
   62    HZ   PHE  10           HZ       PHE  10   0.091   3.334  -5.457
   63    H    VAL  11           H        VAL  11  -3.548   8.045   0.437
   64    HA   VAL  11           HA       VAL  11  -5.250  10.193  -0.581
   65    HB   VAL  11           HB       VAL  11  -6.053   8.562   1.843
   66   1HG1  VAL  11          1HG1      VAL  11  -7.313  11.010   0.622
   67   2HG1  VAL  11          2HG1      VAL  11  -6.567  10.880   2.214
   68   3HG1  VAL  11          3HG1      VAL  11  -8.061  10.011   1.868
   69   1HG2  VAL  11          1HG2      VAL  11  -7.526   7.424   0.604
   70   2HG2  VAL  11          2HG2      VAL  11  -6.581   7.963  -0.783
   71   3HG2  VAL  11          3HG2      VAL  11  -8.015   8.863  -0.291
   72    H    GLY  12           H        GLY  12  -5.071  12.105   0.558
   73   1HA   GLY  12          2HA       GLY  12  -4.478  13.445   2.411
   74   2HA   GLY  12          1HA       GLY  12  -3.419  12.166   2.967
   75    H    ILE  13           H        ILE  13  -1.741  11.646   1.188
   76    HA   ILE  13           HA       ILE  13  -0.688  13.985  -0.174
   77    HB   ILE  13           HB       ILE  13   1.610  13.577   0.905
   78   1HG1  ILE  13          2HG1      ILE  13  -0.135  12.415   3.087
   79   2HG1  ILE  13          1HG1      ILE  13   0.975  11.495   2.079
   80   1HG2  ILE  13          1HG2      ILE  13   0.525  15.646   1.266
   81   2HG2  ILE  13          2HG2      ILE  13   1.055  15.074   2.848
   82   3HG2  ILE  13          3HG2      ILE  13  -0.638  14.923   2.378
   83   1HD1  ILE  13          1HD1      ILE  13   1.486  12.965   4.486
   84   2HD1  ILE  13          2HD1      ILE  13   2.501  13.559   3.172
   85   3HD1  ILE  13          3HD1      ILE  13   2.532  11.850   3.607
   86    H    GLY  14           H        GLY  14  -1.671  11.558  -1.136
   87   1HA   GLY  14          2HA       GLY  14  -1.130  10.003  -2.738
   88   2HA   GLY  14          1HA       GLY  14   0.462  10.745  -2.820
   89    H    THR  15           H        THR  15  -0.702   9.588   0.219
   90    HA   THR  15           HA       THR  15   1.274   7.432   0.109
   91    HB   THR  15           HB       THR  15   1.621   9.050   1.923
   92    HG1  THR  15           1HG      THR  15   1.744   7.510   3.598
   93   1HG2  THR  15          1HG2      THR  15   0.073   9.614   3.534
   94   2HG2  THR  15          2HG2      THR  15  -0.867   8.139   3.302
   95   3HG2  THR  15          3HG2      THR  15  -0.962   9.441   2.117
   96    HA   PRO  16           HA       PRO  16  -2.142   4.635  -0.043
   97   1HB   PRO  16          2HB       PRO  16  -0.785   2.323   0.287
   98   2HB   PRO  16          1HB       PRO  16  -0.758   3.252  -1.214
   99   1HG   PRO  16          2HG       PRO  16   1.287   3.076   0.946
  100   2HG   PRO  16          1HG       PRO  16   1.513   3.208  -0.806
  101   1HD   PRO  16          2HD       PRO  16   1.748   5.305   0.972
  102   2HD   PRO  16          1HD       PRO  16   1.411   5.484  -0.759
  103    H    ILE  17           H        ILE  17  -3.523   4.526   1.565
  104    HA   ILE  17           HA       ILE  17  -2.584   3.667   4.208
  105    HB   ILE  17           HB       ILE  17  -4.613   4.594   5.164
  106   1HG1  ILE  17          2HG1      ILE  17  -6.079   4.147   3.154
  107   2HG1  ILE  17          1HG1      ILE  17  -6.324   5.709   3.922
  108   1HG2  ILE  17          1HG2      ILE  17  -4.271   7.025   4.485
  109   2HG2  ILE  17          2HG2      ILE  17  -3.046   6.415   3.372
  110   3HG2  ILE  17          3HG2      ILE  17  -2.873   6.149   5.108
  111   1HD1  ILE  17          1HD1      ILE  17  -5.583   6.857   2.119
  112   2HD1  ILE  17          2HD1      ILE  17  -6.145   5.403   1.294
  113   3HD1  ILE  17          3HD1      ILE  17  -4.431   5.606   1.653
  114    H    SER  18           H        SER  18  -2.978   1.951   1.995
  115    HA   SER  18           HA       SER  18  -4.294  -0.197   3.219
  116   1HB   SER  18          2HB       SER  18  -6.146  -0.457   1.507
  117   2HB   SER  18          1HB       SER  18  -6.386   0.831   2.682
  118    HG   SER  18           HG       SER  18  -5.725   2.320   1.126
  119    H    PHE  19           H        PHE  19  -3.921  -2.122   2.123
  120    HA   PHE  19           HA       PHE  19  -2.588  -1.943  -0.487
  121   1HB   PHE  19          2HB       PHE  19  -1.507  -3.665   1.747
  122   2HB   PHE  19          1HB       PHE  19  -0.795  -3.399   0.167
  123    HD1  PHE  19           1HD      PHE  19  -1.550  -1.760   3.402
  124    HD2  PHE  19           2HD      PHE  19   0.677  -1.621  -0.222
  125    HE1  PHE  19           1HE      PHE  19  -0.189   0.077   4.312
  126    HE2  PHE  19           2HE      PHE  19   2.041   0.215   0.682
  127    HZ   PHE  19           HZ       PHE  19   1.609   1.066   2.952
  128    H    TYR  20           H        TYR  20  -2.228  -4.304  -1.320
  129    HA   TYR  20           HA       TYR  20  -4.820  -5.633  -1.067
  130   1HB   TYR  20          2HB       TYR  20  -2.528  -6.095  -2.988
  131   2HB   TYR  20          1HB       TYR  20  -4.027  -7.013  -2.999
  132    HD1  TYR  20           1HD      TYR  20  -6.044  -6.082  -3.910
  133    HD2  TYR  20           2HD      TYR  20  -2.501  -3.741  -3.693
  134    HE1  TYR  20           1HE      TYR  20  -7.046  -4.434  -5.436
  135    HE2  TYR  20           2HE      TYR  20  -3.495  -2.084  -5.212
  136    HH   TYR  20           HH       TYR  20  -5.274  -1.505  -6.394
  137    H    GLY  21           H        GLY  21  -1.421  -6.577  -1.114
  138   1HA   GLY  21          2HA       GLY  21  -1.569  -8.204   1.185
  139   2HA   GLY  21          1HA       GLY  21  -1.680  -9.196  -0.268
  Start of MODEL   16
    1   2H    GLY   1           HN2      GLY   1  -7.092  -0.748  -0.104
    2   1HA   GLY   1          2HA       GLY   1  -8.949  -1.249   1.137
    3   2HA   GLY   1          1HA       GLY   1  -9.196  -2.565   0.005
    4    H    GLY   2           H        GLY   2  -6.458  -2.230   2.218
    5   1HA   GLY   2          2HA       GLY   2  -7.290  -3.643   4.396
    6   2HA   GLY   2          1HA       GLY   2  -6.897  -4.883   3.213
    7    H    ALA   3           H        ALA   3  -5.081  -5.743   4.027
    8    HA   ALA   3           HA       ALA   3  -2.763  -3.957   4.293
    9   1HB   ALA   3          1HB       ALA   3  -2.245  -4.656   6.366
   10   2HB   ALA   3          2HB       ALA   3  -2.702  -6.324   6.022
   11   3HB   ALA   3          3HB       ALA   3  -3.938  -5.142   6.453
   12    H    GLY   4           H        GLY   4  -0.854  -4.756   3.468
   13   1HA   GLY   4          2HA       GLY   4  -0.335  -7.441   2.841
   14   2HA   GLY   4          1HA       GLY   4  -1.004  -6.657   1.416
   15    H    HIS   5           H        HIS   5   0.576  -6.191   0.054
   16    HA   HIS   5           HA       HIS   5   3.007  -4.919   1.139
   17   1HB   HIS   5          2HB       HIS   5   2.767  -7.096  -0.919
   18   2HB   HIS   5          1HB       HIS   5   4.144  -6.002  -0.935
   19    HD1  HIS   5           1HD      HIS   5   4.969  -8.759  -0.513
   20    HD2  HIS   5           2HD      HIS   5   3.649  -6.429   2.670
   21    HE1  HIS   5           1HE      HIS   5   5.925  -9.832   1.552
   22    HE2  HIS   5           2HE      HIS   5   5.082  -8.428   3.468
   23    H    VAL   6           H        VAL   6   0.905  -5.294  -1.702
   24    HA   VAL   6           HA       VAL   6   2.050  -2.904  -2.912
   25    HB   VAL   6           HB       VAL   6  -0.264  -4.567  -3.922
   26   1HG1  VAL   6          1HG1      VAL   6   0.429  -2.134  -4.769
   27   2HG1  VAL   6          2HG1      VAL   6  -0.179  -3.383  -5.855
   28   3HG1  VAL   6          3HG1      VAL   6   1.555  -3.090  -5.732
   29   1HG2  VAL   6          1HG2      VAL   6   2.140  -5.641  -3.537
   30   2HG2  VAL   6          2HG2      VAL   6   2.442  -4.865  -5.091
   31   3HG2  VAL   6          3HG2      VAL   6   1.138  -6.043  -4.932
   32    HA   PRO   7           HA       PRO   7  -0.887  -0.279  -0.851
   33   1HB   PRO   7          2HB       PRO   7  -0.563   1.900  -2.491
   34   2HB   PRO   7          1HB       PRO   7   0.519   1.481  -1.158
   35   1HG   PRO   7          2HG       PRO   7   0.819   0.949  -4.086
   36   2HG   PRO   7          1HG       PRO   7   2.039   1.477  -2.912
   37   1HD   PRO   7          2HD       PRO   7   1.886  -1.073  -3.739
   38   2HD   PRO   7          1HD       PRO   7   2.334  -0.660  -2.072
   39    H    GLU   8           H        GLU   8  -2.996   0.080  -1.017
   40    HA   GLU   8           HA       GLU   8  -4.348  -0.554  -3.515
   41   1HB   GLU   8          2HB       GLU   8  -5.379  -0.030  -0.725
   42   2HB   GLU   8          1HB       GLU   8  -6.422  -0.341  -2.104
   43   1HG   GLU   8          2HG       GLU   8  -5.259  -2.535  -2.375
   44   2HG   GLU   8          1HG       GLU   8  -4.442  -2.215  -0.845
   45    H    TYR   9           H        TYR   9  -5.075   1.899  -1.041
   46    HA   TYR   9           HA       TYR   9  -5.405   3.860  -3.215
   47   1HB   TYR   9          2HB       TYR   9  -7.056   3.573  -0.700
   48   2HB   TYR   9          1HB       TYR   9  -7.172   4.930  -1.810
   49    HD1  TYR   9           1HD      TYR   9  -7.501   1.210  -1.710
   50    HD2  TYR   9           2HD      TYR   9  -8.677   4.849  -3.575
   51    HE1  TYR   9           1HE      TYR   9  -9.163  -0.017  -3.043
   52    HE2  TYR   9           2HE      TYR   9 -10.344   3.631  -4.911
   53    HH   TYR   9           HH       TYR   9 -10.963   1.532  -5.614
   54    H    PHE  10           H        PHE  10  -4.715   5.913  -2.887
   55    HA   PHE  10           HA       PHE  10  -3.031   6.367  -0.514
   56   1HB   PHE  10          2HB       PHE  10  -2.834   7.729  -3.209
   57   2HB   PHE  10          1HB       PHE  10  -1.738   7.934  -1.857
   58    HD1  PHE  10           1HD      PHE  10   0.266   6.863  -1.969
   59    HD2  PHE  10           2HD      PHE  10  -3.064   5.161  -3.997
   60    HE1  PHE  10           1HE      PHE  10   1.724   5.108  -2.883
   61    HE2  PHE  10           2HE      PHE  10  -1.613   3.397  -4.908
   62    HZ   PHE  10           HZ       PHE  10   0.786   3.371  -4.353
   63    H    VAL  11           H        VAL  11  -3.130   8.405   0.493
   64    HA   VAL  11           HA       VAL  11  -5.712   9.704   0.253
   65    HB   VAL  11           HB       VAL  11  -4.988  11.072   2.187
   66   1HG1  VAL  11          1HG1      VAL  11  -4.834   9.178   3.815
   67   2HG1  VAL  11          2HG1      VAL  11  -4.717   8.086   2.436
   68   3HG1  VAL  11          3HG1      VAL  11  -6.167   9.062   2.665
   69   1HG2  VAL  11          1HG2      VAL  11  -2.426  10.393   1.386
   70   2HG2  VAL  11          2HG2      VAL  11  -2.670   9.476   2.873
   71   3HG2  VAL  11          3HG2      VAL  11  -2.875  11.227   2.874
   72    H    GLY  12           H        GLY  12  -5.149  12.317   0.913
   73   1HA   GLY  12          2HA       GLY  12  -4.676  13.495  -1.564
   74   2HA   GLY  12          1HA       GLY  12  -4.664  14.346  -0.034
   75    H    ILE  13           H        ILE  13  -2.467  13.061   1.135
   76    HA   ILE  13           HA       ILE  13  -0.339  14.391  -0.314
   77    HB   ILE  13           HB       ILE  13   1.048  13.820   1.716
   78   1HG1  ILE  13          2HG1      ILE  13  -1.647  13.007   2.830
   79   2HG1  ILE  13          1HG1      ILE  13  -0.322  11.903   2.479
   80   1HG2  ILE  13          1HG2      ILE  13  -0.075  15.525   3.131
   81   2HG2  ILE  13          2HG2      ILE  13  -1.458  15.461   2.038
   82   3HG2  ILE  13          3HG2      ILE  13   0.109  16.011   1.444
   83   1HD1  ILE  13          1HD1      ILE  13   0.576  12.278   4.465
   84   2HD1  ILE  13          2HD1      ILE  13  -0.844  13.238   4.872
   85   3HD1  ILE  13          3HD1      ILE  13   0.582  14.020   4.190
   86    H    GLY  14           H        GLY  14  -1.379  12.000  -1.465
   87   1HA   GLY  14          2HA       GLY  14  -0.697  10.050  -2.459
   88   2HA   GLY  14          1HA       GLY  14   0.897  10.777  -2.409
   89    H    THR  15           H        THR  15  -0.928   9.879   0.462
   90    HA   THR  15           HA       THR  15   1.161   7.894   1.039
   91    HB   THR  15           HB       THR  15  -0.768   9.138   3.008
   92    HG1  THR  15           1HG      THR  15   1.340  10.251   1.760
   93   1HG2  THR  15          1HG2      THR  15   1.738   8.366   4.124
   94   2HG2  THR  15          2HG2      THR  15   1.105   7.008   3.193
   95   3HG2  THR  15          3HG2      THR  15   0.134   7.726   4.479
   96    HA   PRO  16           HA       PRO  16  -2.093   4.908   0.328
   97   1HB   PRO  16          2HB       PRO  16  -0.612   2.691   0.806
   98   2HB   PRO  16          1HB       PRO  16  -0.499   3.613  -0.695
   99   1HG   PRO  16          2HG       PRO  16   1.303   3.642   1.689
  100   2HG   PRO  16          1HG       PRO  16   1.721   3.697  -0.033
  101   1HD   PRO  16          2HD       PRO  16   1.675   5.899   1.582
  102   2HD   PRO  16          1HD       PRO  16   1.380   5.959  -0.168
  103    H    ILE  17           H        ILE  17  -3.637   4.418   1.737
  104    HA   ILE  17           HA       ILE  17  -2.856   3.739   4.498
  105    HB   ILE  17           HB       ILE  17  -5.154   4.470   5.160
  106   1HG1  ILE  17          2HG1      ILE  17  -5.256   5.687   2.390
  107   2HG1  ILE  17          1HG1      ILE  17  -6.131   4.233   2.858
  108   1HG2  ILE  17          1HG2      ILE  17  -3.615   6.061   5.725
  109   2HG2  ILE  17          2HG2      ILE  17  -4.618   6.990   4.610
  110   3HG2  ILE  17          3HG2      ILE  17  -3.090   6.306   4.057
  111   1HD1  ILE  17          1HD1      ILE  17  -7.108   5.754   4.727
  112   2HD1  ILE  17          2HD1      ILE  17  -7.738   5.855   3.083
  113   3HD1  ILE  17          3HD1      ILE  17  -6.592   7.063   3.663
  114    H    SER  18           H        SER  18  -2.936   1.920   2.358
  115    HA   SER  18           HA       SER  18  -4.268  -0.245   3.496
  116   1HB   SER  18          2HB       SER  18  -5.975  -0.608   1.627
  117   2HB   SER  18          1HB       SER  18  -6.371   0.635   2.812
  118    HG   SER  18           HG       SER  18  -5.724   2.202   1.346
  119    H    PHE  19           H        PHE  19  -3.758  -2.187   2.429
  120    HA   PHE  19           HA       PHE  19  -2.314  -2.005  -0.112
  121   1HB   PHE  19          2HB       PHE  19  -1.114  -3.450   2.258
  122   2HB   PHE  19          1HB       PHE  19  -0.396  -3.237   0.674
  123    HD1  PHE  19           1HD      PHE  19  -1.371  -1.444   3.765
  124    HD2  PHE  19           2HD      PHE  19   0.924  -1.367   0.181
  125    HE1  PHE  19           1HE      PHE  19  -0.197   0.564   4.564
  126    HE2  PHE  19           2HE      PHE  19   2.100   0.642   0.974
  127    HZ   PHE  19           HZ       PHE  19   1.541   1.611   3.168
  128    H    TYR  20           H        TYR  20  -1.634  -4.331  -0.752
  129    HA   TYR  20           HA       TYR  20  -3.215  -6.484   0.269
  130   1HB   TYR  20          2HB       TYR  20  -4.405  -6.973  -1.885
  131   2HB   TYR  20          1HB       TYR  20  -4.993  -5.560  -1.042
  132    HD1  TYR  20           1HD      TYR  20  -6.099  -4.714  -3.006
  133    HD2  TYR  20           2HD      TYR  20  -1.900  -5.392  -3.044
  134    HE1  TYR  20           1HE      TYR  20  -5.911  -3.396  -5.069
  135    HE2  TYR  20           2HE      TYR  20  -1.703  -4.071  -5.105
  136    HH   TYR  20           HH       TYR  20  -3.381  -2.024  -6.147
  137    H    GLY  21           H        GLY  21  -3.109  -8.098  -2.089
  138   1HA   GLY  21          2HA       GLY  21  -0.588  -8.117  -3.316
  139   2HA   GLY  21          1HA       GLY  21  -0.519  -9.133  -1.880
  Start of MODEL   17
    1   2H    GLY   1           HN2      GLY   1  -7.246  -1.048  -0.102
    2   1HA   GLY   1          2HA       GLY   1  -9.276  -1.867   0.703
    3   2HA   GLY   1          1HA       GLY   1  -8.766  -3.490   0.273
    4    H    GLY   2           H        GLY   2  -6.371  -3.685   1.700
    5   1HA   GLY   2          2HA       GLY   2  -7.062  -3.060   4.476
    6   2HA   GLY   2          1HA       GLY   2  -6.929  -4.755   4.044
    7    H    ALA   3           H        ALA   3  -5.045  -5.630   4.511
    8    HA   ALA   3           HA       ALA   3  -2.649  -3.917   4.483
    9   1HB   ALA   3          1HB       ALA   3  -3.605  -4.950   6.718
   10   2HB   ALA   3          2HB       ALA   3  -1.870  -4.857   6.418
   11   3HB   ALA   3          3HB       ALA   3  -2.728  -6.375   6.159
   12    H    GLY   4           H        GLY   4  -0.782  -4.736   3.580
   13   1HA   GLY   4          2HA       GLY   4  -0.371  -7.399   2.791
   14   2HA   GLY   4          1HA       GLY   4  -1.054  -6.515   1.435
   15    H    HIS   5           H        HIS   5   0.440  -5.871   0.065
   16    HA   HIS   5           HA       HIS   5   2.899  -4.665   1.122
   17   1HB   HIS   5          2HB       HIS   5   2.777  -6.836  -0.976
   18   2HB   HIS   5          1HB       HIS   5   4.187  -5.811  -0.731
   19    HD1  HIS   5           1HD      HIS   5   4.825  -5.836   2.088
   20    HD2  HIS   5           2HD      HIS   5   3.127  -9.182   0.296
   21    HE1  HIS   5           1HE      HIS   5   5.400  -7.769   3.590
   22    HE2  HIS   5           2HE      HIS   5   4.245  -9.756   2.556
   23    H    VAL   6           H        VAL   6   0.819  -5.208  -1.702
   24    HA   VAL   6           HA       VAL   6   1.909  -2.844  -3.012
   25    HB   VAL   6           HB       VAL   6  -0.375  -4.593  -3.946
   26   1HG1  VAL   6          1HG1      VAL   6   1.452  -2.762  -5.499
   27   2HG1  VAL   6          2HG1      VAL   6  -0.191  -2.364  -4.996
   28   3HG1  VAL   6          3HG1      VAL   6   0.087  -3.681  -6.136
   29   1HG2  VAL   6          1HG2      VAL   6   2.543  -5.026  -4.015
   30   2HG2  VAL   6          2HG2      VAL   6   1.673  -5.346  -5.515
   31   3HG2  VAL   6          3HG2      VAL   6   1.220  -6.191  -4.034
   32    HA   PRO   7           HA       PRO   7  -1.069  -0.226  -1.003
   33   1HB   PRO   7          2HB       PRO   7  -0.832   1.902  -2.728
   34   2HB   PRO   7          1HB       PRO   7   0.271   1.564  -1.390
   35   1HG   PRO   7          2HG       PRO   7   0.569   0.938  -4.299
   36   2HG   PRO   7          1HG       PRO   7   1.781   1.537  -3.149
   37   1HD   PRO   7          2HD       PRO   7   1.693  -1.042  -3.892
   38   2HD   PRO   7          1HD       PRO   7   2.138  -0.562  -2.241
   39    H    GLU   8           H        GLU   8  -3.185   0.027  -1.130
   40    HA   GLU   8           HA       GLU   8  -4.570  -0.646  -3.607
   41   1HB   GLU   8          2HB       GLU   8  -5.640  -0.148  -0.818
   42   2HB   GLU   8          1HB       GLU   8  -6.602  -0.668  -2.193
   43   1HG   GLU   8          2HG       GLU   8  -5.188  -2.718  -2.303
   44   2HG   GLU   8          1HG       GLU   8  -4.435  -2.205  -0.794
   45    H    TYR   9           H        TYR   9  -5.406   1.677  -1.060
   46    HA   TYR   9           HA       TYR   9  -5.965   3.668  -3.156
   47   1HB   TYR   9          2HB       TYR   9  -7.130   3.465  -0.371
   48   2HB   TYR   9          1HB       TYR   9  -7.514   4.715  -1.545
   49    HD1  TYR   9           1HD      TYR   9  -9.320   4.434  -2.975
   50    HD2  TYR   9           2HD      TYR   9  -7.642   1.010  -1.088
   51    HE1  TYR   9           1HE      TYR   9 -11.158   3.056  -3.852
   52    HE2  TYR   9           2HE      TYR   9  -9.471  -0.377  -1.964
   53    HH   TYR   9           HH       TYR   9 -11.938   0.976  -4.112
   54    H    PHE  10           H        PHE  10  -5.149   5.710  -2.972
   55    HA   PHE  10           HA       PHE  10  -3.125   6.085  -0.874
   56   1HB   PHE  10          2HB       PHE  10  -3.255   7.486  -3.545
   57   2HB   PHE  10          1HB       PHE  10  -1.959   7.585  -2.370
   58    HD1  PHE  10           1HD      PHE  10  -3.748   5.046  -4.451
   59    HD2  PHE  10           2HD      PHE  10  -0.090   6.301  -2.676
   60    HE1  PHE  10           1HE      PHE  10  -2.573   3.206  -5.581
   61    HE2  PHE  10           2HE      PHE  10   1.091   4.462  -3.801
   62    HZ   PHE  10           HZ       PHE  10  -0.150   2.911  -5.257
   63    H    VAL  11           H        VAL  11  -3.026   7.968   0.230
   64    HA   VAL  11           HA       VAL  11  -5.461   9.551   0.336
   65    HB   VAL  11           HB       VAL  11  -2.956   9.805   2.025
   66   1HG1  VAL  11          1HG1      VAL  11  -4.613  10.831   3.653
   67   2HG1  VAL  11          2HG1      VAL  11  -5.726  10.937   2.289
   68   3HG1  VAL  11          3HG1      VAL  11  -4.189  11.798   2.241
   69   1HG2  VAL  11          1HG2      VAL  11  -3.891   7.577   2.270
   70   2HG2  VAL  11          2HG2      VAL  11  -5.482   8.266   2.596
   71   3HG2  VAL  11          3HG2      VAL  11  -4.160   8.526   3.733
   72    H    GLY  12           H        GLY  12  -5.434  11.858   0.109
   73   1HA   GLY  12          2HA       GLY  12  -4.096  12.846  -2.101
   74   2HA   GLY  12          1HA       GLY  12  -4.851  13.845  -0.875
   75    H    ILE  13           H        ILE  13  -2.944  12.619   1.140
   76    HA   ILE  13           HA       ILE  13  -0.855  14.581   0.789
   77    HB   ILE  13           HB       ILE  13  -0.973  12.575   3.036
   78   1HG1  ILE  13          2HG1      ILE  13  -3.212  13.592   2.823
   79   2HG1  ILE  13          1HG1      ILE  13  -2.397  14.116   4.292
   80   1HG2  ILE  13          1HG2      ILE  13  -0.021  15.438   2.977
   81   2HG2  ILE  13          2HG2      ILE  13   1.024  14.027   2.807
   82   3HG2  ILE  13          3HG2      ILE  13   0.140  14.295   4.311
   83   1HD1  ILE  13          1HD1      ILE  13  -3.361  15.667   2.033
   84   2HD1  ILE  13          2HD1      ILE  13  -1.700  16.058   2.482
   85   3HD1  ILE  13          3HD1      ILE  13  -2.988  16.170   3.682
   86    H    GLY  14           H        GLY  14  -0.922  12.410  -1.088
   87   1HA   GLY  14          2HA       GLY  14   0.454  10.922  -2.154
   88   2HA   GLY  14          1HA       GLY  14   1.749  11.870  -1.449
   89    H    THR  15           H        THR  15  -0.621   9.658   0.068
   90    HA   THR  15           HA       THR  15   1.511   7.769   0.615
   91    HB   THR  15           HB       THR  15   1.802   9.255   2.493
   92    HG1  THR  15           1HG      THR  15   0.349   6.968   3.384
   93   1HG2  THR  15          1HG2      THR  15  -0.392  10.332   2.500
   94   2HG2  THR  15          2HG2      THR  15   0.010   9.712   4.101
   95   3HG2  THR  15          3HG2      THR  15  -1.131   8.838   3.078
   96    HA   PRO  16           HA       PRO  16  -1.961   5.059   0.027
   97   1HB   PRO  16          2HB       PRO  16  -0.281   2.920   1.096
   98   2HB   PRO  16          1HB       PRO  16  -0.894   3.141  -0.545
   99   1HG   PRO  16          2HG       PRO  16   1.723   3.418   0.082
  100   2HG   PRO  16          1HG       PRO  16   0.944   4.347  -1.210
  101   1HD   PRO  16          2HD       PRO  16   1.633   5.189   1.579
  102   2HD   PRO  16          1HD       PRO  16   1.782   6.095   0.058
  103    H    ILE  17           H        ILE  17  -3.596   4.242   1.282
  104    HA   ILE  17           HA       ILE  17  -3.050   3.988   4.166
  105    HB   ILE  17           HB       ILE  17  -4.314   6.076   3.582
  106   1HG1  ILE  17          2HG1      ILE  17  -6.089   5.775   5.300
  107   2HG1  ILE  17          1HG1      ILE  17  -5.769   4.042   5.286
  108   1HG2  ILE  17          1HG2      ILE  17  -5.969   4.166   2.167
  109   2HG2  ILE  17          2HG2      ILE  17  -5.874   5.920   2.011
  110   3HG2  ILE  17          3HG2      ILE  17  -6.911   5.199   3.243
  111   1HD1  ILE  17          1HD1      ILE  17  -3.537   4.412   6.114
  112   2HD1  ILE  17          2HD1      ILE  17  -4.703   5.211   7.167
  113   3HD1  ILE  17          3HD1      ILE  17  -3.758   6.157   6.017
  114    H    SER  18           H        SER  18  -3.034   2.026   2.100
  115    HA   SER  18           HA       SER  18  -4.324  -0.099   3.343
  116   1HB   SER  18          2HB       SER  18  -6.020  -0.603   1.484
  117   2HB   SER  18          1HB       SER  18  -6.453   0.671   2.624
  118    HG   SER  18           HG       SER  18  -5.960   2.196   1.111
  119    H    PHE  19           H        PHE  19  -3.816  -2.099   2.344
  120    HA   PHE  19           HA       PHE  19  -2.340  -2.018  -0.178
  121   1HB   PHE  19          2HB       PHE  19  -1.160  -3.335   2.274
  122   2HB   PHE  19          1HB       PHE  19  -0.429  -3.213   0.690
  123    HD1  PHE  19           1HD      PHE  19  -1.397  -1.267   3.682
  124    HD2  PHE  19           2HD      PHE  19   0.857  -1.346   0.072
  125    HE1  PHE  19           1HE      PHE  19  -0.233   0.790   4.366
  126    HE2  PHE  19           2HE      PHE  19   2.024   0.709   0.751
  127    HZ   PHE  19           HZ       PHE  19   1.478   1.780   2.900
  128    H    TYR  20           H        TYR  20  -1.671  -4.322  -0.751
  129    HA   TYR  20           HA       TYR  20  -3.181  -6.485   0.346
  130   1HB   TYR  20          2HB       TYR  20  -4.398  -7.057  -1.768
  131   2HB   TYR  20          1HB       TYR  20  -5.007  -5.639  -0.950
  132    HD1  TYR  20           1HD      TYR  20  -6.182  -4.928  -2.943
  133    HD2  TYR  20           2HD      TYR  20  -1.954  -5.388  -2.989
  134    HE1  TYR  20           1HE      TYR  20  -6.071  -3.657  -5.043
  135    HE2  TYR  20           2HE      TYR  20  -1.836  -4.116  -5.087
  136    HH   TYR  20           HH       TYR  20  -3.579  -2.200  -6.177
  137    H    GLY  21           H        GLY  21  -3.079  -8.166  -1.948
  138   1HA   GLY  21          2HA       GLY  21  -0.601  -8.144  -3.255
  139   2HA   GLY  21          1HA       GLY  21  -0.446  -9.101  -1.785
  Start of MODEL   18
    1   2H    GLY   1           HN2      GLY   1  -7.214  -0.928  -0.493
    2   1HA   GLY   1          2HA       GLY   1  -9.032  -1.572   0.740
    3   2HA   GLY   1          1HA       GLY   1  -9.128  -2.952  -0.341
    4    H    GLY   2           H        GLY   2  -6.523  -2.165   1.929
    5   1HA   GLY   2          2HA       GLY   2  -7.189  -3.610   4.129
    6   2HA   GLY   2          1HA       GLY   2  -6.618  -4.831   3.002
    7    H    ALA   3           H        ALA   3  -4.714  -5.415   3.856
    8    HA   ALA   3           HA       ALA   3  -2.610  -3.385   3.935
    9   1HB   ALA   3          1HB       ALA   3  -3.718  -4.639   6.258
   10   2HB   ALA   3          2HB       ALA   3  -2.421  -3.448   6.153
   11   3HB   ALA   3          3HB       ALA   3  -2.049  -5.169   6.049
   12    H    GLY   4           H        GLY   4  -0.628  -4.148   3.263
   13   1HA   GLY   4          2HA       GLY   4   0.188  -6.812   3.176
   14   2HA   GLY   4          1HA       GLY   4  -0.625  -6.467   1.660
   15    H    HIS   5           H        HIS   5   0.711  -5.950   0.085
   16    HA   HIS   5           HA       HIS   5   3.111  -4.374   0.763
   17   1HB   HIS   5          2HB       HIS   5   2.894  -6.858  -0.881
   18   2HB   HIS   5          1HB       HIS   5   4.117  -5.663  -1.298
   19    HD1  HIS   5           1HD      HIS   5   5.352  -8.164  -0.520
   20    HD2  HIS   5           2HD      HIS   5   4.104  -5.445   2.368
   21    HE1  HIS   5           1HE      HIS   5   6.679  -8.715   1.544
   22    HE2  HIS   5           2HE      HIS   5   5.950  -7.020   3.261
   23    H    VAL   6           H        VAL   6   0.791  -5.173  -1.819
   24    HA   VAL   6           HA       VAL   6   1.778  -2.959  -3.432
   25    HB   VAL   6           HB       VAL   6  -0.585  -4.774  -3.961
   26   1HG1  VAL   6          1HG1      VAL   6   0.161  -4.017  -6.386
   27   2HG1  VAL   6          2HG1      VAL   6   0.749  -2.610  -5.498
   28   3HG1  VAL   6          3HG1      VAL   6  -0.955  -3.056  -5.415
   29   1HG2  VAL   6          1HG2      VAL   6   2.120  -5.455  -3.923
   30   2HG2  VAL   6          2HG2      VAL   6   1.719  -5.243  -5.628
   31   3HG2  VAL   6          3HG2      VAL   6   0.798  -6.377  -4.641
   32    HA   PRO   7           HA       PRO   7  -0.981  -0.132  -1.336
   33   1HB   PRO   7          2HB       PRO   7  -0.669   1.923  -3.142
   34   2HB   PRO   7          1HB       PRO   7   0.428   1.585  -1.800
   35   1HG   PRO   7          2HG       PRO   7   0.675   0.841  -4.684
   36   2HG   PRO   7          1HG       PRO   7   1.923   1.419  -3.564
   37   1HD   PRO   7          2HD       PRO   7   1.711  -1.176  -4.214
   38   2HD   PRO   7          1HD       PRO   7   2.180  -0.662  -2.579
   39    H    GLU   8           H        GLU   8  -3.096   0.120  -1.429
   40    HA   GLU   8           HA       GLU   8  -4.526  -0.476  -3.904
   41   1HB   GLU   8          2HB       GLU   8  -5.507  -0.092  -1.067
   42   2HB   GLU   8          1HB       GLU   8  -6.549  -0.449  -2.435
   43   1HG   GLU   8          2HG       GLU   8  -5.258  -2.564  -2.752
   44   2HG   GLU   8          1HG       GLU   8  -4.435  -2.211  -1.234
   45    H    TYR   9           H        TYR   9  -5.258   1.781  -1.270
   46    HA   TYR   9           HA       TYR   9  -5.721   3.878  -3.287
   47   1HB   TYR   9          2HB       TYR   9  -7.146   3.452  -0.653
   48   2HB   TYR   9          1HB       TYR   9  -7.382   4.841  -1.703
   49    HD1  TYR   9           1HD      TYR   9  -7.604   1.108  -1.756
   50    HD2  TYR   9           2HD      TYR   9  -9.087   4.799  -3.265
   51    HE1  TYR   9           1HE      TYR   9  -9.363  -0.103  -2.970
   52    HE2  TYR   9           2HE      TYR   9 -10.851   3.596  -4.483
   53    HH   TYR   9           HH       TYR   9 -10.861   0.706  -5.332
   54    H    PHE  10           H        PHE  10  -4.974   5.918  -2.865
   55    HA   PHE  10           HA       PHE  10  -3.067   6.119  -0.639
   56   1HB   PHE  10          2HB       PHE  10  -3.167   7.761  -3.175
   57   2HB   PHE  10          1HB       PHE  10  -1.950   7.876  -1.920
   58    HD1  PHE  10           1HD      PHE  10  -3.426   5.260  -4.158
   59    HD2  PHE  10           2HD      PHE  10   0.055   6.873  -2.317
   60    HE1  PHE  10           1HE      PHE  10  -2.040   3.605  -5.337
   61    HE2  PHE  10           2HE      PHE  10   1.445   5.219  -3.492
   62    HZ   PHE  10           HZ       PHE  10   0.398   3.583  -5.003
   63    H    VAL  11           H        VAL  11  -3.033   7.937   0.635
   64    HA   VAL  11           HA       VAL  11  -5.572   9.273   0.948
   65    HB   VAL  11           HB       VAL  11  -4.189   8.484   2.884
   66   1HG1  VAL  11          1HG1      VAL  11  -1.989   9.041   2.175
   67   2HG1  VAL  11          2HG1      VAL  11  -2.340   9.965   3.636
   68   3HG1  VAL  11          3HG1      VAL  11  -2.400  10.752   2.059
   69   1HG2  VAL  11          1HG2      VAL  11  -4.738  10.290   4.328
   70   2HG2  VAL  11          2HG2      VAL  11  -5.970  10.234   3.067
   71   3HG2  VAL  11          3HG2      VAL  11  -4.692  11.448   2.999
   72    H    GLY  12           H        GLY  12  -5.581  11.703   1.231
   73   1HA   GLY  12          2HA       GLY  12  -4.667  12.934  -1.150
   74   2HA   GLY  12          1HA       GLY  12  -5.491  13.722   0.174
   75    H    ILE  13           H        ILE  13  -2.398  12.066   0.226
   76    HA   ILE  13           HA       ILE  13  -0.906  14.514   0.198
   77    HB   ILE  13           HB       ILE  13  -1.764  14.386   2.570
   78   1HG1  ILE  13          2HG1      ILE  13   1.241  14.287   2.222
   79   2HG1  ILE  13          1HG1      ILE  13   0.228  15.698   1.943
   80   1HG2  ILE  13          1HG2      ILE  13  -1.718  12.110   3.106
   81   2HG2  ILE  13          2HG2      ILE  13  -0.422  12.824   4.064
   82   3HG2  ILE  13          3HG2      ILE  13  -0.042  11.931   2.591
   83   1HD1  ILE  13          1HD1      ILE  13  -0.361  15.778   4.282
   84   2HD1  ILE  13          2HD1      ILE  13   1.392  15.770   4.099
   85   3HD1  ILE  13          3HD1      ILE  13   0.550  14.299   4.587
   86    H    GLY  14           H        GLY  14  -1.090  12.008  -1.213
   87   1HA   GLY  14          2HA       GLY  14   0.305  10.541  -2.287
   88   2HA   GLY  14          1HA       GLY  14   1.618  11.571  -1.749
   89    H    THR  15           H        THR  15  -0.639   9.355  -0.081
   90    HA   THR  15           HA       THR  15   1.611   7.686   0.711
   91    HB   THR  15           HB       THR  15  -0.213   8.900   2.804
   92    HG1  THR  15           1HG      THR  15   2.057   9.862   1.655
   93   1HG2  THR  15          1HG2      THR  15   0.869   7.648   4.381
   94   2HG2  THR  15          2HG2      THR  15   2.364   7.568   3.450
   95   3HG2  THR  15          3HG2      THR  15   0.999   6.543   3.013
   96    HA   PRO  16           HA       PRO  16  -1.691   4.777  -0.077
   97   1HB   PRO  16          2HB       PRO  16   0.142   2.723   0.909
   98   2HB   PRO  16          1HB       PRO  16  -0.504   2.952  -0.718
   99   1HG   PRO  16          2HG       PRO  16   2.096   3.390  -0.104
  100   2HG   PRO  16          1HG       PRO  16   1.242   4.298  -1.364
  101   1HD   PRO  16          2HD       PRO  16   1.909   5.111   1.438
  102   2HD   PRO  16          1HD       PRO  16   1.963   6.069  -0.058
  103    H    ILE  17           H        ILE  17  -3.340   4.353   1.256
  104    HA   ILE  17           HA       ILE  17  -2.722   3.743   4.072
  105    HB   ILE  17           HB       ILE  17  -5.028   4.607   4.584
  106   1HG1  ILE  17          2HG1      ILE  17  -4.842   5.709   1.769
  107   2HG1  ILE  17          1HG1      ILE  17  -5.924   4.419   2.281
  108   1HG2  ILE  17          1HG2      ILE  17  -2.884   5.899   4.861
  109   2HG2  ILE  17          2HG2      ILE  17  -4.346   6.873   4.712
  110   3HG2  ILE  17          3HG2      ILE  17  -3.260   6.696   3.333
  111   1HD1  ILE  17          1HD1      ILE  17  -7.373   6.139   2.428
  112   2HD1  ILE  17          2HD1      ILE  17  -6.104   7.331   2.707
  113   3HD1  ILE  17          3HD1      ILE  17  -6.651   6.298   4.028
  114    H    SER  18           H        SER  18  -2.840   1.895   1.930
  115    HA   SER  18           HA       SER  18  -4.247  -0.210   3.075
  116   1HB   SER  18          2HB       SER  18  -5.977  -0.525   1.216
  117   2HB   SER  18          1HB       SER  18  -6.328   0.727   2.406
  118    HG   SER  18           HG       SER  18  -5.496   2.259   0.910
  119    H    PHE  19           H        PHE  19  -3.807  -2.184   1.993
  120    HA   PHE  19           HA       PHE  19  -2.432  -2.045  -0.577
  121   1HB   PHE  19          2HB       PHE  19  -1.089  -3.569   1.632
  122   2HB   PHE  19          1HB       PHE  19  -0.437  -3.092   0.082
  123    HD1  PHE  19           1HD      PHE  19   0.738  -1.086  -0.187
  124    HD2  PHE  19           2HD      PHE  19  -1.403  -1.816   3.418
  125    HE1  PHE  19           1HE      PHE  19   1.838   0.851   0.855
  126    HE2  PHE  19           2HE      PHE  19  -0.312   0.126   4.463
  127    HZ   PHE  19           HZ       PHE  19   1.312   1.462   3.181
  128    H    TYR  20           H        TYR  20  -1.961  -4.227  -1.427
  129    HA   TYR  20           HA       TYR  20  -4.127  -6.083  -0.735
  130   1HB   TYR  20          2HB       TYR  20  -2.273  -6.309  -3.108
  131   2HB   TYR  20          1HB       TYR  20  -3.786  -7.150  -2.853
  132    HD1  TYR  20           1HD      TYR  20  -5.879  -6.152  -3.440
  133    HD2  TYR  20           2HD      TYR  20  -2.272  -3.920  -3.768
  134    HE1  TYR  20           1HE      TYR  20  -7.053  -4.466  -4.790
  135    HE2  TYR  20           2HE      TYR  20  -3.437  -2.223  -5.110
  136    HH   TYR  20           HH       TYR  20  -5.342  -1.625  -6.074
  137    H    GLY  21           H        GLY  21  -3.560  -8.417  -0.831
  138   1HA   GLY  21          2HA       GLY  21  -0.869  -9.267  -0.507
  139   2HA   GLY  21          1HA       GLY  21  -1.683  -9.147   1.049
  Start of MODEL   19
    1   2H    GLY   1           HN2      GLY   1  -6.989  -0.905  -0.004
    2   1HA   GLY   1          2HA       GLY   1  -8.991  -1.495   0.998
    3   2HA   GLY   1          1HA       GLY   1  -8.792  -3.120   0.371
    4    H    GLY   2           H        GLY   2  -6.339  -3.816   1.528
    5   1HA   GLY   2          2HA       GLY   2  -7.056  -3.737   4.396
    6   2HA   GLY   2          1HA       GLY   2  -6.433  -5.173   3.604
    7    H    ALA   3           H        ALA   3  -4.536  -5.539   4.556
    8    HA   ALA   3           HA       ALA   3  -2.526  -3.401   4.448
    9   1HB   ALA   3          1HB       ALA   3  -2.225  -5.224   6.718
   10   2HB   ALA   3          2HB       ALA   3  -3.662  -4.204   6.798
   11   3HB   ALA   3          3HB       ALA   3  -2.065  -3.469   6.642
   12    H    GLY   4           H        GLY   4  -2.613  -5.100   2.444
   13   1HA   GLY   4          2HA       GLY   4  -1.107  -7.508   2.858
   14   2HA   GLY   4          1HA       GLY   4  -1.561  -6.814   1.311
   15    H    HIS   5           H        HIS   5   0.138  -6.339   0.100
   16    HA   HIS   5           HA       HIS   5   2.554  -5.306   1.442
   17   1HB   HIS   5          2HB       HIS   5   2.318  -7.278  -0.817
   18   2HB   HIS   5          1HB       HIS   5   3.790  -6.344  -0.569
   19    HD1  HIS   5           1HD      HIS   5   4.278  -9.206  -0.332
   20    HD2  HIS   5           2HD      HIS   5   2.820  -7.026   2.893
   21    HE1  HIS   5           1HE      HIS   5   4.857 -10.554   1.711
   22    HE2  HIS   5           2HE      HIS   5   3.875  -9.264   3.641
   23    H    VAL   6           H        VAL   6   0.870  -5.393  -1.715
   24    HA   VAL   6           HA       VAL   6   2.173  -2.889  -2.434
   25    HB   VAL   6           HB       VAL   6   0.840  -3.167  -4.597
   26   1HG1  VAL   6          1HG1      VAL   6   3.288  -3.873  -4.017
   27   2HG1  VAL   6          2HG1      VAL   6   2.553  -4.391  -5.534
   28   3HG1  VAL   6          3HG1      VAL   6   2.644  -5.507  -4.172
   29   1HG2  VAL   6          1HG2      VAL   6   0.021  -5.592  -3.125
   30   2HG2  VAL   6          2HG2      VAL   6   0.448  -5.815  -4.821
   31   3HG2  VAL   6          3HG2      VAL   6  -0.826  -4.682  -4.374
   32    HA   PRO   7           HA       PRO   7  -1.007  -0.336  -0.798
   33   1HB   PRO   7          2HB       PRO   7  -0.654   1.785  -2.547
   34   2HB   PRO   7          1HB       PRO   7   0.269   1.510  -1.066
   35   1HG   PRO   7          2HG       PRO   7   0.974   0.855  -3.895
   36   2HG   PRO   7          1HG       PRO   7   2.007   1.477  -2.593
   37   1HD   PRO   7          2HD       PRO   7   2.083  -1.097  -3.316
   38   2HD   PRO   7          1HD       PRO   7   2.244  -0.615  -1.614
   39    H    GLU   8           H        GLU   8  -3.090   0.015  -1.078
   40    HA   GLU   8           HA       GLU   8  -4.335  -0.730  -3.613
   41   1HB   GLU   8          2HB       GLU   8  -5.544  -0.128  -0.903
   42   2HB   GLU   8          1HB       GLU   8  -6.447  -0.656  -2.313
   43   1HG   GLU   8          2HG       GLU   8  -5.168  -2.761  -2.300
   44   2HG   GLU   8          1HG       GLU   8  -4.358  -2.226  -0.827
   45    H    TYR   9           H        TYR   9  -5.090   1.728  -1.158
   46    HA   TYR   9           HA       TYR   9  -5.452   3.688  -3.327
   47   1HB   TYR   9          2HB       TYR   9  -7.058   3.409  -0.780
   48   2HB   TYR   9          1HB       TYR   9  -7.193   4.760  -1.896
   49    HD1  TYR   9           1HD      TYR   9  -8.741   4.674  -3.621
   50    HD2  TYR   9           2HD      TYR   9  -7.530   1.041  -1.768
   51    HE1  TYR   9           1HE      TYR   9 -10.452   3.458  -4.899
   52    HE2  TYR   9           2HE      TYR   9  -9.233  -0.186  -3.046
   53    HH   TYR   9           HH       TYR   9 -10.858   1.136  -5.688
   54    H    PHE  10           H        PHE  10  -4.737   5.754  -2.967
   55    HA   PHE  10           HA       PHE  10  -2.997   6.094  -0.621
   56   1HB   PHE  10          2HB       PHE  10  -2.810   7.538  -3.268
   57   2HB   PHE  10          1HB       PHE  10  -1.686   7.665  -1.929
   58    HD1  PHE  10           1HD      PHE  10   0.270   6.503  -2.061
   59    HD2  PHE  10           2HD      PHE  10  -3.116   5.042  -4.184
   60    HE1  PHE  10           1HE      PHE  10   1.661   4.737  -3.058
   61    HE2  PHE  10           2HE      PHE  10  -1.733   3.268  -5.178
   62    HZ   PHE  10           HZ       PHE  10   0.659   3.115  -4.616
   63    H    VAL  11           H        VAL  11  -3.032   7.999   0.495
   64    HA   VAL  11           HA       VAL  11  -5.513   9.463   0.475
   65    HB   VAL  11           HB       VAL  11  -3.001  10.012   2.085
   66   1HG1  VAL  11          1HG1      VAL  11  -5.859  10.895   2.461
   67   2HG1  VAL  11          2HG1      VAL  11  -4.465  11.914   2.100
   68   3HG1  VAL  11          3HG1      VAL  11  -4.583  11.104   3.661
   69   1HG2  VAL  11          1HG2      VAL  11  -5.137   8.003   2.408
   70   2HG2  VAL  11          2HG2      VAL  11  -4.660   8.878   3.863
   71   3HG2  VAL  11          3HG2      VAL  11  -3.456   7.974   2.944
   72    H    GLY  12           H        GLY  12  -5.647  11.770   0.134
   73   1HA   GLY  12          2HA       GLY  12  -4.515  12.706  -2.193
   74   2HA   GLY  12          1HA       GLY  12  -5.218  13.737  -0.965
   75    H    ILE  13           H        ILE  13  -3.144  12.810   0.988
   76    HA   ILE  13           HA       ILE  13  -1.144  14.770   0.269
   77    HB   ILE  13           HB       ILE  13  -1.032  13.093   2.763
   78   1HG1  ILE  13          2HG1      ILE  13  -2.727  15.574   2.378
   79   2HG1  ILE  13          1HG1      ILE  13  -3.362  13.937   2.499
   80   1HG2  ILE  13          1HG2      ILE  13  -0.079  15.160   3.709
   81   2HG2  ILE  13          2HG2      ILE  13  -0.252  15.944   2.139
   82   3HG2  ILE  13          3HG2      ILE  13   0.845  14.576   2.326
   83   1HD1  ILE  13          1HD1      ILE  13  -1.824  14.165   4.760
   84   2HD1  ILE  13          2HD1      ILE  13  -3.574  14.363   4.669
   85   3HD1  ILE  13          3HD1      ILE  13  -2.521  15.775   4.584
   86    H    GLY  14           H        GLY  14  -1.257  12.333  -1.272
   87   1HA   GLY  14          2HA       GLY  14   0.127  10.756  -2.200
   88   2HA   GLY  14          1HA       GLY  14   1.424  11.818  -1.688
   89    H    THR  15           H        THR  15  -0.841   9.695   0.096
   90    HA   THR  15           HA       THR  15   1.449   8.116   1.002
   91    HB   THR  15           HB       THR  15  -0.518   9.321   2.962
   92    HG1  THR  15           1HG      THR  15   1.623  10.437   1.831
   93   1HG2  THR  15          1HG2      THR  15   0.746   8.326   4.674
   94   2HG2  THR  15          2HG2      THR  15   2.098   7.980   3.594
   95   3HG2  THR  15          3HG2      THR  15   0.598   7.062   3.452
   96    HA   PRO  16           HA       PRO  16  -1.681   5.011   0.180
   97   1HB   PRO  16          2HB       PRO  16  -0.198   2.861   0.956
   98   2HB   PRO  16          1HB       PRO  16  -0.003   3.660  -0.608
   99   1HG   PRO  16          2HG       PRO  16   1.622   3.955   1.884
  100   2HG   PRO  16          1HG       PRO  16   2.164   3.853   0.199
  101   1HD   PRO  16          2HD       PRO  16   1.997   6.202   1.537
  102   2HD   PRO  16          1HD       PRO  16   1.717   6.076  -0.212
  103    H    ILE  17           H        ILE  17  -3.287   4.198   1.433
  104    HA   ILE  17           HA       ILE  17  -2.717   3.778   4.289
  105    HB   ILE  17           HB       ILE  17  -3.866   5.965   3.902
  106   1HG1  ILE  17          2HG1      ILE  17  -5.526   3.935   5.415
  107   2HG1  ILE  17          1HG1      ILE  17  -4.094   4.744   6.042
  108   1HG2  ILE  17          1HG2      ILE  17  -5.430   6.024   2.322
  109   2HG2  ILE  17          2HG2      ILE  17  -6.510   5.291   3.506
  110   3HG2  ILE  17          3HG2      ILE  17  -5.644   4.274   2.354
  111   1HD1  ILE  17          1HD1      ILE  17  -5.333   6.431   6.739
  112   2HD1  ILE  17          2HD1      ILE  17  -6.773   5.591   6.162
  113   3HD1  ILE  17          3HD1      ILE  17  -5.920   6.713   5.101
  114    H    SER  18           H        SER  18  -2.781   1.907   2.192
  115    HA   SER  18           HA       SER  18  -4.251  -0.172   3.313
  116   1HB   SER  18          2HB       SER  18  -5.907  -0.515   1.402
  117   2HB   SER  18          1HB       SER  18  -6.288   0.786   2.527
  118    HG   SER  18           HG       SER  18  -5.558   2.272   1.037
  119    H    PHE  19           H        PHE  19  -3.815  -2.167   2.274
  120    HA   PHE  19           HA       PHE  19  -2.285  -2.107  -0.215
  121   1HB   PHE  19          2HB       PHE  19  -1.121  -3.615   2.114
  122   2HB   PHE  19          1HB       PHE  19  -0.359  -3.195   0.594
  123    HD1  PHE  19           1HD      PHE  19  -1.470  -1.838   3.848
  124    HD2  PHE  19           2HD      PHE  19   0.838  -1.186   0.331
  125    HE1  PHE  19           1HE      PHE  19  -0.424   0.123   4.901
  126    HE2  PHE  19           2HE      PHE  19   1.887   0.776   1.379
  127    HZ   PHE  19           HZ       PHE  19   1.256   1.433   3.666
  128    H    TYR  20           H        TYR  20  -1.800  -4.348  -0.959
  129    HA   TYR  20           HA       TYR  20  -3.281  -6.529   0.162
  130   1HB   TYR  20          2HB       TYR  20  -4.674  -6.968  -1.876
  131   2HB   TYR  20          1HB       TYR  20  -5.162  -5.564  -0.959
  132    HD1  TYR  20           1HD      TYR  20  -2.237  -4.924  -2.945
  133    HD2  TYR  20           2HD      TYR  20  -6.482  -5.136  -3.096
  134    HE1  TYR  20           1HE      TYR  20  -2.227  -3.576  -4.998
  135    HE2  TYR  20           2HE      TYR  20  -6.480  -3.786  -5.149
  136    HH   TYR  20           HH       TYR  20  -3.833  -2.040  -6.196
  137    H    GLY  21           H        GLY  21  -3.392  -7.853  -2.544
  138   1HA   GLY  21          2HA       GLY  21  -0.871  -7.907  -3.740
  139   2HA   GLY  21          1HA       GLY  21  -0.888  -9.111  -2.455
  Start of MODEL   20
    1   2H    GLY   1           HN2      GLY   1  -7.150  -0.859  -0.115
    2   1HA   GLY   1          2HA       GLY   1  -9.191  -1.431   0.866
    3   2HA   GLY   1          1HA       GLY   1  -8.860  -3.118   0.513
    4    H    GLY   2           H        GLY   2  -6.386  -3.429   1.802
    5   1HA   GLY   2          2HA       GLY   2  -6.915  -2.639   4.582
    6   2HA   GLY   2          1HA       GLY   2  -6.807  -4.351   4.208
    7    H    ALA   3           H        ALA   3  -4.914  -5.198   4.691
    8    HA   ALA   3           HA       ALA   3  -2.511  -3.515   4.428
    9   1HB   ALA   3          1HB       ALA   3  -1.580  -4.462   6.344
   10   2HB   ALA   3          2HB       ALA   3  -2.688  -5.834   6.321
   11   3HB   ALA   3          3HB       ALA   3  -3.274  -4.236   6.780
   12    H    GLY   4           H        GLY   4  -0.666  -4.440   3.544
   13   1HA   GLY   4          2HA       GLY   4  -0.365  -7.164   2.911
   14   2HA   GLY   4          1HA       GLY   4  -1.039  -6.329   1.518
   15    H    HIS   5           H        HIS   5   0.472  -5.872   0.087
   16    HA   HIS   5           HA       HIS   5   3.010  -4.733   1.046
   17   1HB   HIS   5          2HB       HIS   5   2.721  -6.886  -1.063
   18   2HB   HIS   5          1HB       HIS   5   4.200  -5.975  -0.781
   19    HD1  HIS   5           1HD      HIS   5   1.896  -8.379   1.050
   20    HD2  HIS   5           2HD      HIS   5   5.825  -7.024   1.134
   21    HE1  HIS   5           1HE      HIS   5   3.057  -9.787   2.780
   22    HE2  HIS   5           2HE      HIS   5   5.393  -8.852   2.914
   23    H    VAL   6           H        VAL   6   0.923  -5.300  -1.776
   24    HA   VAL   6           HA       VAL   6   2.003  -2.928  -3.076
   25    HB   VAL   6           HB       VAL   6   1.686  -4.762  -4.562
   26   1HG1  VAL   6          1HG1      VAL   6  -1.246  -4.944  -4.061
   27   2HG1  VAL   6          2HG1      VAL   6  -0.125  -5.775  -2.981
   28   3HG1  VAL   6          3HG1      VAL   6  -0.134  -6.152  -4.705
   29   1HG2  VAL   6          1HG2      VAL   6   0.592  -3.715  -6.271
   30   2HG2  VAL   6          2HG2      VAL   6   0.776  -2.361  -5.157
   31   3HG2  VAL   6          3HG2      VAL   6  -0.761  -3.221  -5.253
   32    HA   PRO   7           HA       PRO   7  -0.974  -0.238  -1.215
   33   1HB   PRO   7          2HB       PRO   7  -0.494   1.380  -3.656
   34   2HB   PRO   7          1HB       PRO   7  -0.338   1.830  -1.955
   35   1HG   PRO   7          2HG       PRO   7   1.819   1.399  -3.456
   36   2HG   PRO   7          1HG       PRO   7   1.767   0.889  -1.758
   37   1HD   PRO   7          2HD       PRO   7   1.481  -0.750  -4.241
   38   2HD   PRO   7          1HD       PRO   7   2.294  -1.144  -2.714
   39    H    GLU   8           H        GLU   8  -3.108   0.025  -1.302
   40    HA   GLU   8           HA       GLU   8  -4.552  -0.941  -3.643
   41   1HB   GLU   8          2HB       GLU   8  -5.431  -0.188  -0.856
   42   2HB   GLU   8          1HB       GLU   8  -6.570  -0.578  -2.135
   43   1HG   GLU   8          2HG       GLU   8  -5.451  -2.794  -2.344
   44   2HG   GLU   8          1HG       GLU   8  -4.503  -2.383  -0.915
   45    H    TYR   9           H        TYR   9  -5.247   1.746  -1.414
   46    HA   TYR   9           HA       TYR   9  -5.661   3.467  -3.770
   47   1HB   TYR   9          2HB       TYR   9  -7.295   3.555  -1.230
   48   2HB   TYR   9          1HB       TYR   9  -7.532   4.544  -2.660
   49    HD1  TYR   9           1HD      TYR   9  -7.779   1.091  -1.346
   50    HD2  TYR   9           2HD      TYR   9  -8.820   3.762  -4.489
   51    HE1  TYR   9           1HE      TYR   9  -9.345  -0.579  -2.238
   52    HE2  TYR   9           2HE      TYR   9 -10.391   2.099  -5.390
   53    HH   TYR   9           HH       TYR   9 -11.008  -0.092  -5.296
   54    H    PHE  10           H        PHE  10  -4.800   5.433  -3.702
   55    HA   PHE  10           HA       PHE  10  -3.103   6.108  -1.433
   56   1HB   PHE  10          2HB       PHE  10  -3.343   7.357  -4.178
   57   2HB   PHE  10          1HB       PHE  10  -2.241   7.913  -2.931
   58    HD1  PHE  10           1HD      PHE  10  -3.113   4.613  -4.481
   59    HD2  PHE  10           2HD      PHE  10  -0.069   7.330  -3.269
   60    HE1  PHE  10           1HE      PHE  10  -1.399   3.041  -5.278
   61    HE2  PHE  10           2HE      PHE  10   1.650   5.762  -4.065
   62    HZ   PHE  10           HZ       PHE  10   0.987   3.615  -5.071
   63    H    VAL  11           H        VAL  11  -3.156   8.274  -0.531
   64    HA   VAL  11           HA       VAL  11  -5.821   9.506  -0.760
   65    HB   VAL  11           HB       VAL  11  -5.665  10.190   1.593
   66   1HG1  VAL  11          1HG1      VAL  11  -5.861   7.436   0.672
   67   2HG1  VAL  11          2HG1      VAL  11  -6.897   8.340   1.778
   68   3HG1  VAL  11          3HG1      VAL  11  -5.433   7.563   2.379
   69   1HG2  VAL  11          1HG2      VAL  11  -3.915   8.940   2.991
   70   2HG2  VAL  11          2HG2      VAL  11  -3.385  10.348   2.070
   71   3HG2  VAL  11          3HG2      VAL  11  -3.051   8.724   1.469
   72    H    GLY  12           H        GLY  12  -5.563  11.793   0.531
   73   1HA   GLY  12          2HA       GLY  12  -4.122  13.433  -1.247
   74   2HA   GLY  12          1HA       GLY  12  -4.885  13.962   0.241
   75    H    ILE  13           H        ILE  13  -3.105  11.831   1.602
   76    HA   ILE  13           HA       ILE  13  -0.949  13.673   2.147
   77    HB   ILE  13           HB       ILE  13  -1.168  10.931   3.364
   78   1HG1  ILE  13          2HG1      ILE  13  -2.664  13.400   4.284
   79   2HG1  ILE  13          1HG1      ILE  13  -3.405  12.023   3.477
   80   1HG2  ILE  13          1HG2      ILE  13  -0.498  12.844   5.280
   81   2HG2  ILE  13          2HG2      ILE  13   0.386  13.324   3.829
   82   3HG2  ILE  13          3HG2      ILE  13   0.593  11.702   4.493
   83   1HD1  ILE  13          1HD1      ILE  13  -2.613  10.600   5.371
   84   2HD1  ILE  13          2HD1      ILE  13  -3.815  11.815   5.804
   85   3HD1  ILE  13          3HD1      ILE  13  -2.115  12.079   6.190
   86    H    GLY  14           H        GLY  14  -1.232  12.098  -0.388
   87   1HA   GLY  14          2HA       GLY  14   0.236  11.353  -1.990
   88   2HA   GLY  14          1HA       GLY  14   1.538  11.663  -0.855
   89    H    THR  15           H        THR  15   0.845   9.928   1.189
   90    HA   THR  15           HA       THR  15   1.619   7.410  -0.031
   91    HB   THR  15           HB       THR  15   2.884   8.181   1.907
   92    HG1  THR  15           1HG      THR  15   1.347   5.932   2.727
   93   1HG2  THR  15          1HG2      THR  15   0.285   7.940   3.428
   94   2HG2  THR  15          2HG2      THR  15   1.154   9.433   3.076
   95   3HG2  THR  15          3HG2      THR  15   1.869   8.230   4.149
   96    HA   PRO  16           HA       PRO  16  -2.447   5.671   0.173
   97   1HB   PRO  16          2HB       PRO  16  -1.784   3.070  -0.162
   98   2HB   PRO  16          1HB       PRO  16  -1.711   4.243  -1.481
   99   1HG   PRO  16          2HG       PRO  16   0.498   3.188   0.239
  100   2HG   PRO  16          1HG       PRO  16   0.479   3.464  -1.512
  101   1HD   PRO  16          2HD       PRO  16   1.622   5.192   0.246
  102   2HD   PRO  16          1HD       PRO  16   0.898   5.713  -1.288
  103    H    ILE  17           H        ILE  17  -3.764   4.868   1.745
  104    HA   ILE  17           HA       ILE  17  -2.456   3.840   4.169
  105    HB   ILE  17           HB       ILE  17  -5.256   4.977   4.074
  106   1HG1  ILE  17          2HG1      ILE  17  -2.683   6.444   4.711
  107   2HG1  ILE  17          1HG1      ILE  17  -3.685   6.708   3.289
  108   1HG2  ILE  17          1HG2      ILE  17  -4.565   5.441   6.533
  109   2HG2  ILE  17          2HG2      ILE  17  -3.307   4.243   6.230
  110   3HG2  ILE  17          3HG2      ILE  17  -5.006   3.798   6.063
  111   1HD1  ILE  17          1HD1      ILE  17  -5.112   8.015   4.399
  112   2HD1  ILE  17          2HD1      ILE  17  -3.819   8.141   5.592
  113   3HD1  ILE  17          3HD1      ILE  17  -5.119   6.972   5.820
  114    H    SER  18           H        SER  18  -2.895   2.238   1.968
  115    HA   SER  18           HA       SER  18  -4.273   0.059   3.148
  116   1HB   SER  18          2HB       SER  18  -5.937  -0.235   1.273
  117   2HB   SER  18          1HB       SER  18  -6.290   1.085   2.383
  118    HG   SER  18           HG       SER  18  -5.452   2.532   0.857
  119    H    PHE  19           H        PHE  19  -3.754  -1.860   2.209
  120    HA   PHE  19           HA       PHE  19  -2.315  -1.914  -0.332
  121   1HB   PHE  19          2HB       PHE  19  -1.092  -3.146   2.147
  122   2HB   PHE  19          1HB       PHE  19  -0.390  -3.074   0.544
  123    HD1  PHE  19           1HD      PHE  19   0.888  -1.224  -0.154
  124    HD2  PHE  19           2HD      PHE  19  -1.274  -1.053   3.509
  125    HE1  PHE  19           1HE      PHE  19   2.099   0.826   0.463
  126    HE2  PHE  19           2HE      PHE  19  -0.073   1.002   4.126
  127    HZ   PHE  19           HZ       PHE  19   1.617   1.944   2.602
  128    H    TYR  20           H        TYR  20  -1.687  -4.314  -0.760
  129    HA   TYR  20           HA       TYR  20  -3.314  -6.300   0.516
  130   1HB   TYR  20          2HB       TYR  20  -4.667  -6.946  -1.378
  131   2HB   TYR  20          1HB       TYR  20  -4.970  -5.261  -1.017
  132    HD1  TYR  20           1HD      TYR  20  -3.691  -3.517  -2.488
  133    HD2  TYR  20           2HD      TYR  20  -4.177  -7.607  -3.543
  134    HE1  TYR  20           1HE      TYR  20  -3.290  -2.952  -4.844
  135    HE2  TYR  20           2HE      TYR  20  -3.767  -7.055  -5.901
  136    HH   TYR  20           HH       TYR  20  -2.730  -5.340  -7.235
  137    H    GLY  21           H        GLY  21  -3.293  -8.135  -1.654
  138   1HA   GLY  21          2HA       GLY  21  -0.779  -8.392  -2.879
  139   2HA   GLY  21          1HA       GLY  21  -0.751  -9.266  -1.352