*HEADER    DE NOVO PROTEIN                         19-JUL-16   5KX1              
*TITLE     NMR SOLUTION STRUCTURE OF DESIGNED PEPTIDE NC_CHHH_D1                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DESIGNED PEPTIDE NC_CHHH_D1;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
*SOURCE   4 ORGANISM_TAXID: 32630                                                
*KEYWDS    DESIGNED PEPTIDE, DE NOVO PROTEIN                                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    P.J.HARVEY,D.J.CRAIK                                                  
*REVDAT   1   21-SEP-16 5KX1    0                                                
# Restraints file 1: design12pdb.restraints
!distance restraints
assign (resid  11 and name   HN)   (resid  11 and name  HB#)   2.615    0.815    0.815  
assign (resid  11 and name  HB#)   (resid  12 and name   HN)   2.890    1.090    1.090  
assign (resid  12 and name  HB2)   (resid  13 and name   HN)   3.545    1.745    1.745  
assign (resid  12 and name  HB1)   (resid  13 and name   HN)   3.545    1.745    1.745  
assign (resid  12 and name   HN)   (resid  13 and name   HN)   2.900    1.100    1.100  
assign (resid  11 and name  HB#)   (resid  13 and name   HN)   3.580    1.780    1.780  
assign (resid  13 and name   HN)   (resid  14 and name   HN)   3.135    1.335    1.335  
assign (resid  14 and name   HA)   (resid  15 and name  HD2)   2.805    1.005    1.005  
assign (resid  14 and name   HA)   (resid  15 and name  HD1)   2.805    1.005    1.005  
assign (resid  21 and name   HA)   (resid  22 and name   HN)   2.555    0.755    0.755  
assign (resid   1 and name   HN)   (resid  22 and name   HN)   2.960    1.160    1.160  
assign (resid  18 and name   HN)   (resid  20 and name   HN)   3.065    1.265    1.265  
assign (resid  19 and name   HN)   (resid  20 and name   HN)   2.865    1.065    1.065  
assign (resid   3 and name   HN)   (resid   4 and name   HN)   2.845    1.045    1.045  
assign (resid   4 and name   HN)   (resid   5 and name   HN)   2.785    0.985    0.985  
assign (resid   5 and name   HN)   (resid   6 and name   HN)   2.945    1.145    1.145  
assign (resid   6 and name   HN)   (resid   7 and name   HN)   3.135    1.335    1.335  
assign (resid  16 and name   HN)   (resid  17 and name   HN)   2.855    1.055    1.055  
assign (resid   1 and name   HN)   (resid  22 and name   HA)   2.910    1.110    1.110  
assign (resid   1 and name   HN)   (resid  21 and name  HB2)   3.265    1.465    1.465  
assign (resid   1 and name   HN)   (resid  21 and name  HB1)   3.265    1.465    1.465  
assign (resid  22 and name   HN)   (resid  22 and name  HB2)   2.915    1.115    1.115  
assign (resid  22 and name   HN)   (resid  22 and name  HB1)   2.915    1.115    1.115  
assign (resid  21 and name   HN)   (resid  21 and name HD1#)   3.290    1.490    1.490  
assign (resid  21 and name   HN)   (resid  21 and name HD2#)   3.290    1.490    1.490  
assign (resid  20 and name   HN)   (resid  20 and name  HB2)   2.985    1.185    1.185  
assign (resid  20 and name   HN)   (resid  20 and name  HB1)   2.985    1.185    1.185  
assign (resid  21 and name   HN)   (resid  21 and name  HB2)   2.840    1.040    1.040  
assign (resid  21 and name   HN)   (resid  21 and name  HB1)   2.840    1.040    1.040  
assign (resid  20 and name   HN)   (resid  20 and name  HG#)   3.370    1.570    1.570  
assign (resid  20 and name  HG#)   (resid  21 and name   HN)   3.505    1.705    1.705  
assign (resid  18 and name  HB2)   (resid  19 and name   HN)   3.185    1.385    1.385  
assign (resid  18 and name  HB1)   (resid  19 and name   HN)   3.185    1.385    1.385  
assign (resid  19 and name   HN)   (resid  19 and name  HG2)   3.185    1.385    1.385  
assign (resid  19 and name   HN)   (resid  19 and name  HG1)   3.185    1.385    1.385  
assign (resid  18 and name   HN)   (resid  19 and name   HN)   2.845    1.045    1.045  
assign (resid  18 and name   HA)   (resid  21 and name   HN)   3.250    1.450    1.450  
assign (resid   5 and name   HN)   (resid   5 and name  HB2)   2.860    1.060    1.060  
assign (resid   5 and name   HN)   (resid   5 and name  HB1)   2.860    1.060    1.060  
assign (resid  17 and name  HG2)   (resid  18 and name   HN)   3.650    1.850    1.850  
assign (resid  17 and name  HG1)   (resid  18 and name   HN)   3.650    1.850    1.850  
assign (resid  17 and name  HB2)   (resid  18 and name   HN)   3.355    1.555    1.555  
assign (resid  17 and name  HB1)   (resid  18 and name   HN)   3.355    1.555    1.555  
assign (resid  17 and name   HN)   (resid  18 and name   HN)   2.790    0.990    0.990  
assign (resid  17 and name   HN)   (resid  17 and name  HG2)   3.465    1.665    1.665  
assign (resid  17 and name   HN)   (resid  17 and name  HG1)   3.465    1.665    1.665  
assign (resid  16 and name  HB2)   (resid  17 and name   HN)   3.215    1.415    1.415  
assign (resid  16 and name  HB1)   (resid  17 and name   HN)   3.215    1.415    1.415  
assign (resid  16 and name   HN)   (resid  16 and name  HB2)   2.865    1.065    1.065  
assign (resid  16 and name   HN)   (resid  16 and name  HB1)   2.865    1.065    1.065  
assign (resid  16 and name   HN)   (resid  16 and name  HG2)   3.595    1.795    1.795  
assign (resid  16 and name   HN)   (resid  16 and name  HG1)   3.595    1.795    1.795  
assign (resid  12 and name   HN)   (resid  12 and name  HB2)   2.930    1.130    1.130  
assign (resid  12 and name   HN)   (resid  12 and name  HB1)   2.930    1.130    1.130  
assign (resid   7 and name   HN)   (resid   7 and name  HB1)   2.975    1.175    1.175  
assign (resid   7 and name   HN)   (resid   7 and name  HG2)   3.600    1.800    1.800  
assign (resid   7 and name   HN)   (resid   7 and name  HG1)   3.600    1.800    1.800  
assign (resid   3 and name   HN)   (resid   3 and name  HG2)   3.560    1.760    1.760  
assign (resid   3 and name   HN)   (resid   3 and name  HG1)   3.560    1.760    1.760  
assign (resid   7 and name   HN)   (resid   7 and name  HB2)   2.975    1.175    1.175  
assign (resid  10 and name   HN)   (resid  10 and name  HG2)   3.650    1.850    1.850  
assign (resid  10 and name   HN)   (resid  10 and name  HG1)   3.650    1.850    1.850  
assign (resid  22 and name   HN)   (resid  22 and name  HG2)   3.650    1.850    1.850  
assign (resid  22 and name   HN)   (resid  22 and name  HG1)   3.650    1.850    1.850  
assign (resid  19 and name   HN)   (resid  19 and name  HB2)   2.955    1.155    1.155  
assign (resid  19 and name   HN)   (resid  19 and name  HB1)   2.955    1.155    1.155  
assign (resid  19 and name   HA)   (resid  19 and name  HD2)   3.595    1.795    1.795  
assign (resid  19 and name   HA)   (resid  19 and name  HD1)   3.595    1.795    1.795  
assign (resid  21 and name   HA)   (resid  21 and name HD2#)   3.020    1.220    1.220  
assign (resid   6 and name   HA)   (resid   6 and name  HD2)   3.550    1.750    1.750  
assign (resid   6 and name   HA)   (resid   6 and name  HD1)   3.550    1.750    1.750  
assign (resid  10 and name   HN)   (resid  11 and name   HN)   2.665    0.865    0.865  
assign (resid  19 and name   HA)   (resid  19 and name  HE2)   3.650    1.850    1.850  
assign (resid  19 and name   HA)   (resid  19 and name  HE1)   3.650    1.850    1.850  
assign (resid  19 and name   HN)   (resid  19 and name  HD2)   3.650    1.850    1.850  
assign (resid  19 and name   HN)   (resid  19 and name  HD1)   3.650    1.850    1.850  
assign (resid  21 and name   HA)   (resid  21 and name HD1#)   3.020    1.220    1.220  
assign (resid   8 and name   HA)   (resid   9 and name  HD2)   2.855    1.055    1.055  
assign (resid   8 and name   HA)   (resid   9 and name  HD1)   2.855    1.055    1.055  
assign (resid  20 and name   HA)   (resid  20 and name  HG#)   2.525    0.725    0.725  
assign (resid   1 and name   HN)   (resid   1 and name  HB#)   2.725    0.925    0.925  
assign (resid   1 and name   HN)   (resid   2 and name  HD#)   3.170    1.370    1.370  
assign (resid   1 and name   HN)   (resid  21 and name  HB#)   2.850    1.050    1.050  
assign (resid   1 and name   HA)   (resid   2 and name  HD#)   2.495    0.695    0.695  
assign (resid   1 and name  HB#)   (resid   2 and name  HD#)   3.000    1.200    1.200  
assign (resid   2 and name  HG#)   (resid   3 and name   HN)   2.860    1.060    1.060  
assign (resid   3 and name   HN)   (resid   3 and name  HG#)   3.175    1.375    1.375  
assign (resid   4 and name  HB#)   (resid  21 and name  HD#)   2.975    1.175    1.175  
assign (resid   5 and name   HN)   (resid   5 and name  HB#)   2.555    0.755    0.755  
assign (resid   5 and name   HN)   (resid  21 and name  HD#)   3.340    1.540    1.540  
assign (resid   5 and name   HA)   (resid  21 and name  HD#)   3.000    1.200    1.200  
assign (resid   5 and name  HB#)   (resid   6 and name   HN)   2.940    1.140    1.140  
assign (resid   5 and name  HB#)   (resid  21 and name  HD#)   2.980    1.180    1.180  
assign (resid   6 and name   HN)   (resid   6 and name  HB#)   2.630    0.830    0.830  
assign (resid   6 and name   HN)   (resid   6 and name  HG#)   2.930    1.130    1.130  
assign (resid   6 and name  HB#)   (resid   7 and name   HN)   3.045    1.245    1.245  
assign (resid   7 and name   HN)   (resid   7 and name  HB#)   2.660    0.860    0.860  
assign (resid   7 and name   HN)   (resid   7 and name  HG#)   3.225    1.425    1.425  
assign (resid   8 and name   HN)   (resid   8 and name  HB#)   2.670    0.870    0.870  
assign (resid   8 and name   HN)   (resid   9 and name  HD#)   3.260    1.460    1.460  
assign (resid   8 and name   HA)   (resid   9 and name  HD#)   2.590    0.790    0.790  
assign (resid   8 and name  HB#)   (resid   9 and name  HD#)   3.175    1.375    1.375  
assign (resid  10 and name   HN)   (resid  10 and name  HB#)   2.590    0.790    0.790  
assign (resid  10 and name   HN)   (resid  10 and name  HG#)   3.285    1.485    1.485  
assign (resid  12 and name   HN)   (resid  12 and name  HB#)   2.595    0.795    0.795  
assign (resid  13 and name   HN)   (resid  13 and name  HB#)   2.675    0.875    0.875  
assign (resid  13 and name   HN)   (resid  13 and name  HG#)   3.570    1.770    1.770  
assign (resid  13 and name  HB#)   (resid  14 and name   HN)   3.020    1.220    1.220  
assign (resid  14 and name   HN)   (resid  14 and name  HB#)   2.735    0.935    0.935  
assign (resid  14 and name   HA)   (resid  15 and name  HD#)   2.550    0.750    0.750  
assign (resid  14 and name  HB#)   (resid  15 and name  HD#)   3.090    1.290    1.290  
assign (resid  16 and name   HN)   (resid  16 and name  HB#)   2.505    0.705    0.705  
assign (resid  16 and name   HN)   (resid  16 and name  HG#)   3.205    1.405    1.405  
assign (resid  16 and name  HB#)   (resid  17 and name   HN)   2.910    1.110    1.110  
assign (resid  16 and name  HB#)   (resid  17 and name   HA)   3.055    1.255    1.255  
assign (resid  17 and name   HN)   (resid  17 and name  HB#)   2.695    0.895    0.895  
assign (resid  17 and name  HB#)   (resid  18 and name   HN)   2.990    1.190    1.190  
assign (resid  17 and name  HG#)   (resid  18 and name   HN)   3.275    1.475    1.475  
assign (resid  18 and name   HN)   (resid  18 and name  HB#)   2.520    0.720    0.720  
assign (resid  18 and name   HA)   (resid  21 and name  HD#)   2.950    1.150    1.150  
assign (resid  18 and name  HB#)   (resid  19 and name   HN)   2.885    1.085    1.085  
assign (resid  19 and name   HN)   (resid  19 and name  HB#)   2.635    0.835    0.835  
assign (resid  19 and name   HA)   (resid  19 and name  HD#)   3.215    1.415    1.415  
assign (resid  20 and name   HN)   (resid  20 and name  HB#)   2.625    0.825    0.825  
assign (resid  20 and name  HB#)   (resid  21 and name   HN)   2.885    1.085    1.085  
assign (resid  21 and name   HN)   (resid  21 and name  HB#)   2.570    0.770    0.770  
assign (resid  21 and name   HA)   (resid  21 and name  HD#)   2.525    0.725    0.725  
assign (resid  21 and name  HB#)   (resid  22 and name   HN)   2.870    1.070    1.070  
assign (resid  21 and name  HD#)   (resid  22 and name   HN)   3.305    1.505    1.505  
assign (resid  22 and name   HN)   (resid  22 and name  HB#)   2.595    0.795    0.795  
assign (resid  22 and name   HN)   (resid  22 and name  HG#)   3.290    1.490    1.490  
!dihedral restraints
assign (resid    1 and name N    ) (resid    1 and name CA   )
       (resid    1 and name C    ) (resid    2 and name N    )    1.0   70.0   30.0 2
assign (resid    2 and name C    ) (resid    3 and name N    )
       (resid    3 and name CA   ) (resid    3 and name C    )    1.0  -70.0   30.0 2
assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name C    ) (resid    4 and name N    )    1.0  -30.0   30.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0  -60.0   40.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name C    ) (resid    5 and name N    )    1.0  -35.0   35.0 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0  -60.0   30.0 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name C    ) (resid    6 and name N    )    1.0  -30.0   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  -60.0   40.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name C    ) (resid    7 and name N    )    1.0  -30.0   30.0 2
assign (resid    6 and name C    ) (resid    7 and name N    )
       (resid    7 and name CA   ) (resid    7 and name C    )    1.0  -70.0   50.0 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name C    ) (resid    8 and name N    )    1.0  -20.0   40.0 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   60.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name C    ) (resid    9 and name N    )    1.0   90.0   60.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )    1.0  -30.0   30.0 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0  -70.0   50.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  -30.0   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  -60.0   30.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  -30.0   30.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0  -70.0   50.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  -30.0   30.0 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
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0 -100.0   80.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  140.0   40.0 2
assign (resid   15 and name C    ) (resid   16 and name N    )
       (resid   16 and name CA   ) (resid   16 and name C    )    1.0  -70.0   50.0 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0  -30.0   40.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -60.0   30.0 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  -30.0   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  -60.0   30.0 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )    1.0  -30.0   30.0 2
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )    1.0  -70.0   50.0 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  -30.0   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  -70.0   50.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0  -35.0   35.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0 -100.0   80.0 2
assign (resid   21 and name C    ) (resid   22 and name N    )
       (resid   22 and name CA   ) (resid   22 and name C    )    1.0 -100.0   80.0 2
assign (resid    1 and name N    ) (resid    1 and name CA   )
       (resid    1 and name CB   ) (resid    1 and name CG   )    1.0  -60.0   30.0 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name CB   ) (resid    7 and name CG   )    1.0  180.0   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   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name CB   ) (resid   10 and name CG   )    1.0  180.0   30.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name CB   ) (resid   14 and name OG   )    1.0   60.0   30.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name CB   ) (resid   20 and name CG   )    1.0  180.0   30.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name CB   ) (resid   21 and name CG   )    1.0  -60.0   30.0 2
!hbond restraints
assign (resid 5 and name HN)(resid 1 and name O) 0 0 2
assign (resid 5 and name N)(resid 1 and name O) 0 0 3
assign (resid 21 and name HN)(resid 17 and name O) 0 0 2
assign (resid 21 and name N)(resid 17 and name O) 0 0 3
assign (resid 19 and name HN)(resid 15 and name O) 0 0 2
assign (resid 19 and name N)(resid 15 and name O) 0 0 3
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ASN   1           H        ASN   1  -1.952  -6.822  -2.483
    2    HA   ASN   1           HA       ASN   1   0.537  -8.285  -2.018
    3    HB2  ASN   1          2HB       ASN   1   0.011  -5.836  -3.730
    4    HB3  ASN   1          1HB       ASN   1   1.544  -6.675  -3.606
    5   HD21  ASN   1          1HD2      ASN   1   1.668  -7.109  -5.729
    6   HD22  ASN   1          2HD2      ASN   1   0.671  -8.214  -6.589
    7    HA   PRO   2           HA       PRO   2   0.826  -5.416   1.549
    8    HB2  PRO   2          2HB       PRO   2   3.368  -6.908   1.877
    9    HB3  PRO   2          1HB       PRO   2   2.099  -6.590   3.062
   10    HG2  PRO   2          2HG       PRO   2   2.377  -9.012   2.005
   11    HG3  PRO   2          1HG       PRO   2   0.773  -8.327   2.313
   12    HD2  PRO   2          2HD       PRO   2   2.237  -8.607  -0.278
   13    HD3  PRO   2          1HD       PRO   2   0.513  -8.807   0.082
   14    H    GLU   3           H        GLU   3   3.602  -6.325  -0.508
   15    HA   GLU   3           HA       GLU   3   5.077  -4.001   0.079
   16    HB2  GLU   3          2HB       GLU   3   5.343  -5.969  -2.169
   17    HB3  GLU   3          1HB       GLU   3   6.389  -4.577  -1.991
   18    HG2  GLU   3          2HG       GLU   3   6.048  -6.764   0.033
   19    HG3  GLU   3          1HG       GLU   3   7.423  -6.566  -1.059
   20    H    ASP   4           H        ASP   4   2.565  -4.611  -2.180
   21    HA   ASP   4           HA       ASP   4   3.198  -2.319  -3.820
   22    HB2  ASP   4          2HB       ASP   4   1.918  -4.444  -4.550
   23    HB3  ASP   4          1HB       ASP   4   0.534  -3.713  -3.743
   24    H    CYS   5           H        CYS   5   0.953  -3.162  -1.270
   25    HA   CYS   5           HA       CYS   5  -0.430  -0.743  -1.043
   26    HB2  CYS   5          2HB       CYS   5  -1.302  -2.555   0.204
   27    HB3  CYS   5          1HB       CYS   5   0.254  -2.907   0.943
   28    H    ARG   6           H        ARG   6   2.597  -1.774   0.512
   29    HA   ARG   6           HA       ARG   6   2.879   0.806   1.736
   30    HB2  ARG   6          2HB       ARG   6   5.017  -0.019   2.618
   31    HB3  ARG   6          1HB       ARG   6   3.651  -1.060   2.985
   32    HG2  ARG   6          2HG       ARG   6   4.318  -2.438   1.032
   33    HG3  ARG   6          1HG       ARG   6   5.805  -1.484   0.967
   34    HD2  ARG   6          2HD       ARG   6   6.052  -3.564   2.145
   35    HD3  ARG   6          1HD       ARG   6   6.395  -2.194   3.207
   36    HE   ARG   6           HE       ARG   6   3.990  -2.545   3.964
   37   HH11  ARG   6          1HH1      ARG   6   5.988  -5.282   2.883
   38   HH12  ARG   6          2HH1      ARG   6   5.202  -6.393   3.902
   39   HH21  ARG   6          1HH2      ARG   6   2.930  -4.072   5.315
   40   HH22  ARG   6          2HH2      ARG   6   3.422  -5.700   5.319
   41    H    GLN   7           H        GLN   7   3.463  -0.279  -1.294
   42    HA   GLN   7           HA       GLN   7   5.826   1.204  -1.961
   43    HB2  GLN   7          2HB       GLN   7   5.253  -0.696  -3.309
   44    HB3  GLN   7          1HB       GLN   7   3.642  -0.067  -3.600
   45    HG2  GLN   7          2HG       GLN   7   4.659   1.800  -4.871
   46    HG3  GLN   7          1HG       GLN   7   6.231   1.024  -4.667
   47   HE21  GLN   7          1HE2      GLN   7   3.089   0.773  -6.136
   48   HE22  GLN   7          2HE2      GLN   7   3.510  -0.418  -7.301
   49    H    ASP   8           H        ASP   8   2.353   1.607  -2.486
   50    HA   ASP   8           HA       ASP   8   2.843   4.331  -3.409
   51    HB2  ASP   8          2HB       ASP   8   0.421   2.547  -3.641
   52    HB3  ASP   8          1HB       ASP   8   0.405   4.249  -4.076
   53    HA   PRO   9           HA       PRO   9   1.678   5.741   0.732
   54    HB2  PRO   9          2HB       PRO   9   1.737   8.259  -0.877
   55    HB3  PRO   9          1HB       PRO   9   2.421   7.943   0.723
   56    HG2  PRO   9          2HG       PRO   9   4.009   8.047  -1.385
   57    HG3  PRO   9          1HG       PRO   9   4.255   6.800  -0.148
   58    HD2  PRO   9          2HD       PRO   9   3.060   6.553  -2.872
   59    HD3  PRO   9          1HD       PRO   9   4.078   5.418  -1.973
   60    H    GLU  10           H        GLU  10   0.284   6.900  -2.332
   61    HA   GLU  10           HA       GLU  10  -2.154   7.916  -1.438
   62    HB2  GLU  10          2HB       GLU  10  -1.268   8.173  -3.729
   63    HB3  GLU  10          1HB       GLU  10  -1.562   6.470  -4.033
   64    HG2  GLU  10          2HG       GLU  10  -3.297   7.663  -5.090
   65    HG3  GLU  10          1HG       GLU  10  -4.003   6.945  -3.646
   66    H    ALA  11           H        ALA  11  -1.232   4.603  -2.295
   67    HA   ALA  11           HA       ALA  11  -3.887   3.557  -2.090
   68    HB1  ALA  11          1HB       ALA  11  -2.854   1.374  -2.407
   69    HB2  ALA  11          2HB       ALA  11  -1.258   2.075  -2.148
   70    HB3  ALA  11          3HB       ALA  11  -2.200   2.532  -3.568
   71    H    ASN  12           H        ASN  12  -0.971   3.359  -0.102
   72    HA   ASN  12           HA       ASN  12  -2.011   1.753   1.959
   73    HB2  ASN  12          2HB       ASN  12   0.390   2.107   1.627
   74    HB3  ASN  12          1HB       ASN  12   0.216   3.794   2.086
   75   HD21  ASN  12          1HD2      ASN  12   0.110   0.505   3.218
   76   HD22  ASN  12          2HD2      ASN  12   0.322   0.843   4.886
   77    H    LYS  13           H        LYS  13  -2.271   5.112   1.363
   78    HA   LYS  13           HA       LYS  13  -3.041   6.016   3.889
   79    HB2  LYS  13          2HB       LYS  13  -2.286   7.520   2.170
   80    HB3  LYS  13          1HB       LYS  13  -3.590   7.018   1.115
   81    HG2  LYS  13          2HG       LYS  13  -5.200   8.162   2.442
   82    HG3  LYS  13          1HG       LYS  13  -4.011   8.490   3.705
   83    HD2  LYS  13          2HD       LYS  13  -4.458  10.456   2.255
   84    HD3  LYS  13          1HD       LYS  13  -2.773   9.946   2.234
   85    HE2  LYS  13          2HE       LYS  13  -3.448  10.472  -0.018
   86    HE3  LYS  13          1HE       LYS  13  -3.217   8.742   0.109
   87    HZ1  LYS  13          1HZ       LYS  13  -5.119   9.232  -1.134
   88    HZ2  LYS  13          2HZ       LYS  13  -5.811  10.188   0.058
   89    HZ3  LYS  13          3HZ       LYS  13  -5.675   8.510   0.275
   90    H    SER  14           H        SER  14  -4.762   4.283   1.469
   91    HA   SER  14           HA       SER  14  -7.216   4.615   3.003
   92    HB2  SER  14          2HB       SER  14  -8.253   3.879   0.738
   93    HB3  SER  14          1HB       SER  14  -7.690   5.542   0.934
   94    HG   SER  14           HG       SER  14  -5.952   3.553  -0.053
   95    HA   PRO  15           HA       PRO  15  -6.173   0.350   4.193
   96    HB2  PRO  15          2HB       PRO  15  -8.962   0.690   5.198
   97    HB3  PRO  15          1HB       PRO  15  -7.560  -0.021   6.006
   98    HG2  PRO  15          2HG       PRO  15  -8.343   2.428   6.628
   99    HG3  PRO  15          1HG       PRO  15  -6.618   2.047   6.483
  100    HD2  PRO  15          2HD       PRO  15  -8.389   3.546   4.616
  101    HD3  PRO  15          1HD       PRO  15  -6.667   3.784   4.975
  102    H    GLU  16           H        GLU  16  -9.218   1.372   2.657
  103    HA   GLU  16           HA       GLU  16 -10.149  -1.144   1.892
  104    HB2  GLU  16          2HB       GLU  16 -10.484   1.363   0.245
  105    HB3  GLU  16          1HB       GLU  16 -11.491  -0.069   0.194
  106    HG2  GLU  16          2HG       GLU  16 -12.798   1.316   1.423
  107    HG3  GLU  16          1HG       GLU  16 -11.899   0.520   2.709
  108    H    GLU  17           H        GLU  17  -7.660   0.847   0.459
  109    HA   GLU  17           HA       GLU  17  -7.594  -0.738  -1.923
  110    HB2  GLU  17          2HB       GLU  17  -5.711   1.411  -0.954
  111    HB3  GLU  17          1HB       GLU  17  -5.590   0.605  -2.514
  112    HG2  GLU  17          2HG       GLU  17  -7.853   2.333  -1.544
  113    HG3  GLU  17          1HG       GLU  17  -6.680   2.723  -2.803
  114    H    CYS  18           H        CYS  18  -5.891  -0.629   1.104
  115    HA   CYS  18           HA       CYS  18  -4.019  -2.621   0.197
  116    HB2  CYS  18          2HB       CYS  18  -4.525  -1.513   2.962
  117    HB3  CYS  18          1HB       CYS  18  -3.235  -2.650   2.564
  118    H    LYS  19           H        LYS  19  -7.135  -2.611   1.379
  119    HA   LYS  19           HA       LYS  19  -7.203  -5.365   2.217
  120    HB2  LYS  19          2HB       LYS  19  -8.796  -3.739   3.105
  121    HB3  LYS  19          1HB       LYS  19  -9.345  -3.366   1.485
  122    HG2  LYS  19          2HG       LYS  19 -10.251  -5.635   1.284
  123    HG3  LYS  19          1HG       LYS  19  -9.728  -5.972   2.940
  124    HD2  LYS  19          2HD       LYS  19 -11.131  -4.206   3.786
  125    HD3  LYS  19          1HD       LYS  19 -11.576  -3.738   2.147
  126    HE2  LYS  19          2HE       LYS  19 -12.650  -5.904   1.828
  127    HE3  LYS  19          1HE       LYS  19 -12.209  -6.364   3.475
  128    HZ1  LYS  19          1HZ       LYS  19 -13.927  -4.067   2.745
  129    HZ2  LYS  19          2HZ       LYS  19 -13.567  -4.570   4.309
  130    HZ3  LYS  19          3HZ       LYS  19 -14.493  -5.553   3.294
  131    H    LYS  20           H        LYS  20  -8.130  -3.432  -0.550
  132    HA   LYS  20           HA       LYS  20  -9.070  -5.406  -2.298
  133    HB2  LYS  20          2HB       LYS  20  -9.423  -2.999  -2.585
  134    HB3  LYS  20          1HB       LYS  20  -7.707  -2.765  -2.825
  135    HG2  LYS  20          2HG       LYS  20  -7.832  -4.132  -4.878
  136    HG3  LYS  20          1HG       LYS  20  -9.573  -4.253  -4.652
  137    HD2  LYS  20          2HD       LYS  20  -8.196  -1.584  -4.825
  138    HD3  LYS  20          1HD       LYS  20  -8.666  -2.459  -6.271
  139    HE2  LYS  20          2HE       LYS  20 -10.379  -0.857  -5.773
  140    HE3  LYS  20          1HE       LYS  20 -11.009  -2.456  -5.439
  141    HZ1  LYS  20          1HZ       LYS  20 -10.720  -2.036  -3.060
  142    HZ2  LYS  20          2HZ       LYS  20 -11.654  -0.863  -3.771
  143    HZ3  LYS  20          3HZ       LYS  20 -10.055  -0.502  -3.389
  144    H    LEU  21           H        LEU  21  -5.904  -3.840  -2.091
  145    HA   LEU  21           HA       LEU  21  -4.697  -5.704  -3.905
  146    HB2  LEU  21          2HB       LEU  21  -3.679  -3.368  -2.301
  147    HB3  LEU  21          1HB       LEU  21  -2.587  -4.435  -3.145
  148    HG   LEU  21           HG       LEU  21  -3.479  -3.724  -5.293
  149   HD11  LEU  21          1HD1      LEU  21  -5.821  -3.369  -4.661
  150   HD12  LEU  21          2HD1      LEU  21  -5.152  -1.975  -5.504
  151   HD13  LEU  21          3HD1      LEU  21  -5.352  -1.934  -3.751
  152   HD21  LEU  21          1HD2      LEU  21  -2.904  -1.403  -3.477
  153   HD22  LEU  21          2HD2      LEU  21  -2.810  -1.386  -5.239
  154   HD23  LEU  21          3HD2      LEU  21  -1.716  -2.407  -4.307
  155    H    LYS  22           H        LYS  22  -4.296  -7.648  -3.181
  156    HA   LYS  22           HA       LYS  22  -3.846  -8.236  -0.403
  157    HB2  LYS  22          2HB       LYS  22  -3.624  -9.966  -2.858
  158    HB3  LYS  22          1HB       LYS  22  -3.538 -10.546  -1.205
  159    HG2  LYS  22          2HG       LYS  22  -5.845  -9.823  -0.833
  160    HG3  LYS  22          1HG       LYS  22  -5.929  -9.245  -2.503
  161    HD2  LYS  22          2HD       LYS  22  -5.509 -11.481  -3.325
  162    HD3  LYS  22          1HD       LYS  22  -5.303 -12.060  -1.673
  163    HE2  LYS  22          2HE       LYS  22  -7.647 -11.506  -1.208
  164    HE3  LYS  22          1HE       LYS  22  -7.836 -10.968  -2.878
  165    HZ1  LYS  22          1HZ       LYS  22  -7.030 -13.720  -2.102
  166    HZ2  LYS  22          2HZ       LYS  22  -7.404 -13.193  -3.648
  167    HZ3  LYS  22          3HZ       LYS  22  -8.597 -13.274  -2.473
  Start of MODEL    2
    1    H    ASN   1           H        ASN   1  -2.160  -6.480  -2.028
    2    HA   ASN   1           HA       ASN   1   0.344  -8.004  -2.022
    3    HB2  ASN   1          2HB       ASN   1  -0.294  -5.497  -3.636
    4    HB3  ASN   1          1HB       ASN   1   1.274  -6.276  -3.545
    5   HD21  ASN   1          1HD2      ASN   1   1.471  -6.627  -5.675
    6   HD22  ASN   1          2HD2      ASN   1   0.503  -7.716  -6.581
    7    HA   PRO   2           HA       PRO   2   0.050  -5.252   1.619
    8    HB2  PRO   2          2HB       PRO   2   2.433  -6.853   2.368
    9    HB3  PRO   2          1HB       PRO   2   0.987  -6.478   3.306
   10    HG2  PRO   2          2HG       PRO   2   1.303  -8.905   2.286
   11    HG3  PRO   2          1HG       PRO   2  -0.286  -8.118   2.268
   12    HD2  PRO   2          2HD       PRO   2   1.688  -8.439   0.044
   13    HD3  PRO   2          1HD       PRO   2  -0.081  -8.603   0.020
   14    H    GLU   3           H        GLU   3   3.228  -6.185   0.309
   15    HA   GLU   3           HA       GLU   3   4.560  -3.874   1.280
   16    HB2  GLU   3          2HB       GLU   3   5.607  -6.074   0.578
   17    HB3  GLU   3          1HB       GLU   3   5.374  -5.552  -1.082
   18    HG2  GLU   3          2HG       GLU   3   7.632  -5.125  -0.411
   19    HG3  GLU   3          1HG       GLU   3   6.784  -3.594  -0.639
   20    H    ASP   4           H        ASP   4   3.016  -4.713  -1.704
   21    HA   ASP   4           HA       ASP   4   3.916  -2.497  -3.232
   22    HB2  ASP   4          2HB       ASP   4   3.125  -4.576  -4.277
   23    HB3  ASP   4          1HB       ASP   4   1.506  -4.242  -3.674
   24    H    CYS   5           H        CYS   5   0.896  -3.065  -1.399
   25    HA   CYS   5           HA       CYS   5  -0.188  -0.567  -2.243
   26    HB2  CYS   5          2HB       CYS   5  -2.003  -0.931  -0.711
   27    HB3  CYS   5          1HB       CYS   5  -1.600  -2.492  -1.411
   28    H    ARG   6           H        ARG   6   1.858  -1.565   0.390
   29    HA   ARG   6           HA       ARG   6   1.658   0.834   1.920
   30    HB2  ARG   6          2HB       ARG   6   3.867  -1.213   1.740
   31    HB3  ARG   6          1HB       ARG   6   3.853   0.100   2.890
   32    HG2  ARG   6          2HG       ARG   6   1.838  -2.142   2.753
   33    HG3  ARG   6          1HG       ARG   6   3.193  -2.053   3.870
   34    HD2  ARG   6          2HD       ARG   6   1.342  -1.346   5.118
   35    HD3  ARG   6          1HD       ARG   6   2.168   0.137   4.670
   36    HE   ARG   6           HE       ARG   6   0.018  -0.680   2.918
   37   HH11  ARG   6          1HH1      ARG   6   0.973   1.308   5.705
   38   HH12  ARG   6          2HH1      ARG   6  -0.403   2.293   5.636
   39   HH21  ARG   6          1HH2      ARG   6  -1.928   0.688   2.891
   40   HH22  ARG   6          2HH2      ARG   6  -2.078   1.926   4.053
   41    H    GLN   7           H        GLN   7   3.420  -0.154  -0.844
   42    HA   GLN   7           HA       GLN   7   5.535   1.710  -0.882
   43    HB2  GLN   7          2HB       GLN   7   5.644  -0.321  -2.143
   44    HB3  GLN   7          1HB       GLN   7   4.197   0.098  -3.036
   45    HG2  GLN   7          2HG       GLN   7   5.441   1.999  -4.036
   46    HG3  GLN   7          1HG       GLN   7   6.898   1.402  -3.235
   47   HE21  GLN   7          1HE2      GLN   7   4.532   0.786  -5.686
   48   HE22  GLN   7          2HE2      GLN   7   5.391  -0.459  -6.501
   49    H    ASP   8           H        ASP   8   2.469   1.638  -2.661
   50    HA   ASP   8           HA       ASP   8   3.007   4.192  -3.846
   51    HB2  ASP   8          2HB       ASP   8   0.532   2.466  -3.926
   52    HB3  ASP   8          1HB       ASP   8   0.621   4.041  -4.705
   53    HA   PRO   9           HA       PRO   9   1.765   6.726  -0.433
   54    HB2  PRO   9          2HB       PRO   9   1.120   8.684  -2.562
   55    HB3  PRO   9          1HB       PRO   9   2.165   8.860  -1.152
   56    HG2  PRO   9          2HG       PRO   9   3.152   8.574  -3.635
   57    HG3  PRO   9          1HG       PRO   9   3.978   7.930  -2.210
   58    HD2  PRO   9          2HD       PRO   9   2.473   6.503  -4.329
   59    HD3  PRO   9          1HD       PRO   9   3.817   5.957  -3.311
   60    H    GLU  10           H        GLU  10  -0.191   6.441  -3.317
   61    HA   GLU  10           HA       GLU  10  -2.585   7.543  -2.379
   62    HB2  GLU  10          2HB       GLU  10  -2.092   7.038  -4.747
   63    HB3  GLU  10          1HB       GLU  10  -2.193   5.320  -4.395
   64    HG2  GLU  10          2HG       GLU  10  -4.203   6.064  -5.462
   65    HG3  GLU  10          1HG       GLU  10  -4.558   5.642  -3.788
   66    H    ALA  11           H        ALA  11  -1.455   4.164  -2.439
   67    HA   ALA  11           HA       ALA  11  -3.803   3.262  -1.017
   68    HB1  ALA  11          1HB       ALA  11  -2.920   1.029  -1.377
   69    HB2  ALA  11          2HB       ALA  11  -1.403   1.705  -1.972
   70    HB3  ALA  11          3HB       ALA  11  -2.895   1.948  -2.881
   71    H    ASN  12           H        ASN  12  -0.732   4.357  -0.232
   72    HA   ASN  12           HA       ASN  12  -0.084   2.874   2.070
   73    HB2  ASN  12          2HB       ASN  12   1.519   4.354   0.914
   74    HB3  ASN  12          1HB       ASN  12   0.589   5.755   1.421
   75   HD21  ASN  12          1HD2      ASN  12   2.889   3.352   2.363
   76   HD22  ASN  12          2HD2      ASN  12   3.250   4.012   3.911
   77    H    LYS  13           H        LYS  13  -2.453   5.281   1.557
   78    HA   LYS  13           HA       LYS  13  -2.777   5.675   4.466
   79    HB2  LYS  13          2HB       LYS  13  -3.971   7.702   3.955
   80    HB3  LYS  13          1HB       LYS  13  -2.414   7.715   3.135
   81    HG2  LYS  13          2HG       LYS  13  -3.479   7.091   1.053
   82    HG3  LYS  13          1HG       LYS  13  -5.042   7.012   1.859
   83    HD2  LYS  13          2HD       LYS  13  -4.865   9.406   2.386
   84    HD3  LYS  13          1HD       LYS  13  -3.322   9.467   1.528
   85    HE2  LYS  13          2HE       LYS  13  -6.009   8.756   0.350
   86    HE3  LYS  13          1HE       LYS  13  -5.093  10.240   0.080
   87    HZ1  LYS  13          1HZ       LYS  13  -4.183   7.524  -0.659
   88    HZ2  LYS  13          2HZ       LYS  13  -3.378   8.973  -0.992
   89    HZ3  LYS  13          3HZ       LYS  13  -4.845   8.619  -1.739
   90    H    SER  14           H        SER  14  -4.003   3.769   2.073
   91    HA   SER  14           HA       SER  14  -6.690   4.028   3.130
   92    HB2  SER  14          2HB       SER  14  -7.303   3.188   0.780
   93    HB3  SER  14          1HB       SER  14  -6.817   4.877   0.983
   94    HG   SER  14           HG       SER  14  -5.721   3.845  -0.779
   95    HA   PRO  15           HA       PRO  15  -5.702  -0.229   4.374
   96    HB2  PRO  15          2HB       PRO  15  -8.448   0.095   5.473
   97    HB3  PRO  15          1HB       PRO  15  -6.989  -0.484   6.285
   98    HG2  PRO  15          2HG       PRO  15  -7.948   1.941   6.811
   99    HG3  PRO  15          1HG       PRO  15  -6.202   1.670   6.682
  100    HD2  PRO  15          2HD       PRO  15  -8.077   2.894   4.701
  101    HD3  PRO  15          1HD       PRO  15  -6.417   3.363   5.130
  102    H    GLU  16           H        GLU  16  -8.593   1.111   2.956
  103    HA   GLU  16           HA       GLU  16  -9.872  -1.241   2.095
  104    HB2  GLU  16          2HB       GLU  16  -9.959   1.511   0.883
  105    HB3  GLU  16          1HB       GLU  16 -11.049   0.195   0.489
  106    HG2  GLU  16          2HG       GLU  16 -11.855   0.187   2.792
  107    HG3  GLU  16          1HG       GLU  16 -10.777   1.537   3.160
  108    H    GLU  17           H        GLU  17  -7.247   0.624   0.690
  109    HA   GLU  17           HA       GLU  17  -7.493  -0.822  -1.767
  110    HB2  GLU  17          2HB       GLU  17  -5.433   1.197  -0.894
  111    HB3  GLU  17          1HB       GLU  17  -5.440   0.416  -2.474
  112    HG2  GLU  17          2HG       GLU  17  -7.738   1.291  -2.816
  113    HG3  GLU  17          1HG       GLU  17  -7.558   2.210  -1.326
  114    H    CYS  18           H        CYS  18  -5.617  -1.027   1.130
  115    HA   CYS  18           HA       CYS  18  -3.966  -3.109   0.091
  116    HB2  CYS  18          2HB       CYS  18  -4.534  -2.240   2.933
  117    HB3  CYS  18          1HB       CYS  18  -3.417  -3.540   2.535
  118    H    LYS  19           H        LYS  19  -7.150  -2.926   1.327
  119    HA   LYS  19           HA       LYS  19  -7.437  -5.778   1.668
  120    HB2  LYS  19          2HB       LYS  19  -9.565  -3.638   1.344
  121    HB3  LYS  19          1HB       LYS  19  -9.876  -5.312   1.762
  122    HG2  LYS  19          2HG       LYS  19  -8.369  -3.311   3.434
  123    HG3  LYS  19          1HG       LYS  19 -10.016  -3.876   3.710
  124    HD2  LYS  19          2HD       LYS  19  -9.137  -6.171   4.006
  125    HD3  LYS  19          1HD       LYS  19  -7.502  -5.542   3.809
  126    HE2  LYS  19          2HE       LYS  19  -8.003  -5.791   6.170
  127    HE3  LYS  19          1HE       LYS  19  -7.843  -4.087   5.756
  128    HZ1  LYS  19          1HZ       LYS  19 -10.413  -5.521   6.052
  129    HZ2  LYS  19          2HZ       LYS  19 -10.230  -3.866   5.753
  130    HZ3  LYS  19          3HZ       LYS  19  -9.722  -4.531   7.213
  131    H    LYS  20           H        LYS  20  -8.122  -3.377  -0.785
  132    HA   LYS  20           HA       LYS  20  -9.324  -5.046  -2.695
  133    HB2  LYS  20          2HB       LYS  20  -9.391  -2.600  -2.846
  134    HB3  LYS  20          1HB       LYS  20  -7.651  -2.552  -3.085
  135    HG2  LYS  20          2HG       LYS  20  -7.891  -3.706  -5.221
  136    HG3  LYS  20          1HG       LYS  20  -9.631  -3.815  -4.970
  137    HD2  LYS  20          2HD       LYS  20  -8.069  -1.242  -5.207
  138    HD3  LYS  20          1HD       LYS  20  -8.998  -1.986  -6.506
  139    HE2  LYS  20          2HE       LYS  20 -10.079  -0.945  -3.883
  140    HE3  LYS  20          1HE       LYS  20 -10.278  -0.198  -5.463
  141    HZ1  LYS  20          1HZ       LYS  20 -11.559  -2.148  -6.159
  142    HZ2  LYS  20          2HZ       LYS  20 -12.255  -1.415  -4.824
  143    HZ3  LYS  20          3HZ       LYS  20 -11.389  -2.828  -4.628
  144    H    LEU  21           H        LEU  21  -5.981  -3.929  -2.445
  145    HA   LEU  21           HA       LEU  21  -5.129  -5.983  -4.321
  146    HB2  LEU  21          2HB       LEU  21  -3.612  -3.768  -2.959
  147    HB3  LEU  21          1HB       LEU  21  -2.996  -4.818  -4.215
  148    HG   LEU  21           HG       LEU  21  -5.239  -2.839  -4.591
  149   HD11  LEU  21          1HD1      LEU  21  -3.573  -1.536  -5.809
  150   HD12  LEU  21          2HD1      LEU  21  -2.326  -2.690  -5.321
  151   HD13  LEU  21          3HD1      LEU  21  -3.158  -1.720  -4.104
  152   HD21  LEU  21          1HD2      LEU  21  -4.833  -3.259  -6.976
  153   HD22  LEU  21          2HD2      LEU  21  -5.347  -4.716  -6.131
  154   HD23  LEU  21          3HD2      LEU  21  -3.647  -4.493  -6.549
  155    H    LYS  22           H        LYS  22  -4.561  -7.868  -3.426
  156    HA   LYS  22           HA       LYS  22  -3.844  -7.982  -0.621
  157    HB2  LYS  22          2HB       LYS  22  -4.658  -9.929  -2.672
  158    HB3  LYS  22          1HB       LYS  22  -3.434 -10.515  -1.560
  159    HG2  LYS  22          2HG       LYS  22  -5.638 -11.137  -0.794
  160    HG3  LYS  22          1HG       LYS  22  -4.908 -10.001   0.328
  161    HD2  LYS  22          2HD       LYS  22  -7.254  -9.496   0.012
  162    HD3  LYS  22          1HD       LYS  22  -6.271  -8.196  -0.661
  163    HE2  LYS  22          2HE       LYS  22  -6.636  -9.014  -2.889
  164    HE3  LYS  22          1HE       LYS  22  -7.448 -10.453  -2.266
  165    HZ1  LYS  22          1HZ       LYS  22  -9.257  -9.138  -1.523
  166    HZ2  LYS  22          2HZ       LYS  22  -8.950  -8.614  -3.104
  167    HZ3  LYS  22          3HZ       LYS  22  -8.421  -7.715  -1.776
  Start of MODEL    3
    1    H    ASN   1           H        ASN   1  -2.193  -7.464  -2.782
    2    HA   ASN   1           HA       ASN   1   0.476  -8.470  -2.136
    3    HB2  ASN   1          2HB       ASN   1  -0.220  -6.497  -4.337
    4    HB3  ASN   1          1HB       ASN   1   1.409  -6.956  -3.864
    5   HD21  ASN   1          1HD2      ASN   1   2.145  -9.025  -4.390
    6   HD22  ASN   1          2HD2      ASN   1   1.405  -9.981  -5.608
    7    HA   PRO   2           HA       PRO   2  -0.628  -5.137   0.823
    8    HB2  PRO   2          2HB       PRO   2   1.541  -6.470   2.334
    9    HB3  PRO   2          1HB       PRO   2  -0.097  -6.061   2.854
   10    HG2  PRO   2          2HG       PRO   2   0.565  -8.587   2.362
   11    HG3  PRO   2          1HG       PRO   2  -1.018  -7.959   1.875
   12    HD2  PRO   2          2HD       PRO   2   1.426  -8.407   0.199
   13    HD3  PRO   2          1HD       PRO   2  -0.274  -8.784  -0.159
   14    H    GLU   3           H        GLU   3   2.729  -6.243   0.325
   15    HA   GLU   3           HA       GLU   3   3.879  -3.731   0.958
   16    HB2  GLU   3          2HB       GLU   3   4.955  -6.219  -0.291
   17    HB3  GLU   3          1HB       GLU   3   5.906  -4.747  -0.358
   18    HG2  GLU   3          2HG       GLU   3   6.564  -6.153   1.518
   19    HG3  GLU   3          1HG       GLU   3   5.904  -4.620   2.061
   20    H    ASP   4           H        ASP   4   2.802  -5.148  -1.974
   21    HA   ASP   4           HA       ASP   4   3.894  -3.271  -3.781
   22    HB2  ASP   4          2HB       ASP   4   2.959  -5.353  -4.591
   23    HB3  ASP   4          1HB       ASP   4   1.385  -4.922  -3.937
   24    H    CYS   5           H        CYS   5   0.704  -3.461  -2.260
   25    HA   CYS   5           HA       CYS   5  -0.235  -1.005  -3.221
   26    HB2  CYS   5          2HB       CYS   5  -1.754  -2.658  -2.311
   27    HB3  CYS   5          1HB       CYS   5  -0.992  -2.534  -0.733
   28    H    ARG   6           H        ARG   6   1.301  -1.822  -0.129
   29    HA   ARG   6           HA       ARG   6   0.988   0.699   1.047
   30    HB2  ARG   6          2HB       ARG   6   1.223  -1.286   2.365
   31    HB3  ARG   6          1HB       ARG   6   2.826  -1.583   1.722
   32    HG2  ARG   6          2HG       ARG   6   3.666   0.393   2.822
   33    HG3  ARG   6          1HG       ARG   6   2.048   0.769   3.415
   34    HD2  ARG   6          2HD       ARG   6   3.539  -0.316   5.088
   35    HD3  ARG   6          1HD       ARG   6   2.029  -1.171   4.798
   36    HE   ARG   6           HE       ARG   6   3.166  -2.887   3.880
   37   HH11  ARG   6          1HH1      ARG   6   5.468  -0.200   4.166
   38   HH12  ARG   6          2HH1      ARG   6   6.839  -1.199   4.146
   39   HH21  ARG   6          1HH2      ARG   6   5.031  -4.247   3.831
   40   HH22  ARG   6          2HH2      ARG   6   6.591  -3.562   3.929
   41    H    GLN   7           H        GLN   7   3.393  -0.404  -1.162
   42    HA   GLN   7           HA       GLN   7   5.517   1.299  -0.429
   43    HB2  GLN   7          2HB       GLN   7   5.679  -0.635  -2.026
   44    HB3  GLN   7          1HB       GLN   7   4.848   0.347  -3.217
   45    HG2  GLN   7          2HG       GLN   7   6.691   1.985  -3.120
   46    HG3  GLN   7          1HG       GLN   7   7.530   0.934  -1.983
   47   HE21  GLN   7          1HE2      GLN   7   9.265   0.624  -3.322
   48   HE22  GLN   7          2HE2      GLN   7   9.183  -0.329  -4.755
   49    H    ASP   8           H        ASP   8   2.601   1.843  -2.200
   50    HA   ASP   8           HA       ASP   8   3.450   4.437  -3.171
   51    HB2  ASP   8          2HB       ASP   8   0.984   2.790  -3.542
   52    HB3  ASP   8          1HB       ASP   8   0.921   4.512  -3.881
   53    HA   PRO   9           HA       PRO   9   2.077   6.738   0.332
   54    HB2  PRO   9          2HB       PRO   9   1.368   9.066  -0.957
   55    HB3  PRO   9          1HB       PRO   9   3.024   8.622  -0.536
   56    HG2  PRO   9          2HG       PRO   9   1.593   8.339  -3.150
   57    HG3  PRO   9          1HG       PRO   9   3.259   8.863  -2.839
   58    HD2  PRO   9          2HD       PRO   9   2.694   6.397  -3.701
   59    HD3  PRO   9          1HD       PRO   9   4.009   6.694  -2.544
   60    H    GLU  10           H        GLU  10   0.009   6.192  -2.394
   61    HA   GLU  10           HA       GLU  10  -2.347   7.405  -1.324
   62    HB2  GLU  10          2HB       GLU  10  -1.762   6.809  -3.769
   63    HB3  GLU  10          1HB       GLU  10  -2.297   5.192  -3.349
   64    HG2  GLU  10          2HG       GLU  10  -4.126   6.263  -4.399
   65    HG3  GLU  10          1HG       GLU  10  -4.498   6.217  -2.677
   66    H    ALA  11           H        ALA  11  -0.669   4.516  -0.643
   67    HA   ALA  11           HA       ALA  11  -2.857   2.916   0.255
   68    HB1  ALA  11          1HB       ALA  11  -0.699   1.943  -0.344
   69    HB2  ALA  11          2HB       ALA  11  -1.130   1.567   1.324
   70    HB3  ALA  11          3HB       ALA  11   0.063   2.822   0.981
   71    H    ASN  12           H        ASN  12  -0.981   5.494   1.500
   72    HA   ASN  12           HA       ASN  12  -1.673   5.099   4.259
   73    HB2  ASN  12          2HB       ASN  12  -0.442   7.446   2.799
   74    HB3  ASN  12          1HB       ASN  12  -0.665   7.371   4.543
   75   HD21  ASN  12          1HD2      ASN  12   0.592   5.968   5.726
   76   HD22  ASN  12          2HD2      ASN  12   2.038   5.259   5.127
   77    H    LYS  13           H        LYS  13  -2.835   6.706   1.496
   78    HA   LYS  13           HA       LYS  13  -4.752   8.448   2.669
   79    HB2  LYS  13          2HB       LYS  13  -4.003   8.654   0.328
   80    HB3  LYS  13          1HB       LYS  13  -4.699   7.090  -0.025
   81    HG2  LYS  13          2HG       LYS  13  -6.223   8.677  -0.872
   82    HG3  LYS  13          1HG       LYS  13  -6.944   8.046   0.605
   83    HD2  LYS  13          2HD       LYS  13  -7.236  10.445   0.503
   84    HD3  LYS  13          1HD       LYS  13  -6.127  10.039   1.814
   85    HE2  LYS  13          2HE       LYS  13  -5.356  11.971   0.513
   86    HE3  LYS  13          1HE       LYS  13  -4.220  10.638   0.423
   87    HZ1  LYS  13          1HZ       LYS  13  -4.573  11.688  -1.720
   88    HZ2  LYS  13          2HZ       LYS  13  -6.217  11.357  -1.657
   89    HZ3  LYS  13          3HZ       LYS  13  -5.105  10.086  -1.785
   90    H    SER  14           H        SER  14  -4.914   5.245   1.189
   91    HA   SER  14           HA       SER  14  -7.197   4.620   2.852
   92    HB2  SER  14          2HB       SER  14  -8.341   3.733   0.768
   93    HB3  SER  14          1HB       SER  14  -8.282   5.490   0.952
   94    HG   SER  14           HG       SER  14  -6.219   4.179  -0.412
   95    HA   PRO  15           HA       PRO  15  -4.506   0.918   2.775
   96    HB2  PRO  15          2HB       PRO  15  -6.148   0.307   5.150
   97    HB3  PRO  15          1HB       PRO  15  -4.390   0.346   4.984
   98    HG2  PRO  15          2HG       PRO  15  -5.667   2.257   6.333
   99    HG3  PRO  15          1HG       PRO  15  -4.285   2.648   5.294
  100    HD2  PRO  15          2HD       PRO  15  -7.210   2.954   4.738
  101    HD3  PRO  15          1HD       PRO  15  -5.874   4.085   4.420
  102    H    GLU  16           H        GLU  16  -7.879   1.422   2.527
  103    HA   GLU  16           HA       GLU  16  -8.978  -1.134   2.598
  104    HB2  GLU  16          2HB       GLU  16 -10.334   0.930   2.319
  105    HB3  GLU  16          1HB       GLU  16  -9.769   1.050   0.653
  106    HG2  GLU  16          2HG       GLU  16 -10.711  -1.344   0.416
  107    HG3  GLU  16          1HG       GLU  16 -11.597  -0.973   1.890
  108    H    GLU  17           H        GLU  17  -7.238   0.497  -0.012
  109    HA   GLU  17           HA       GLU  17  -7.807  -1.571  -1.859
  110    HB2  GLU  17          2HB       GLU  17  -7.351   0.703  -2.662
  111    HB3  GLU  17          1HB       GLU  17  -5.707   0.598  -2.051
  112    HG2  GLU  17          2HG       GLU  17  -5.084  -0.980  -3.662
  113    HG3  GLU  17          1HG       GLU  17  -6.756  -1.348  -4.071
  114    H    CYS  18           H        CYS  18  -5.313  -1.084   0.471
  115    HA   CYS  18           HA       CYS  18  -3.560  -3.079  -0.570
  116    HB2  CYS  18          2HB       CYS  18  -3.806  -2.048   2.268
  117    HB3  CYS  18          1HB       CYS  18  -2.452  -2.965   1.619
  118    H    LYS  19           H        LYS  19  -6.261  -2.970   1.581
  119    HA   LYS  19           HA       LYS  19  -6.165  -5.706   2.422
  120    HB2  LYS  19          2HB       LYS  19  -7.181  -3.782   3.658
  121    HB3  LYS  19          1HB       LYS  19  -8.440  -3.715   2.448
  122    HG2  LYS  19          2HG       LYS  19  -9.278  -4.843   4.382
  123    HG3  LYS  19          1HG       LYS  19  -9.088  -6.028   3.083
  124    HD2  LYS  19          2HD       LYS  19  -7.023  -6.795   4.022
  125    HD3  LYS  19          1HD       LYS  19  -7.068  -5.534   5.253
  126    HE2  LYS  19          2HE       LYS  19  -9.173  -6.539   6.104
  127    HE3  LYS  19          1HE       LYS  19  -8.967  -7.833   4.923
  128    HZ1  LYS  19          1HZ       LYS  19  -6.888  -8.428   5.969
  129    HZ2  LYS  19          2HZ       LYS  19  -8.122  -8.422   7.129
  130    HZ3  LYS  19          3HZ       LYS  19  -7.041  -7.146   7.046
  131    H    LYS  20           H        LYS  20  -7.200  -4.041  -0.328
  132    HA   LYS  20           HA       LYS  20  -9.239  -5.918  -1.191
  133    HB2  LYS  20          2HB       LYS  20  -9.367  -3.450  -1.578
  134    HB3  LYS  20          1HB       LYS  20  -8.000  -3.598  -2.670
  135    HG2  LYS  20          2HG       LYS  20  -9.342  -5.081  -4.104
  136    HG3  LYS  20          1HG       LYS  20 -10.719  -4.851  -3.033
  137    HD2  LYS  20          2HD       LYS  20  -9.312  -2.743  -4.678
  138    HD3  LYS  20          1HD       LYS  20 -10.936  -3.373  -4.931
  139    HE2  LYS  20          2HE       LYS  20 -10.007  -1.757  -2.544
  140    HE3  LYS  20          1HE       LYS  20 -10.947  -1.148  -3.894
  141    HZ1  LYS  20          1HZ       LYS  20 -12.767  -2.580  -3.251
  142    HZ2  LYS  20          2HZ       LYS  20 -12.311  -1.605  -1.955
  143    HZ3  LYS  20          3HZ       LYS  20 -11.883  -3.237  -1.981
  144    H    LEU  21           H        LEU  21  -5.953  -4.973  -1.976
  145    HA   LEU  21           HA       LEU  21  -5.763  -6.874  -4.134
  146    HB2  LEU  21          2HB       LEU  21  -3.621  -5.204  -2.814
  147    HB3  LEU  21          1HB       LEU  21  -3.418  -6.148  -4.272
  148    HG   LEU  21           HG       LEU  21  -5.157  -3.702  -3.949
  149   HD11  LEU  21          1HD1      LEU  21  -2.608  -4.159  -5.479
  150   HD12  LEU  21          2HD1      LEU  21  -2.804  -3.176  -4.026
  151   HD13  LEU  21          3HD1      LEU  21  -3.590  -2.697  -5.529
  152   HD21  LEU  21          1HD2      LEU  21  -5.532  -3.875  -6.368
  153   HD22  LEU  21          2HD2      LEU  21  -6.192  -5.265  -5.509
  154   HD23  LEU  21          3HD2      LEU  21  -4.666  -5.410  -6.388
  155    H    LYS  22           H        LYS  22  -3.826  -8.362  -4.100
  156    HA   LYS  22           HA       LYS  22  -3.766  -9.804  -1.524
  157    HB2  LYS  22          2HB       LYS  22  -3.219 -11.771  -2.816
  158    HB3  LYS  22          1HB       LYS  22  -4.575 -10.982  -3.606
  159    HG2  LYS  22          2HG       LYS  22  -2.827  -9.873  -5.103
  160    HG3  LYS  22          1HG       LYS  22  -1.711 -11.049  -4.444
  161    HD2  LYS  22          2HD       LYS  22  -3.132 -12.868  -5.232
  162    HD3  LYS  22          1HD       LYS  22  -4.264 -11.688  -5.903
  163    HE2  LYS  22          2HE       LYS  22  -1.401 -12.147  -6.716
  164    HE3  LYS  22          1HE       LYS  22  -2.848 -12.461  -7.671
  165    HZ1  LYS  22          1HZ       LYS  22  -1.802 -10.432  -8.373
  166    HZ2  LYS  22          2HZ       LYS  22  -1.859  -9.776  -6.829
  167    HZ3  LYS  22          3HZ       LYS  22  -3.289 -10.043  -7.685
  Start of MODEL    4
    1    H    ASN   1           H        ASN   1  -1.753  -6.773  -2.562
    2    HA   ASN   1           HA       ASN   1   0.664  -8.207  -1.748
    3    HB2  ASN   1          2HB       ASN   1   0.307  -6.233  -3.996
    4    HB3  ASN   1          1HB       ASN   1   1.889  -6.584  -3.314
    5   HD21  ASN   1          1HD2      ASN   1   2.840  -8.572  -3.688
    6   HD22  ASN   1          2HD2      ASN   1   2.231  -9.663  -4.872
    7    HA   PRO   2           HA       PRO   2   0.603  -5.088   1.510
    8    HB2  PRO   2          2HB       PRO   2   3.026  -6.728   2.097
    9    HB3  PRO   2          1HB       PRO   2   1.768  -6.157   3.200
   10    HG2  PRO   2          2HG       PRO   2   1.803  -8.688   2.438
   11    HG3  PRO   2          1HG       PRO   2   0.268  -7.805   2.547
   12    HD2  PRO   2          2HD       PRO   2   1.858  -8.544   0.133
   13    HD3  PRO   2          1HD       PRO   2   0.096  -8.508   0.359
   14    H    GLU   3           H        GLU   3   3.309  -6.238  -0.461
   15    HA   GLU   3           HA       GLU   3   5.160  -4.182   0.011
   16    HB2  GLU   3          2HB       GLU   3   4.806  -5.323  -2.747
   17    HB3  GLU   3          1HB       GLU   3   6.277  -4.755  -1.993
   18    HG2  GLU   3          2HG       GLU   3   6.542  -7.046  -2.081
   19    HG3  GLU   3          1HG       GLU   3   5.984  -6.773  -0.429
   20    H    ASP   4           H        ASP   4   2.511  -4.426  -2.261
   21    HA   ASP   4           HA       ASP   4   3.089  -2.026  -3.693
   22    HB2  ASP   4          2HB       ASP   4   1.784  -4.052  -4.523
   23    HB3  ASP   4          1HB       ASP   4   0.437  -3.456  -3.563
   24    H    CYS   5           H        CYS   5   0.707  -2.967  -1.252
   25    HA   CYS   5           HA       CYS   5  -0.568  -0.502  -0.871
   26    HB2  CYS   5          2HB       CYS   5  -1.555  -2.390   0.184
   27    HB3  CYS   5          1HB       CYS   5  -0.062  -2.810   1.009
   28    H    ARG   6           H        ARG   6   2.471  -1.657   0.399
   29    HA   ARG   6           HA       ARG   6   2.763   0.684   2.075
   30    HB2  ARG   6          2HB       ARG   6   4.517  -1.724   1.662
   31    HB3  ARG   6          1HB       ARG   6   4.846  -0.422   2.799
   32    HG2  ARG   6          2HG       ARG   6   2.841  -0.949   4.051
   33    HG3  ARG   6          1HG       ARG   6   2.385  -2.156   2.856
   34    HD2  ARG   6          2HD       ARG   6   3.366  -3.196   4.841
   35    HD3  ARG   6          1HD       ARG   6   4.344  -3.478   3.410
   36    HE   ARG   6           HE       ARG   6   5.382  -1.235   4.554
   37   HH11  ARG   6          1HH1      ARG   6   4.826  -4.536   5.714
   38   HH12  ARG   6          2HH1      ARG   6   6.227  -4.571   6.673
   39   HH21  ARG   6          1HH2      ARG   6   7.321  -1.307   5.872
   40   HH22  ARG   6          2HH2      ARG   6   7.655  -2.715   6.768
   41    H    GLN   7           H        GLN   7   3.409  -0.095  -1.103
   42    HA   GLN   7           HA       GLN   7   5.884   1.409  -1.330
   43    HB2  GLN   7          2HB       GLN   7   5.560  -0.594  -2.718
   44    HB3  GLN   7          1HB       GLN   7   4.148   0.144  -3.454
   45    HG2  GLN   7          2HG       GLN   7   5.630   1.955  -4.314
   46    HG3  GLN   7          1HG       GLN   7   7.009   1.036  -3.713
   47   HE21  GLN   7          1HE2      GLN   7   7.818   0.776  -5.795
   48   HE22  GLN   7          2HE2      GLN   7   7.081  -0.282  -6.938
   49    H    ASP   8           H        ASP   8   2.649   1.583  -2.812
   50    HA   ASP   8           HA       ASP   8   3.140   4.339  -3.519
   51    HB2  ASP   8          2HB       ASP   8   0.784   2.514  -4.028
   52    HB3  ASP   8          1HB       ASP   8   0.703   4.237  -4.358
   53    HA   PRO   9           HA       PRO   9   1.518   5.495   0.439
   54    HB2  PRO   9          2HB       PRO   9   1.931   8.177   0.187
   55    HB3  PRO   9          1HB       PRO   9   3.187   7.024   0.644
   56    HG2  PRO   9          2HG       PRO   9   2.684   8.320  -1.985
   57    HG3  PRO   9          1HG       PRO   9   4.215   7.893  -1.207
   58    HD2  PRO   9          2HD       PRO   9   3.040   6.447  -3.220
   59    HD3  PRO   9          1HD       PRO   9   4.181   5.772  -2.038
   60    H    GLU  10           H        GLU  10   0.550   6.528  -2.626
   61    HA   GLU  10           HA       GLU  10  -1.738   8.045  -2.012
   62    HB2  GLU  10          2HB       GLU  10  -0.567   7.855  -4.251
   63    HB3  GLU  10          1HB       GLU  10  -1.273   6.262  -4.411
   64    HG2  GLU  10          2HG       GLU  10  -3.494   7.218  -4.435
   65    HG3  GLU  10          1HG       GLU  10  -2.822   8.830  -4.179
   66    H    ALA  11           H        ALA  11  -1.111   4.591  -2.360
   67    HA   ALA  11           HA       ALA  11  -3.884   3.871  -1.854
   68    HB1  ALA  11          1HB       ALA  11  -2.602   2.612  -3.522
   69    HB2  ALA  11          2HB       ALA  11  -3.125   1.577  -2.196
   70    HB3  ALA  11          3HB       ALA  11  -1.453   2.132  -2.275
   71    H    ASN  12           H        ASN  12  -0.818   4.034  -0.272
   72    HA   ASN  12           HA       ASN  12  -1.181   2.315   1.885
   73    HB2  ASN  12          2HB       ASN  12   0.969   3.410   1.190
   74    HB3  ASN  12          1HB       ASN  12   0.371   4.890   1.938
   75   HD21  ASN  12          1HD2      ASN  12   1.390   1.651   2.508
   76   HD22  ASN  12          2HD2      ASN  12   1.809   1.836   4.181
   77    H    LYS  13           H        LYS  13  -2.330   5.571   1.443
   78    HA   LYS  13           HA       LYS  13  -3.173   5.756   4.197
   79    HB2  LYS  13          2HB       LYS  13  -4.136   7.941   3.565
   80    HB3  LYS  13          1HB       LYS  13  -2.426   7.796   3.196
   81    HG2  LYS  13          2HG       LYS  13  -2.918   7.476   0.857
   82    HG3  LYS  13          1HG       LYS  13  -4.650   7.462   1.195
   83    HD2  LYS  13          2HD       LYS  13  -3.977   9.620   0.328
   84    HD3  LYS  13          1HD       LYS  13  -4.508   9.771   1.997
   85    HE2  LYS  13          2HE       LYS  13  -2.519  11.119   1.632
   86    HE3  LYS  13          1HE       LYS  13  -2.158   9.802   2.732
   87    HZ1  LYS  13          1HZ       LYS  13  -1.497   9.853  -0.164
   88    HZ2  LYS  13          2HZ       LYS  13  -1.085   8.610   0.916
   89    HZ3  LYS  13          3HZ       LYS  13  -0.417  10.130   1.086
   90    H    SER  14           H        SER  14  -4.379   4.048   1.725
   91    HA   SER  14           HA       SER  14  -7.064   4.348   2.805
   92    HB2  SER  14          2HB       SER  14  -7.849   3.601   0.491
   93    HB3  SER  14          1HB       SER  14  -7.185   5.232   0.601
   94    HG   SER  14           HG       SER  14  -5.370   3.217   0.036
   95    HA   PRO  15           HA       PRO  15  -5.802   0.117   3.963
   96    HB2  PRO  15          2HB       PRO  15  -8.326   0.381   5.505
   97    HB3  PRO  15          1HB       PRO  15  -6.721  -0.109   6.062
   98    HG2  PRO  15          2HG       PRO  15  -7.684   2.275   6.688
   99    HG3  PRO  15          1HG       PRO  15  -5.975   2.079   6.257
  100    HD2  PRO  15          2HD       PRO  15  -8.238   3.128   4.600
  101    HD3  PRO  15          1HD       PRO  15  -6.570   3.730   4.750
  102    H    GLU  16           H        GLU  16  -8.820   1.377   2.870
  103    HA   GLU  16           HA       GLU  16 -10.221  -0.990   2.344
  104    HB2  GLU  16          2HB       GLU  16 -10.362   1.649   0.879
  105    HB3  GLU  16          1HB       GLU  16 -11.541   0.360   0.741
  106    HG2  GLU  16          2HG       GLU  16 -12.426   2.082   2.150
  107    HG3  GLU  16          1HG       GLU  16 -12.087   0.674   3.149
  108    H    GLU  17           H        GLU  17  -7.832   0.814   0.469
  109    HA   GLU  17           HA       GLU  17  -8.080  -0.902  -1.801
  110    HB2  GLU  17          2HB       GLU  17  -5.971   1.144  -1.099
  111    HB3  GLU  17          1HB       GLU  17  -6.010   0.245  -2.609
  112    HG2  GLU  17          2HG       GLU  17  -8.081   2.193  -1.624
  113    HG3  GLU  17          1HG       GLU  17  -6.919   2.455  -2.922
  114    H    CYS  18           H        CYS  18  -6.145  -0.777   1.078
  115    HA   CYS  18           HA       CYS  18  -4.276  -2.724   0.157
  116    HB2  CYS  18          2HB       CYS  18  -4.855  -1.733   2.944
  117    HB3  CYS  18          1HB       CYS  18  -3.495  -2.774   2.514
  118    H    LYS  19           H        LYS  19  -7.411  -2.928   1.510
  119    HA   LYS  19           HA       LYS  19  -7.238  -5.748   2.131
  120    HB2  LYS  19          2HB       LYS  19  -9.635  -3.974   1.615
  121    HB3  LYS  19          1HB       LYS  19  -9.731  -5.636   2.165
  122    HG2  LYS  19          2HG       LYS  19  -8.546  -4.999   4.223
  123    HG3  LYS  19          1HG       LYS  19  -8.516  -3.327   3.656
  124    HD2  LYS  19          2HD       LYS  19 -10.928  -3.250   3.623
  125    HD3  LYS  19          1HD       LYS  19 -11.015  -4.955   4.065
  126    HE2  LYS  19          2HE       LYS  19  -9.908  -4.439   6.196
  127    HE3  LYS  19          1HE       LYS  19  -9.861  -2.738   5.732
  128    HZ1  LYS  19          1HZ       LYS  19 -11.737  -3.263   7.206
  129    HZ2  LYS  19          2HZ       LYS  19 -12.352  -4.315   6.034
  130    HZ3  LYS  19          3HZ       LYS  19 -12.235  -2.675   5.717
  131    H    LYS  20           H        LYS  20  -8.303  -3.744  -0.459
  132    HA   LYS  20           HA       LYS  20  -9.365  -5.611  -2.260
  133    HB2  LYS  20          2HB       LYS  20  -9.769  -3.223  -2.292
  134    HB3  LYS  20          1HB       LYS  20  -8.075  -2.919  -2.584
  135    HG2  LYS  20          2HG       LYS  20  -8.294  -3.864  -4.822
  136    HG3  LYS  20          1HG       LYS  20 -10.014  -4.186  -4.512
  137    HD2  LYS  20          2HD       LYS  20 -10.438  -1.859  -4.121
  138    HD3  LYS  20          1HD       LYS  20  -8.729  -1.475  -4.251
  139    HE2  LYS  20          2HE       LYS  20  -8.821  -2.155  -6.619
  140    HE3  LYS  20          1HE       LYS  20 -10.557  -2.434  -6.441
  141    HZ1  LYS  20          1HZ       LYS  20  -9.255   0.164  -5.840
  142    HZ2  LYS  20          2HZ       LYS  20 -10.909  -0.135  -5.942
  143    HZ3  LYS  20          3HZ       LYS  20  -9.964  -0.176  -7.326
  144    H    LEU  21           H        LEU  21  -6.142  -4.158  -1.984
  145    HA   LEU  21           HA       LEU  21  -4.994  -5.812  -4.038
  146    HB2  LEU  21          2HB       LEU  21  -3.712  -4.008  -1.979
  147    HB3  LEU  21          1HB       LEU  21  -2.880  -4.753  -3.324
  148    HG   LEU  21           HG       LEU  21  -5.070  -2.686  -3.571
  149   HD11  LEU  21          1HD1      LEU  21  -3.048  -1.746  -2.598
  150   HD12  LEU  21          2HD1      LEU  21  -3.277  -1.174  -4.250
  151   HD13  LEU  21          3HD1      LEU  21  -2.086  -2.429  -3.909
  152   HD21  LEU  21          1HD2      LEU  21  -4.973  -4.192  -5.482
  153   HD22  LEU  21          2HD2      LEU  21  -3.240  -3.912  -5.630
  154   HD23  LEU  21          3HD2      LEU  21  -4.374  -2.594  -5.923
  155    H    LYS  22           H        LYS  22  -3.596  -7.503  -3.670
  156    HA   LYS  22           HA       LYS  22  -3.682  -8.580  -0.948
  157    HB2  LYS  22          2HB       LYS  22  -3.288 -10.785  -1.925
  158    HB3  LYS  22          1HB       LYS  22  -4.777 -10.066  -2.500
  159    HG2  LYS  22          2HG       LYS  22  -3.752  -9.525  -4.619
  160    HG3  LYS  22          1HG       LYS  22  -2.186 -10.100  -4.042
  161    HD2  LYS  22          2HD       LYS  22  -4.665 -11.808  -4.314
  162    HD3  LYS  22          1HD       LYS  22  -3.347 -11.741  -5.485
  163    HE2  LYS  22          2HE       LYS  22  -1.781 -12.549  -3.772
  164    HE3  LYS  22          1HE       LYS  22  -3.083 -12.600  -2.592
  165    HZ1  LYS  22          1HZ       LYS  22  -2.966 -14.220  -5.069
  166    HZ2  LYS  22          2HZ       LYS  22  -4.169 -14.295  -3.897
  167    HZ3  LYS  22          3HZ       LYS  22  -2.592 -14.750  -3.522
  Start of MODEL    5
    1    H    ASN   1           H        ASN   1  -1.682  -6.558  -3.530
    2    HA   ASN   1           HA       ASN   1   0.259  -7.865  -1.757
    3    HB2  ASN   1          2HB       ASN   1   0.647  -5.890  -3.994
    4    HB3  ASN   1          1HB       ASN   1   1.895  -6.197  -2.797
    5   HD21  ASN   1          1HD2      ASN   1   3.250  -6.924  -4.404
    6   HD22  ASN   1          2HD2      ASN   1   3.068  -8.470  -5.158
    7    HA   PRO   2           HA       PRO   2  -1.098  -4.476   0.998
    8    HB2  PRO   2          2HB       PRO   2   0.431  -6.121   2.932
    9    HB3  PRO   2          1HB       PRO   2  -1.224  -5.515   3.050
   10    HG2  PRO   2          2HG       PRO   2  -0.742  -8.105   2.613
   11    HG3  PRO   2          1HG       PRO   2  -2.097  -7.277   1.826
   12    HD2  PRO   2          2HD       PRO   2   0.580  -8.011   0.697
   13    HD3  PRO   2          1HD       PRO   2  -1.030  -8.133  -0.045
   14    H    GLU   3           H        GLU   3   2.023  -6.061   0.725
   15    HA   GLU   3           HA       GLU   3   3.623  -4.097   1.959
   16    HB2  GLU   3          2HB       GLU   3   4.361  -6.030  -0.231
   17    HB3  GLU   3          1HB       GLU   3   5.490  -5.152   0.786
   18    HG2  GLU   3          2HG       GLU   3   4.732  -6.328   2.736
   19    HG3  GLU   3          1HG       GLU   3   3.469  -7.119   1.797
   20    H    ASP   4           H        ASP   4   2.788  -4.666  -1.417
   21    HA   ASP   4           HA       ASP   4   4.172  -2.399  -2.392
   22    HB2  ASP   4          2HB       ASP   4   2.036  -4.135  -3.616
   23    HB3  ASP   4          1HB       ASP   4   2.678  -2.720  -4.438
   24    H    CYS   5           H        CYS   5   0.915  -2.960  -1.322
   25    HA   CYS   5           HA       CYS   5  -0.262  -0.563  -2.058
   26    HB2  CYS   5          2HB       CYS   5  -1.534  -2.425  -1.130
   27    HB3  CYS   5          1HB       CYS   5  -0.717  -2.231   0.411
   28    H    ARG   6           H        ARG   6   1.482  -1.320   0.984
   29    HA   ARG   6           HA       ARG   6   1.236   1.325   1.971
   30    HB2  ARG   6          2HB       ARG   6   3.129  -0.889   2.769
   31    HB3  ARG   6          1HB       ARG   6   3.008   0.645   3.615
   32    HG2  ARG   6          2HG       ARG   6   0.648   0.150   4.129
   33    HG3  ARG   6          1HG       ARG   6   0.821  -1.412   3.323
   34    HD2  ARG   6          2HD       ARG   6   2.541  -2.061   4.909
   35    HD3  ARG   6          1HD       ARG   6   2.442  -0.488   5.695
   36    HE   ARG   6           HE       ARG   6  -0.029  -1.974   5.605
   37   HH11  ARG   6          1HH1      ARG   6   2.887  -1.313   7.502
   38   HH12  ARG   6          2HH1      ARG   6   2.233  -1.812   8.985
   39   HH21  ARG   6          1HH2      ARG   6  -0.928  -2.717   7.657
   40   HH22  ARG   6          2HH2      ARG   6   0.005  -2.621   9.074
   41    H    GLN   7           H        GLN   7   3.351  -0.118  -0.252
   42    HA   GLN   7           HA       GLN   7   5.559   1.696   0.027
   43    HB2  GLN   7          2HB       GLN   7   5.737  -0.633  -0.857
   44    HB3  GLN   7          1HB       GLN   7   4.837  -0.123  -2.272
   45    HG2  GLN   7          2HG       GLN   7   6.637   1.477  -2.793
   46    HG3  GLN   7          1HG       GLN   7   7.556   0.845  -1.424
   47   HE21  GLN   7          1HE2      GLN   7   6.458   0.264  -4.634
   48   HE22  GLN   7          2HE2      GLN   7   7.355  -1.177  -4.904
   49    H    ASP   8           H        ASP   8   2.720   1.406  -2.036
   50    HA   ASP   8           HA       ASP   8   3.482   3.614  -3.679
   51    HB2  ASP   8          2HB       ASP   8   1.069   1.827  -3.620
   52    HB3  ASP   8          1HB       ASP   8   1.057   3.303  -4.581
   53    HA   PRO   9           HA       PRO   9   2.194   6.916  -1.263
   54    HB2  PRO   9          2HB       PRO   9   1.742   8.836  -3.090
   55    HB3  PRO   9          1HB       PRO   9   3.357   8.208  -2.739
   56    HG2  PRO   9          2HG       PRO   9   1.494   7.505  -4.969
   57    HG3  PRO   9          1HG       PRO   9   3.236   7.831  -5.031
   58    HD2  PRO   9          2HD       PRO   9   2.235   5.319  -5.033
   59    HD3  PRO   9          1HD       PRO   9   3.782   5.729  -4.269
   60    H    GLU  10           H        GLU  10  -0.205   6.069  -3.751
   61    HA   GLU  10           HA       GLU  10  -2.165   7.570  -2.146
   62    HB2  GLU  10          2HB       GLU  10  -1.878   8.033  -4.665
   63    HB3  GLU  10          1HB       GLU  10  -2.600   6.454  -4.917
   64    HG2  GLU  10          2HG       GLU  10  -4.310   8.081  -5.190
   65    HG3  GLU  10          1HG       GLU  10  -4.605   7.247  -3.666
   66    H    ALA  11           H        ALA  11  -0.922   4.581  -2.532
   67    HA   ALA  11           HA       ALA  11  -3.428   3.163  -2.248
   68    HB1  ALA  11          1HB       ALA  11  -2.117   1.116  -2.386
   69    HB2  ALA  11          2HB       ALA  11  -0.627   2.050  -2.300
   70    HB3  ALA  11          3HB       ALA  11  -1.685   2.208  -3.704
   71    H    ASN  12           H        ASN  12  -0.600   4.036  -0.337
   72    HA   ASN  12           HA       ASN  12  -1.337   2.528   1.975
   73    HB2  ASN  12          2HB       ASN  12   0.483   3.603   3.123
   74    HB3  ASN  12          1HB       ASN  12   1.018   3.303   1.479
   75   HD21  ASN  12          1HD2      ASN  12   2.012   5.170   3.431
   76   HD22  ASN  12          2HD2      ASN  12   1.922   6.744   2.733
   77    H    LYS  13           H        LYS  13  -2.818   4.927   0.624
   78    HA   LYS  13           HA       LYS  13  -3.462   6.979   2.354
   79    HB2  LYS  13          2HB       LYS  13  -4.122   6.541  -0.082
   80    HB3  LYS  13          1HB       LYS  13  -5.429   5.573   0.567
   81    HG2  LYS  13          2HG       LYS  13  -6.252   7.745  -0.010
   82    HG3  LYS  13          1HG       LYS  13  -6.262   7.584   1.751
   83    HD2  LYS  13          2HD       LYS  13  -4.329   8.931   1.981
   84    HD3  LYS  13          1HD       LYS  13  -3.975   8.826   0.257
   85    HE2  LYS  13          2HE       LYS  13  -6.325  10.247   1.500
   86    HE3  LYS  13          1HE       LYS  13  -4.878  11.009   0.847
   87    HZ1  LYS  13          1HZ       LYS  13  -6.526  11.116  -0.832
   88    HZ2  LYS  13          2HZ       LYS  13  -6.950   9.513  -0.647
   89    HZ3  LYS  13          3HZ       LYS  13  -5.445   9.908  -1.314
   90    H    SER  14           H        SER  14  -4.926   3.749   2.033
   91    HA   SER  14           HA       SER  14  -5.824   3.823   4.749
   92    HB2  SER  14          2HB       SER  14  -8.143   3.154   4.047
   93    HB3  SER  14          1HB       SER  14  -7.734   4.810   3.590
   94    HG   SER  14           HG       SER  14  -8.235   4.209   1.653
   95    HA   PRO  15           HA       PRO  15  -4.721  -0.476   4.092
   96    HB2  PRO  15          2HB       PRO  15  -6.649  -1.346   6.120
   97    HB3  PRO  15          1HB       PRO  15  -4.887  -1.359   6.189
   98    HG2  PRO  15          2HG       PRO  15  -6.331   0.334   7.706
   99    HG3  PRO  15          1HG       PRO  15  -4.760   0.786   7.024
  100    HD2  PRO  15          2HD       PRO  15  -7.507   1.443   6.009
  101    HD3  PRO  15          1HD       PRO  15  -6.104   2.511   6.225
  102    H    GLU  16           H        GLU  16  -7.821   0.700   3.696
  103    HA   GLU  16           HA       GLU  16  -9.226  -1.647   3.006
  104    HB2  GLU  16          2HB       GLU  16 -10.265   0.534   3.651
  105    HB3  GLU  16          1HB       GLU  16  -9.772   1.177   2.096
  106    HG2  GLU  16          2HG       GLU  16 -11.187  -0.389   0.943
  107    HG3  GLU  16          1HG       GLU  16 -11.609  -1.174   2.464
  108    H    GLU  17           H        GLU  17  -7.325   0.699   1.150
  109    HA   GLU  17           HA       GLU  17  -7.743  -0.503  -1.386
  110    HB2  GLU  17          2HB       GLU  17  -6.829   1.785  -1.162
  111    HB3  GLU  17          1HB       GLU  17  -5.406   1.151  -0.359
  112    HG2  GLU  17          2HG       GLU  17  -4.743   1.654  -2.573
  113    HG3  GLU  17          1HG       GLU  17  -4.883  -0.092  -2.493
  114    H    CYS  18           H        CYS  18  -5.423  -0.977   1.216
  115    HA   CYS  18           HA       CYS  18  -3.750  -2.840  -0.088
  116    HB2  CYS  18          2HB       CYS  18  -4.288  -2.560   2.873
  117    HB3  CYS  18          1HB       CYS  18  -2.926  -3.410   2.152
  118    H    LYS  19           H        LYS  19  -6.740  -3.204   1.609
  119    HA   LYS  19           HA       LYS  19  -6.759  -6.079   1.740
  120    HB2  LYS  19          2HB       LYS  19  -7.986  -4.637   3.308
  121    HB3  LYS  19          1HB       LYS  19  -8.945  -4.008   1.986
  122    HG2  LYS  19          2HG       LYS  19  -9.878  -6.277   1.645
  123    HG3  LYS  19          1HG       LYS  19  -8.982  -6.815   3.071
  124    HD2  LYS  19          2HD       LYS  19 -10.143  -5.191   4.446
  125    HD3  LYS  19          1HD       LYS  19 -11.001  -4.576   3.034
  126    HE2  LYS  19          2HE       LYS  19 -12.024  -6.815   2.759
  127    HE3  LYS  19          1HE       LYS  19 -11.228  -7.323   4.250
  128    HZ1  LYS  19          1HZ       LYS  19 -12.440  -5.596   5.428
  129    HZ2  LYS  19          2HZ       LYS  19 -13.521  -6.621   4.617
  130    HZ3  LYS  19          3HZ       LYS  19 -13.160  -5.107   3.988
  131    H    LYS  20           H        LYS  20  -7.627  -3.632  -0.467
  132    HA   LYS  20           HA       LYS  20  -9.286  -5.241  -2.197
  133    HB2  LYS  20          2HB       LYS  20  -9.861  -2.947  -1.871
  134    HB3  LYS  20          1HB       LYS  20  -8.227  -2.432  -2.224
  135    HG2  LYS  20          2HG       LYS  20  -8.532  -3.059  -4.537
  136    HG3  LYS  20          1HG       LYS  20 -10.188  -3.579  -4.182
  137    HD2  LYS  20          2HD       LYS  20 -10.888  -1.401  -3.707
  138    HD3  LYS  20          1HD       LYS  20  -9.235  -0.823  -3.494
  139    HE2  LYS  20          2HE       LYS  20 -10.516  -1.671  -6.081
  140    HE3  LYS  20          1HE       LYS  20 -10.154  -0.022  -5.577
  141    HZ1  LYS  20          1HZ       LYS  20  -7.792  -0.709  -5.406
  142    HZ2  LYS  20          2HZ       LYS  20  -8.397  -0.684  -6.976
  143    HZ3  LYS  20          3HZ       LYS  20  -8.186  -2.163  -6.191
  144    H    LEU  21           H        LEU  21  -6.001  -4.099  -2.053
  145    HA   LEU  21           HA       LEU  21  -5.328  -5.215  -4.637
  146    HB2  LEU  21          2HB       LEU  21  -3.557  -4.058  -2.471
  147    HB3  LEU  21          1HB       LEU  21  -3.032  -4.494  -4.080
  148    HG   LEU  21           HG       LEU  21  -4.927  -2.256  -3.363
  149   HD11  LEU  21          1HD1      LEU  21  -2.642  -1.751  -2.787
  150   HD12  LEU  21          2HD1      LEU  21  -3.136  -0.808  -4.193
  151   HD13  LEU  21          3HD1      LEU  21  -2.104  -2.222  -4.399
  152   HD21  LEU  21          1HD2      LEU  21  -4.805  -1.643  -5.735
  153   HD22  LEU  21          2HD2      LEU  21  -5.545  -3.225  -5.501
  154   HD23  LEU  21          3HD2      LEU  21  -3.873  -3.106  -6.058
  155    H    LYS  22           H        LYS  22  -3.480  -6.782  -4.724
  156    HA   LYS  22           HA       LYS  22  -4.025  -8.924  -2.845
  157    HB2  LYS  22          2HB       LYS  22  -2.297  -8.882  -5.325
  158    HB3  LYS  22          1HB       LYS  22  -2.657 -10.304  -4.362
  159    HG2  LYS  22          2HG       LYS  22  -5.035 -10.061  -4.916
  160    HG3  LYS  22          1HG       LYS  22  -4.644  -8.655  -5.905
  161    HD2  LYS  22          2HD       LYS  22  -3.199 -10.044  -7.307
  162    HD3  LYS  22          1HD       LYS  22  -3.606 -11.455  -6.331
  163    HE2  LYS  22          2HE       LYS  22  -5.948 -11.235  -6.974
  164    HE3  LYS  22          1HE       LYS  22  -5.567  -9.793  -7.912
  165    HZ1  LYS  22          1HZ       LYS  22  -4.081 -11.200  -9.272
  166    HZ2  LYS  22          2HZ       LYS  22  -5.705 -11.606  -9.380
  167    HZ3  LYS  22          3HZ       LYS  22  -4.669 -12.574  -8.468
  Start of MODEL    6
    1    H    ASN   1           H        ASN   1  -1.827  -7.284  -2.224
    2    HA   ASN   1           HA       ASN   1   0.239  -8.742  -0.738
    3    HB2  ASN   1          2HB       ASN   1   0.344  -6.914  -3.152
    4    HB3  ASN   1          1HB       ASN   1   1.786  -7.448  -2.302
    5   HD21  ASN   1          1HD2      ASN   1   2.463  -9.534  -2.539
    6   HD22  ASN   1          2HD2      ASN   1   1.850 -10.575  -3.771
    7    HA   PRO   2           HA       PRO   2  -0.369  -5.113   1.966
    8    HB2  PRO   2          2HB       PRO   2   1.816  -6.461   3.464
    9    HB3  PRO   2          1HB       PRO   2   0.252  -5.878   4.045
   10    HG2  PRO   2          2HG       PRO   2   0.676  -8.478   3.720
   11    HG3  PRO   2          1HG       PRO   2  -0.878  -7.757   3.268
   12    HD2  PRO   2          2HD       PRO   2   1.403  -8.581   1.515
   13    HD3  PRO   2          1HD       PRO   2  -0.346  -8.778   1.268
   14    H    GLU   3           H        GLU   3   2.926  -6.350   1.387
   15    HA   GLU   3           HA       GLU   3   4.151  -3.831   1.866
   16    HB2  GLU   3          2HB       GLU   3   5.270  -6.308   0.532
   17    HB3  GLU   3          1HB       GLU   3   6.211  -4.892   0.944
   18    HG2  GLU   3          2HG       GLU   3   6.581  -6.642   2.560
   19    HG3  GLU   3          1HG       GLU   3   5.754  -5.290   3.322
   20    H    ASP   4           H        ASP   4   3.347  -5.630  -1.059
   21    HA   ASP   4           HA       ASP   4   4.489  -3.783  -2.886
   22    HB2  ASP   4          2HB       ASP   4   3.993  -6.064  -3.592
   23    HB3  ASP   4          1HB       ASP   4   2.282  -5.799  -3.289
   24    H    CYS   5           H        CYS   5   1.387  -3.986  -1.352
   25    HA   CYS   5           HA       CYS   5   0.007  -2.098  -2.871
   26    HB2  CYS   5          2HB       CYS   5  -1.155  -3.602  -1.376
   27    HB3  CYS   5          1HB       CYS   5  -0.337  -2.907   0.015
   28    H    ARG   6           H        ARG   6   2.491  -1.684  -0.488
   29    HA   ARG   6           HA       ARG   6   1.719   0.962   0.308
   30    HB2  ARG   6          2HB       ARG   6   4.390  -0.405   0.646
   31    HB3  ARG   6          1HB       ARG   6   3.895   1.082   1.426
   32    HG2  ARG   6          2HG       ARG   6   2.764  -1.671   1.881
   33    HG3  ARG   6          1HG       ARG   6   3.771  -0.738   2.983
   34    HD2  ARG   6          2HD       ARG   6   1.909   0.998   2.967
   35    HD3  ARG   6          1HD       ARG   6   0.920  -0.224   2.168
   36    HE   ARG   6           HE       ARG   6   2.185  -0.636   4.786
   37   HH11  ARG   6          1HH1      ARG   6  -0.679  -1.004   2.710
   38   HH12  ARG   6          2HH1      ARG   6  -1.602  -1.749   3.922
   39   HH21  ARG   6          1HH2      ARG   6   0.845  -1.635   6.442
   40   HH22  ARG   6          2HH2      ARG   6  -0.729  -2.116   6.070
   41    H    GLN   7           H        GLN   7   2.852  -0.112  -2.558
   42    HA   GLN   7           HA       GLN   7   4.819   1.789  -3.255
   43    HB2  GLN   7          2HB       GLN   7   4.373  -0.321  -4.497
   44    HB3  GLN   7          1HB       GLN   7   2.853   0.358  -5.048
   45    HG2  GLN   7          2HG       GLN   7   4.040   2.082  -6.272
   46    HG3  GLN   7          1HG       GLN   7   5.580   1.463  -5.676
   47   HE21  GLN   7          1HE2      GLN   7   2.934   0.920  -7.851
   48   HE22  GLN   7          2HE2      GLN   7   3.673  -0.349  -8.738
   49    H    ASP   8           H        ASP   8   1.309   1.752  -3.452
   50    HA   ASP   8           HA       ASP   8   1.198   4.438  -4.580
   51    HB2  ASP   8          2HB       ASP   8  -0.987   2.577  -3.599
   52    HB3  ASP   8          1HB       ASP   8  -1.309   4.239  -4.043
   53    HA   PRO   9           HA       PRO   9   1.664   6.341  -0.507
   54    HB2  PRO   9          2HB       PRO   9   0.315   8.529  -2.034
   55    HB3  PRO   9          1HB       PRO   9   1.738   8.612  -0.989
   56    HG2  PRO   9          2HG       PRO   9   2.026   8.665  -3.620
   57    HG3  PRO   9          1HG       PRO   9   3.145   7.727  -2.618
   58    HD2  PRO   9          2HD       PRO   9   0.917   6.783  -4.357
   59    HD3  PRO   9          1HD       PRO   9   2.485   6.035  -4.013
   60    H    GLU  10           H        GLU  10  -1.231   6.167  -2.426
   61    HA   GLU  10           HA       GLU  10  -3.080   7.136  -0.541
   62    HB2  GLU  10          2HB       GLU  10  -3.523   6.905  -2.987
   63    HB3  GLU  10          1HB       GLU  10  -3.619   5.164  -2.767
   64    HG2  GLU  10          2HG       GLU  10  -5.529   5.428  -1.329
   65    HG3  GLU  10          1HG       GLU  10  -5.403   7.180  -1.435
   66    H    ALA  11           H        ALA  11  -1.433   4.106  -0.747
   67    HA   ALA  11           HA       ALA  11  -3.304   2.577   0.782
   68    HB1  ALA  11          1HB       ALA  11  -1.638   1.512  -0.659
   69    HB2  ALA  11          2HB       ALA  11  -1.483   0.969   1.012
   70    HB3  ALA  11          3HB       ALA  11  -0.351   2.155   0.358
   71    H    ASN  12           H        ASN  12  -0.945   4.934   1.489
   72    HA   ASN  12           HA       ASN  12  -0.896   4.231   4.317
   73    HB2  ASN  12          2HB       ASN  12   0.693   6.251   2.714
   74    HB3  ASN  12          1HB       ASN  12   0.771   6.135   4.467
   75   HD21  ASN  12          1HD2      ASN  12   0.628   3.202   4.538
   76   HD22  ASN  12          2HD2      ASN  12   2.159   2.652   3.985
   77    H    LYS  13           H        LYS  13  -2.743   5.804   2.249
   78    HA   LYS  13           HA       LYS  13  -3.663   7.860   4.087
   79    HB2  LYS  13          2HB       LYS  13  -3.399   8.499   1.713
   80    HB3  LYS  13          1HB       LYS  13  -4.403   7.158   1.220
   81    HG2  LYS  13          2HG       LYS  13  -5.553   9.341   2.925
   82    HG3  LYS  13          1HG       LYS  13  -5.329   9.590   1.198
   83    HD2  LYS  13          2HD       LYS  13  -6.698   7.554   0.776
   84    HD3  LYS  13          1HD       LYS  13  -6.980   7.426   2.512
   85    HE2  LYS  13          2HE       LYS  13  -8.078   9.603   2.509
   86    HE3  LYS  13          1HE       LYS  13  -7.739   9.788   0.791
   87    HZ1  LYS  13          1HZ       LYS  13  -9.179   7.896   0.330
   88    HZ2  LYS  13          2HZ       LYS  13 -10.020   9.053   1.223
   89    HZ3  LYS  13          3HZ       LYS  13  -9.452   7.674   1.981
   90    H    SER  14           H        SER  14  -4.839   5.015   2.284
   91    HA   SER  14           HA       SER  14  -6.171   4.149   4.637
   92    HB2  SER  14          2HB       SER  14  -8.361   3.816   3.446
   93    HB3  SER  14          1HB       SER  14  -7.941   5.503   3.717
   94    HG   SER  14           HG       SER  14  -8.698   4.558   1.533
   95    HA   PRO  15           HA       PRO  15  -4.556   0.415   2.738
   96    HB2  PRO  15          2HB       PRO  15  -6.041  -1.115   4.751
   97    HB3  PRO  15          1HB       PRO  15  -4.300  -0.933   4.542
   98    HG2  PRO  15          2HG       PRO  15  -5.584   0.192   6.615
   99    HG3  PRO  15          1HG       PRO  15  -4.193   0.960   5.837
  100    HD2  PRO  15          2HD       PRO  15  -7.113   1.534   5.456
  101    HD3  PRO  15          1HD       PRO  15  -5.746   2.655   5.696
  102    H    GLU  16           H        GLU  16  -7.425   1.482   2.177
  103    HA   GLU  16           HA       GLU  16  -9.068  -0.739   1.562
  104    HB2  GLU  16          2HB       GLU  16  -8.950   1.998   0.294
  105    HB3  GLU  16          1HB       GLU  16 -10.263   0.844   0.097
  106    HG2  GLU  16          2HG       GLU  16 -10.840   1.038   2.413
  107    HG3  GLU  16          1HG       GLU  16  -9.429   2.055   2.716
  108    H    GLU  17           H        GLU  17  -6.535   1.002  -0.121
  109    HA   GLU  17           HA       GLU  17  -6.706  -0.333  -2.592
  110    HB2  GLU  17          2HB       GLU  17  -4.446   1.098  -1.216
  111    HB3  GLU  17          1HB       GLU  17  -4.198   0.268  -2.743
  112    HG2  GLU  17          2HG       GLU  17  -6.156   2.497  -2.253
  113    HG3  GLU  17          1HG       GLU  17  -4.593   2.649  -3.061
  114    H    CYS  18           H        CYS  18  -5.441  -1.268   0.462
  115    HA   CYS  18           HA       CYS  18  -3.935  -3.474  -0.653
  116    HB2  CYS  18          2HB       CYS  18  -4.375  -2.703   2.225
  117    HB3  CYS  18          1HB       CYS  18  -3.173  -3.845   1.619
  118    H    LYS  19           H        LYS  19  -7.020  -2.843   0.714
  119    HA   LYS  19           HA       LYS  19  -7.663  -5.602   1.076
  120    HB2  LYS  19          2HB       LYS  19  -9.424  -3.188   0.586
  121    HB3  LYS  19          1HB       LYS  19 -10.063  -4.797   0.880
  122    HG2  LYS  19          2HG       LYS  19  -8.333  -3.242   2.800
  123    HG3  LYS  19          1HG       LYS  19 -10.089  -3.383   2.889
  124    HD2  LYS  19          2HD       LYS  19  -9.853  -5.834   3.090
  125    HD3  LYS  19          1HD       LYS  19  -8.101  -5.643   3.097
  126    HE2  LYS  19          2HE       LYS  19  -9.981  -4.418   5.106
  127    HE3  LYS  19          1HE       LYS  19  -9.063  -5.901   5.357
  128    HZ1  LYS  19          1HZ       LYS  19  -7.892  -3.212   4.870
  129    HZ2  LYS  19          2HZ       LYS  19  -7.034  -4.641   5.131
  130    HZ3  LYS  19          3HZ       LYS  19  -7.980  -4.005   6.356
  131    H    LYS  20           H        LYS  20  -7.592  -3.383  -1.512
  132    HA   LYS  20           HA       LYS  20  -8.784  -5.130  -3.430
  133    HB2  LYS  20          2HB       LYS  20  -9.033  -2.719  -3.620
  134    HB3  LYS  20          1HB       LYS  20  -7.301  -2.504  -3.688
  135    HG2  LYS  20          2HG       LYS  20  -8.641  -4.121  -5.806
  136    HG3  LYS  20          1HG       LYS  20  -8.815  -2.371  -5.849
  137    HD2  LYS  20          2HD       LYS  20  -6.195  -3.862  -5.794
  138    HD3  LYS  20          1HD       LYS  20  -6.952  -3.211  -7.245
  139    HE2  LYS  20          2HE       LYS  20  -5.997  -1.591  -4.854
  140    HE3  LYS  20          1HE       LYS  20  -5.204  -1.717  -6.412
  141    HZ1  LYS  20          1HZ       LYS  20  -7.020  -0.588  -7.453
  142    HZ2  LYS  20          2HZ       LYS  20  -6.487   0.316  -6.130
  143    HZ3  LYS  20          3HZ       LYS  20  -7.918  -0.556  -6.018
  144    H    LEU  21           H        LEU  21  -5.431  -3.963  -2.873
  145    HA   LEU  21           HA       LEU  21  -4.389  -6.199  -4.459
  146    HB2  LEU  21          2HB       LEU  21  -2.961  -3.903  -3.093
  147    HB3  LEU  21          1HB       LEU  21  -2.200  -5.110  -4.101
  148    HG   LEU  21           HG       LEU  21  -4.189  -3.048  -5.036
  149   HD11  LEU  21          1HD1      LEU  21  -1.202  -3.228  -5.387
  150   HD12  LEU  21          2HD1      LEU  21  -2.071  -2.054  -4.397
  151   HD13  LEU  21          3HD1      LEU  21  -2.258  -2.041  -6.151
  152   HD21  LEU  21          1HD2      LEU  21  -4.287  -5.094  -6.370
  153   HD22  LEU  21          2HD2      LEU  21  -2.537  -5.045  -6.577
  154   HD23  LEU  21          3HD2      LEU  21  -3.543  -3.782  -7.285
  155    H    LYS  22           H        LYS  22  -4.206  -8.027  -3.296
  156    HA   LYS  22           HA       LYS  22  -4.278  -7.961  -0.430
  157    HB2  LYS  22          2HB       LYS  22  -3.981 -10.293  -2.305
  158    HB3  LYS  22          1HB       LYS  22  -4.309 -10.409  -0.587
  159    HG2  LYS  22          2HG       LYS  22  -6.447  -9.290  -0.885
  160    HG3  LYS  22          1HG       LYS  22  -6.115  -9.085  -2.606
  161    HD2  LYS  22          2HD       LYS  22  -6.036 -11.528  -2.865
  162    HD3  LYS  22          1HD       LYS  22  -6.399 -11.711  -1.148
  163    HE2  LYS  22          2HE       LYS  22  -8.541 -10.592  -1.474
  164    HE3  LYS  22          1HE       LYS  22  -8.168 -10.367  -3.183
  165    HZ1  LYS  22          1HZ       LYS  22  -8.456 -12.991  -1.829
  166    HZ2  LYS  22          2HZ       LYS  22  -8.125 -12.767  -3.449
  167    HZ3  LYS  22          3HZ       LYS  22  -9.613 -12.284  -2.822
  Start of MODEL    7
    1    H    ASN   1           H        ASN   1  -1.855  -7.351  -2.674
    2    HA   ASN   1           HA       ASN   1   0.518  -8.487  -1.394
    3    HB2  ASN   1          2HB       ASN   1   0.255  -6.778  -3.859
    4    HB3  ASN   1          1HB       ASN   1   1.806  -7.079  -3.083
    5   HD21  ASN   1          1HD2      ASN   1   0.832  -7.853  -5.749
    6   HD22  ASN   1          2HD2      ASN   1   0.985  -9.567  -5.795
    7    HA   PRO   2           HA       PRO   2   0.055  -4.994   1.463
    8    HB2  PRO   2          2HB       PRO   2   2.422  -6.411   2.575
    9    HB3  PRO   2          1HB       PRO   2   0.974  -5.833   3.407
   10    HG2  PRO   2          2HG       PRO   2   1.295  -8.421   2.928
   11    HG3  PRO   2          1HG       PRO   2  -0.293  -7.652   2.738
   12    HD2  PRO   2          2HD       PRO   2   1.657  -8.495   0.640
   13    HD3  PRO   2          1HD       PRO   2  -0.111  -8.581   0.653
   14    H    GLU   3           H        GLU   3   3.141  -6.263   0.261
   15    HA   GLU   3           HA       GLU   3   4.652  -3.920   0.648
   16    HB2  GLU   3          2HB       GLU   3   6.255  -4.870  -0.964
   17    HB3  GLU   3          1HB       GLU   3   5.726  -6.071   0.202
   18    HG2  GLU   3          2HG       GLU   3   4.316  -7.128  -1.412
   19    HG3  GLU   3          1HG       GLU   3   4.537  -5.803  -2.545
   20    H    ASP   4           H        ASP   4   2.503  -4.894  -1.893
   21    HA   ASP   4           HA       ASP   4   3.466  -2.937  -3.745
   22    HB2  ASP   4          2HB       ASP   4   2.594  -5.140  -4.483
   23    HB3  ASP   4          1HB       ASP   4   0.996  -4.656  -3.929
   24    H    CYS   5           H        CYS   5   0.710  -3.265  -1.543
   25    HA   CYS   5           HA       CYS   5  -0.335  -0.732  -2.475
   26    HB2  CYS   5          2HB       CYS   5  -2.136  -1.040  -0.817
   27    HB3  CYS   5          1HB       CYS   5  -1.933  -2.431  -1.874
   28    H    ARG   6           H        ARG   6   2.079  -1.535  -0.413
   29    HA   ARG   6           HA       ARG   6   1.687   0.779   1.339
   30    HB2  ARG   6          2HB       ARG   6   2.451  -1.441   2.231
   31    HB3  ARG   6          1HB       ARG   6   3.922  -1.258   1.295
   32    HG2  ARG   6          2HG       ARG   6   4.421   0.799   2.586
   33    HG3  ARG   6          1HG       ARG   6   3.010   0.456   3.596
   34    HD2  ARG   6          2HD       ARG   6   4.992  -0.390   4.688
   35    HD3  ARG   6          1HD       ARG   6   3.999  -1.742   4.141
   36    HE   ARG   6           HE       ARG   6   6.131  -0.834   2.383
   37   HH11  ARG   6          1HH1      ARG   6   5.023  -3.292   4.672
   38   HH12  ARG   6          2HH1      ARG   6   6.210  -4.426   4.251
   39   HH21  ARG   6          1HH2      ARG   6   7.727  -2.347   1.782
   40   HH22  ARG   6          2HH2      ARG   6   7.837  -3.867   2.537
   41    H    GLN   7           H        GLN   7   3.124  -0.132  -1.530
   42    HA   GLN   7           HA       GLN   7   5.596   1.164  -1.676
   43    HB2  GLN   7          2HB       GLN   7   4.720  -0.471  -3.302
   44    HB3  GLN   7          1HB       GLN   7   3.611   0.753  -3.900
   45    HG2  GLN   7          2HG       GLN   7   5.645   2.165  -4.385
   46    HG3  GLN   7          1HG       GLN   7   6.603   0.720  -4.085
   47   HE21  GLN   7          1HE2      GLN   7   4.350  -0.915  -5.228
   48   HE22  GLN   7          2HE2      GLN   7   4.519  -0.736  -6.934
   49    H    ASP   8           H        ASP   8   2.389   2.304  -2.676
   50    HA   ASP   8           HA       ASP   8   3.464   4.993  -2.947
   51    HB2  ASP   8          2HB       ASP   8   0.878   3.767  -3.932
   52    HB3  ASP   8          1HB       ASP   8   1.173   5.493  -3.932
   53    HA   PRO   9           HA       PRO   9   1.894   5.677   1.183
   54    HB2  PRO   9          2HB       PRO   9   2.433   8.471   0.264
   55    HB3  PRO   9          1HB       PRO   9   2.900   7.689   1.779
   56    HG2  PRO   9          2HG       PRO   9   4.697   8.083  -0.112
   57    HG3  PRO   9          1HG       PRO   9   4.677   6.556   0.791
   58    HD2  PRO   9          2HD       PRO   9   3.719   7.138  -1.978
   59    HD3  PRO   9          1HD       PRO   9   4.551   5.701  -1.342
   60    H    GLU  10           H        GLU  10   0.988   7.320  -1.740
   61    HA   GLU  10           HA       GLU  10  -1.325   8.652  -0.859
   62    HB2  GLU  10          2HB       GLU  10   0.021   9.022  -2.984
   63    HB3  GLU  10          1HB       GLU  10  -0.812   7.627  -3.643
   64    HG2  GLU  10          2HG       GLU  10  -1.844   9.682  -4.385
   65    HG3  GLU  10          1HG       GLU  10  -2.944   8.757  -3.357
   66    H    ALA  11           H        ALA  11  -0.784   5.414  -2.165
   67    HA   ALA  11           HA       ALA  11  -3.616   4.791  -2.106
   68    HB1  ALA  11          1HB       ALA  11  -2.249   3.970  -3.971
   69    HB2  ALA  11          2HB       ALA  11  -2.941   2.633  -3.050
   70    HB3  ALA  11          3HB       ALA  11  -1.245   3.068  -2.837
   71    H    ASN  12           H        ASN  12  -0.726   4.270  -0.292
   72    HA   ASN  12           HA       ASN  12  -1.530   2.151   1.359
   73    HB2  ASN  12          2HB       ASN  12   0.804   3.023   1.165
   74    HB3  ASN  12          1HB       ASN  12   0.309   4.429   2.097
   75   HD21  ASN  12          1HD2      ASN  12  -0.613   1.044   2.624
   76   HD22  ASN  12          2HD2      ASN  12   0.101   0.926   4.185
   77    H    LYS  13           H        LYS  13  -2.149   5.587   1.508
   78    HA   LYS  13           HA       LYS  13  -3.204   5.773   4.096
   79    HB2  LYS  13          2HB       LYS  13  -3.841   7.321   1.615
   80    HB3  LYS  13          1HB       LYS  13  -4.585   7.692   3.156
   81    HG2  LYS  13          2HG       LYS  13  -2.324   8.118   4.094
   82    HG3  LYS  13          1HG       LYS  13  -1.650   7.843   2.484
   83    HD2  LYS  13          2HD       LYS  13  -3.725   9.945   3.133
   84    HD3  LYS  13          1HD       LYS  13  -1.994  10.256   3.015
   85    HE2  LYS  13          2HE       LYS  13  -1.974   9.634   0.715
   86    HE3  LYS  13          1HE       LYS  13  -3.644   9.082   0.772
   87    HZ1  LYS  13          1HZ       LYS  13  -4.323  11.362   1.154
   88    HZ2  LYS  13          2HZ       LYS  13  -3.437  11.183  -0.273
   89    HZ3  LYS  13          3HZ       LYS  13  -2.714  11.891   1.079
   90    H    SER  14           H        SER  14  -4.550   4.345   1.262
   91    HA   SER  14           HA       SER  14  -7.143   4.254   2.561
   92    HB2  SER  14          2HB       SER  14  -7.948   3.425   0.293
   93    HB3  SER  14          1HB       SER  14  -7.354   5.083   0.330
   94    HG   SER  14           HG       SER  14  -5.389   3.242  -0.228
   95    HA   PRO  15           HA       PRO  15  -5.632   0.122   3.690
   96    HB2  PRO  15          2HB       PRO  15  -8.038   0.162   5.394
   97    HB3  PRO  15          1HB       PRO  15  -6.351  -0.102   5.850
   98    HG2  PRO  15          2HG       PRO  15  -7.617   2.155   6.485
   99    HG3  PRO  15          1HG       PRO  15  -5.909   2.164   6.006
  100    HD2  PRO  15          2HD       PRO  15  -8.335   2.847   4.395
  101    HD3  PRO  15          1HD       PRO  15  -6.772   3.693   4.494
  102    H    GLU  16           H        GLU  16  -8.805   1.172   2.773
  103    HA   GLU  16           HA       GLU  16 -10.024  -1.339   2.439
  104    HB2  GLU  16          2HB       GLU  16 -10.574   1.239   0.983
  105    HB3  GLU  16          1HB       GLU  16 -11.660  -0.143   1.086
  106    HG2  GLU  16          2HG       GLU  16 -11.908   0.143   3.439
  107    HG3  GLU  16          1HG       GLU  16 -10.690   1.413   3.463
  108    H    GLU  17           H        GLU  17  -8.080   0.643   0.281
  109    HA   GLU  17           HA       GLU  17  -8.419  -1.157  -1.946
  110    HB2  GLU  17          2HB       GLU  17  -7.951   1.350  -2.116
  111    HB3  GLU  17          1HB       GLU  17  -6.303   0.976  -1.631
  112    HG2  GLU  17          2HG       GLU  17  -6.266   1.131  -3.979
  113    HG3  GLU  17          1HG       GLU  17  -6.212  -0.591  -3.610
  114    H    CYS  18           H        CYS  18  -6.016  -0.433   0.508
  115    HA   CYS  18           HA       CYS  18  -4.000  -2.148  -0.494
  116    HB2  CYS  18          2HB       CYS  18  -3.584  -0.205   1.003
  117    HB3  CYS  18          1HB       CYS  18  -4.373  -1.061   2.308
  118    H    LYS  19           H        LYS  19  -6.816  -2.779   1.456
  119    HA   LYS  19           HA       LYS  19  -5.874  -5.467   2.056
  120    HB2  LYS  19          2HB       LYS  19  -8.517  -4.149   2.713
  121    HB3  LYS  19          1HB       LYS  19  -8.046  -5.762   3.216
  122    HG2  LYS  19          2HG       LYS  19  -6.748  -3.174   4.041
  123    HG3  LYS  19          1HG       LYS  19  -7.780  -4.190   5.042
  124    HD2  LYS  19          2HD       LYS  19  -6.086  -6.017   4.808
  125    HD3  LYS  19          1HD       LYS  19  -5.057  -4.883   3.935
  126    HE2  LYS  19          2HE       LYS  19  -4.355  -4.959   6.233
  127    HE3  LYS  19          1HE       LYS  19  -5.092  -3.395   5.890
  128    HZ1  LYS  19          1HZ       LYS  19  -6.407  -5.666   7.276
  129    HZ2  LYS  19          2HZ       LYS  19  -7.148  -4.197   6.941
  130    HZ3  LYS  19          3HZ       LYS  19  -5.852  -4.255   8.006
  131    H    LYS  20           H        LYS  20  -7.653  -3.833  -0.330
  132    HA   LYS  20           HA       LYS  20  -9.108  -6.099  -1.328
  133    HB2  LYS  20          2HB       LYS  20  -9.811  -3.771  -1.801
  134    HB3  LYS  20          1HB       LYS  20  -8.307  -3.493  -2.651
  135    HG2  LYS  20          2HG       LYS  20 -10.132  -3.813  -4.221
  136    HG3  LYS  20          1HG       LYS  20  -8.958  -5.115  -4.361
  137    HD2  LYS  20          2HD       LYS  20 -11.269  -5.938  -4.479
  138    HD3  LYS  20          1HD       LYS  20 -10.412  -6.595  -3.089
  139    HE2  LYS  20          2HE       LYS  20 -12.715  -5.934  -2.532
  140    HE3  LYS  20          1HE       LYS  20 -11.533  -5.008  -1.620
  141    HZ1  LYS  20          1HZ       LYS  20 -11.865  -3.160  -3.157
  142    HZ2  LYS  20          2HZ       LYS  20 -13.327  -3.612  -2.480
  143    HZ3  LYS  20          3HZ       LYS  20 -12.947  -4.062  -4.055
  144    H    LEU  21           H        LEU  21  -6.110  -4.457  -1.923
  145    HA   LEU  21           HA       LEU  21  -5.165  -6.296  -3.892
  146    HB2  LEU  21          2HB       LEU  21  -3.685  -4.286  -2.170
  147    HB3  LEU  21          1HB       LEU  21  -3.039  -5.084  -3.589
  148    HG   LEU  21           HG       LEU  21  -5.332  -3.114  -3.586
  149   HD11  LEU  21          1HD1      LEU  21  -3.328  -1.942  -3.123
  150   HD12  LEU  21          2HD1      LEU  21  -3.746  -1.660  -4.811
  151   HD13  LEU  21          3HD1      LEU  21  -2.461  -2.798  -4.396
  152   HD21  LEU  21          1HD2      LEU  21  -5.113  -3.166  -6.016
  153   HD22  LEU  21          2HD2      LEU  21  -5.551  -4.745  -5.363
  154   HD23  LEU  21          3HD2      LEU  21  -3.889  -4.426  -5.870
  155    H    LYS  22           H        LYS  22  -3.859  -8.064  -3.480
  156    HA   LYS  22           HA       LYS  22  -3.923  -8.945  -0.711
  157    HB2  LYS  22          2HB       LYS  22  -4.787 -10.446  -2.510
  158    HB3  LYS  22          1HB       LYS  22  -3.168 -10.521  -3.187
  159    HG2  LYS  22          2HG       LYS  22  -2.352 -11.563  -1.132
  160    HG3  LYS  22          1HG       LYS  22  -3.971 -11.478  -0.445
  161    HD2  LYS  22          2HD       LYS  22  -4.796 -12.966  -2.186
  162    HD3  LYS  22          1HD       LYS  22  -3.191 -13.025  -2.918
  163    HE2  LYS  22          2HE       LYS  22  -2.296 -13.979  -0.844
  164    HE3  LYS  22          1HE       LYS  22  -3.904 -13.938  -0.137
  165    HZ1  LYS  22          1HZ       LYS  22  -4.656 -15.465  -1.841
  166    HZ2  LYS  22          2HZ       LYS  22  -3.355 -16.135  -0.987
  167    HZ3  LYS  22          3HZ       LYS  22  -3.116 -15.503  -2.526
  Start of MODEL    8
    1    H    ASN   1           H        ASN   1  -1.926  -6.960  -2.784
    2    HA   ASN   1           HA       ASN   1   0.382  -8.323  -1.622
    3    HB2  ASN   1          2HB       ASN   1   0.176  -6.381  -3.946
    4    HB3  ASN   1          1HB       ASN   1   1.713  -6.874  -3.256
    5   HD21  ASN   1          1HD2      ASN   1   0.697  -7.260  -5.970
    6   HD22  ASN   1          2HD2      ASN   1   0.710  -8.959  -6.222
    7    HA   PRO   2           HA       PRO   2  -0.467  -4.964   1.338
    8    HB2  PRO   2          2HB       PRO   2   1.751  -6.303   2.774
    9    HB3  PRO   2          1HB       PRO   2   0.133  -5.882   3.347
   10    HG2  PRO   2          2HG       PRO   2   0.746  -8.410   2.822
   11    HG3  PRO   2          1HG       PRO   2  -0.839  -7.751   2.372
   12    HD2  PRO   2          2HD       PRO   2   1.555  -8.250   0.650
   13    HD3  PRO   2          1HD       PRO   2  -0.163  -8.580   0.328
   14    H    GLU   3           H        GLU   3   2.879  -6.011   0.749
   15    HA   GLU   3           HA       GLU   3   3.991  -3.514   1.518
   16    HB2  GLU   3          2HB       GLU   3   5.271  -5.551   1.742
   17    HB3  GLU   3          1HB       GLU   3   5.172  -5.853   0.017
   18    HG2  GLU   3          2HG       GLU   3   6.571  -3.940  -0.425
   19    HG3  GLU   3          1HG       GLU   3   6.595  -3.534   1.289
   20    H    ASP   4           H        ASP   4   2.932  -4.900  -1.447
   21    HA   ASP   4           HA       ASP   4   4.071  -2.930  -3.165
   22    HB2  ASP   4          2HB       ASP   4   3.379  -5.131  -4.015
   23    HB3  ASP   4          1HB       ASP   4   1.708  -4.742  -3.614
   24    H    CYS   5           H        CYS   5   0.956  -3.285  -1.557
   25    HA   CYS   5           HA       CYS   5  -0.178  -0.911  -2.604
   26    HB2  CYS   5          2HB       CYS   5  -1.556  -2.657  -1.524
   27    HB3  CYS   5          1HB       CYS   5  -0.773  -2.323   0.017
   28    H    ARG   6           H        ARG   6   1.772  -1.635   0.244
   29    HA   ARG   6           HA       ARG   6   1.670   0.939   1.390
   30    HB2  ARG   6          2HB       ARG   6   3.725  -1.236   1.732
   31    HB3  ARG   6          1HB       ARG   6   3.682   0.239   2.684
   32    HG2  ARG   6          2HG       ARG   6   1.458  -0.380   3.508
   33    HG3  ARG   6          1HG       ARG   6   1.549  -1.874   2.577
   34    HD2  ARG   6          2HD       ARG   6   3.556  -2.513   3.843
   35    HD3  ARG   6          1HD       ARG   6   3.400  -1.044   4.808
   36    HE   ARG   6           HE       ARG   6   1.115  -2.803   4.715
   37   HH11  ARG   6          1HH1      ARG   6   3.986  -1.850   6.549
   38   HH12  ARG   6          2HH1      ARG   6   3.428  -2.449   8.034
   39   HH21  ARG   6          1HH2      ARG   6   0.355  -3.681   6.746
   40   HH22  ARG   6          2HH2      ARG   6   1.301  -3.537   8.148
   41    H    GLN   7           H        GLN   7   3.316  -0.213  -1.328
   42    HA   GLN   7           HA       GLN   7   5.517   1.584  -1.178
   43    HB2  GLN   7          2HB       GLN   7   5.649  -0.566  -2.398
   44    HB3  GLN   7          1HB       GLN   7   4.471   0.031  -3.554
   45    HG2  GLN   7          2HG       GLN   7   6.019   1.769  -4.254
   46    HG3  GLN   7          1HG       GLN   7   7.192   1.208  -3.068
   47   HE21  GLN   7          1HE2      GLN   7   8.711   0.827  -4.714
   48   HE22  GLN   7          2HE2      GLN   7   8.553  -0.532  -5.770
   49    H    ASP   8           H        ASP   8   2.265   1.796  -2.233
   50    HA   ASP   8           HA       ASP   8   2.812   4.370  -3.492
   51    HB2  ASP   8          2HB       ASP   8   0.582   2.432  -3.790
   52    HB3  ASP   8          1HB       ASP   8   0.171   4.137  -3.898
   53    HA   PRO   9           HA       PRO   9   1.770   6.165   0.482
   54    HB2  PRO   9          2HB       PRO   9   1.738   8.545  -1.322
   55    HB3  PRO   9          1HB       PRO   9   2.515   8.343   0.253
   56    HG2  PRO   9          2HG       PRO   9   3.972   8.276  -1.947
   57    HG3  PRO   9          1HG       PRO   9   4.289   7.129  -0.631
   58    HD2  PRO   9          2HD       PRO   9   2.926   6.687  -3.245
   59    HD3  PRO   9          1HD       PRO   9   4.010   5.618  -2.334
   60    H    GLU  10           H        GLU  10   0.107   6.895  -2.572
   61    HA   GLU  10           HA       GLU  10  -2.196   7.999  -1.291
   62    HB2  GLU  10          2HB       GLU  10  -1.527   8.686  -3.545
   63    HB3  GLU  10          1HB       GLU  10  -1.775   7.051  -4.126
   64    HG2  GLU  10          2HG       GLU  10  -4.148   7.223  -3.707
   65    HG3  GLU  10          1HG       GLU  10  -3.933   8.834  -3.028
   66    H    ALA  11           H        ALA  11  -1.215   4.819  -2.236
   67    HA   ALA  11           HA       ALA  11  -3.892   3.733  -2.060
   68    HB1  ALA  11          1HB       ALA  11  -2.846   1.572  -2.504
   69    HB2  ALA  11          2HB       ALA  11  -1.250   2.294  -2.309
   70    HB3  ALA  11          3HB       ALA  11  -2.274   2.780  -3.659
   71    H    ASN  12           H        ASN  12  -0.867   3.544  -0.277
   72    HA   ASN  12           HA       ASN  12  -1.660   1.886   1.851
   73    HB2  ASN  12          2HB       ASN  12   0.681   2.538   1.162
   74    HB3  ASN  12          1HB       ASN  12   0.393   4.086   1.912
   75   HD21  ASN  12          1HD2      ASN  12   2.019   3.837   3.393
   76   HD22  ASN  12          2HD2      ASN  12   1.937   2.765   4.732
   77    H    LYS  13           H        LYS  13  -2.172   5.228   1.225
   78    HA   LYS  13           HA       LYS  13  -2.703   6.222   3.789
   79    HB2  LYS  13          2HB       LYS  13  -2.377   7.564   1.678
   80    HB3  LYS  13          1HB       LYS  13  -3.961   7.050   1.154
   81    HG2  LYS  13          2HG       LYS  13  -3.548   8.621   3.687
   82    HG3  LYS  13          1HG       LYS  13  -3.710   9.409   2.131
   83    HD2  LYS  13          2HD       LYS  13  -5.933   8.285   1.880
   84    HD3  LYS  13          1HD       LYS  13  -5.738   7.643   3.512
   85    HE2  LYS  13          2HE       LYS  13  -7.115   9.627   3.591
   86    HE3  LYS  13          1HE       LYS  13  -5.566   9.953   4.362
   87    HZ1  LYS  13          1HZ       LYS  13  -6.330  10.746   1.604
   88    HZ2  LYS  13          2HZ       LYS  13  -4.845  11.042   2.288
   89    HZ3  LYS  13          3HZ       LYS  13  -6.213  11.782   2.925
   90    H    SER  14           H        SER  14  -4.577   4.341   1.555
   91    HA   SER  14           HA       SER  14  -6.808   4.369   3.430
   92    HB2  SER  14          2HB       SER  14  -8.172   3.796   1.358
   93    HB3  SER  14          1HB       SER  14  -7.520   5.436   1.433
   94    HG   SER  14           HG       SER  14  -5.966   3.458   0.248
   95    HA   PRO  15           HA       PRO  15  -5.245   0.063   3.948
   96    HB2  PRO  15          2HB       PRO  15  -7.669   0.192   5.694
   97    HB3  PRO  15          1HB       PRO  15  -6.074  -0.504   6.020
   98    HG2  PRO  15          2HG       PRO  15  -6.703   1.832   7.070
   99    HG3  PRO  15          1HG       PRO  15  -5.092   1.558   6.379
  100    HD2  PRO  15          2HD       PRO  15  -7.393   3.088   5.254
  101    HD3  PRO  15          1HD       PRO  15  -5.657   3.428   5.167
  102    H    GLU  16           H        GLU  16  -8.463   1.186   3.185
  103    HA   GLU  16           HA       GLU  16  -9.796  -1.126   2.451
  104    HB2  GLU  16          2HB       GLU  16 -10.768   1.154   2.573
  105    HB3  GLU  16          1HB       GLU  16  -9.886   1.595   1.123
  106    HG2  GLU  16          2HG       GLU  16 -12.219   1.154   0.639
  107    HG3  GLU  16          1HG       GLU  16 -11.172  -0.026  -0.148
  108    H    GLU  17           H        GLU  17  -7.397   0.767   0.688
  109    HA   GLU  17           HA       GLU  17  -7.670  -0.706  -1.734
  110    HB2  GLU  17          2HB       GLU  17  -5.627   1.290  -0.803
  111    HB3  GLU  17          1HB       GLU  17  -5.576   0.518  -2.386
  112    HG2  GLU  17          2HG       GLU  17  -7.793   2.234  -1.311
  113    HG3  GLU  17          1HG       GLU  17  -6.617   2.681  -2.553
  114    H    CYS  18           H        CYS  18  -5.521  -0.776   1.007
  115    HA   CYS  18           HA       CYS  18  -3.828  -2.758  -0.140
  116    HB2  CYS  18          2HB       CYS  18  -4.108  -1.904   2.745
  117    HB3  CYS  18          1HB       CYS  18  -2.825  -2.925   2.103
  118    H    LYS  19           H        LYS  19  -6.848  -2.850   1.360
  119    HA   LYS  19           HA       LYS  19  -6.764  -5.653   1.993
  120    HB2  LYS  19          2HB       LYS  19  -8.302  -4.231   3.167
  121    HB3  LYS  19          1HB       LYS  19  -9.052  -3.710   1.664
  122    HG2  LYS  19          2HG       LYS  19  -9.769  -6.073   1.311
  123    HG3  LYS  19          1HG       LYS  19  -9.165  -6.437   2.929
  124    HD2  LYS  19          2HD       LYS  19 -10.705  -4.868   3.902
  125    HD3  LYS  19          1HD       LYS  19 -11.242  -4.347   2.306
  126    HE2  LYS  19          2HE       LYS  19 -12.029  -6.640   1.864
  127    HE3  LYS  19          1HE       LYS  19 -11.572  -7.085   3.508
  128    HZ1  LYS  19          1HZ       LYS  19 -13.923  -6.543   3.282
  129    HZ2  LYS  19          2HZ       LYS  19 -13.516  -4.975   2.805
  130    HZ3  LYS  19          3HZ       LYS  19 -13.133  -5.513   4.359
  131    H    LYS  20           H        LYS  20  -7.849  -3.634  -0.667
  132    HA   LYS  20           HA       LYS  20  -8.965  -5.762  -2.213
  133    HB2  LYS  20          2HB       LYS  20  -9.822  -3.551  -2.598
  134    HB3  LYS  20          1HB       LYS  20  -8.211  -2.920  -2.889
  135    HG2  LYS  20          2HG       LYS  20  -8.091  -3.944  -5.020
  136    HG3  LYS  20          1HG       LYS  20  -9.492  -4.960  -4.688
  137    HD2  LYS  20          2HD       LYS  20 -10.013  -3.084  -6.214
  138    HD3  LYS  20          1HD       LYS  20 -10.954  -3.037  -4.729
  139    HE2  LYS  20          2HE       LYS  20 -10.257  -0.813  -5.213
  140    HE3  LYS  20          1HE       LYS  20  -9.316  -1.370  -3.843
  141    HZ1  LYS  20          1HZ       LYS  20  -7.458  -1.821  -5.466
  142    HZ2  LYS  20          2HZ       LYS  20  -7.923  -0.223  -5.263
  143    HZ3  LYS  20          3HZ       LYS  20  -8.419  -1.036  -6.644
  144    H    LEU  21           H        LEU  21  -5.925  -3.996  -2.288
  145    HA   LEU  21           HA       LEU  21  -4.842  -5.728  -4.330
  146    HB2  LEU  21          2HB       LEU  21  -3.477  -3.696  -2.545
  147    HB3  LEU  21          1HB       LEU  21  -2.775  -4.459  -3.954
  148    HG   LEU  21           HG       LEU  21  -5.056  -2.481  -3.950
  149   HD11  LEU  21          1HD1      LEU  21  -2.196  -2.210  -4.850
  150   HD12  LEU  21          2HD1      LEU  21  -2.932  -1.448  -3.446
  151   HD13  LEU  21          3HD1      LEU  21  -3.460  -1.000  -5.069
  152   HD21  LEU  21          1HD2      LEU  21  -3.659  -3.827  -6.272
  153   HD22  LEU  21          2HD2      LEU  21  -4.834  -2.521  -6.402
  154   HD23  LEU  21          3HD2      LEU  21  -5.328  -4.087  -5.764
  155    H    LYS  22           H        LYS  22  -4.128  -7.695  -3.776
  156    HA   LYS  22           HA       LYS  22  -4.017  -8.291  -0.960
  157    HB2  LYS  22          2HB       LYS  22  -3.676 -10.190  -3.277
  158    HB3  LYS  22          1HB       LYS  22  -3.914 -10.635  -1.595
  159    HG2  LYS  22          2HG       LYS  22  -5.896  -9.312  -3.442
  160    HG3  LYS  22          1HG       LYS  22  -5.999 -10.918  -2.726
  161    HD2  LYS  22          2HD       LYS  22  -6.083  -8.304  -1.199
  162    HD3  LYS  22          1HD       LYS  22  -7.482  -9.272  -1.616
  163    HE2  LYS  22          2HE       LYS  22  -6.702 -11.082  -0.220
  164    HE3  LYS  22          1HE       LYS  22  -5.198 -10.223   0.111
  165    HZ1  LYS  22          1HZ       LYS  22  -6.410  -8.530   1.249
  166    HZ2  LYS  22          2HZ       LYS  22  -6.875  -9.997   1.925
  167    HZ3  LYS  22          3HZ       LYS  22  -7.880  -9.201   0.840
  Start of MODEL    9
    1    H    ASN   1           H        ASN   1  -1.976  -6.978  -2.077
    2    HA   ASN   1           HA       ASN   1   0.535  -8.332  -1.634
    3    HB2  ASN   1          2HB       ASN   1  -0.236  -6.084  -3.524
    4    HB3  ASN   1          1HB       ASN   1   1.358  -6.819  -3.489
    5   HD21  ASN   1          1HD2      ASN   1   1.245  -7.512  -5.612
    6   HD22  ASN   1          2HD2      ASN   1   0.195  -8.781  -6.113
    7    HA   PRO   2           HA       PRO   2   1.061  -5.251   1.650
    8    HB2  PRO   2          2HB       PRO   2   3.485  -6.188   2.548
    9    HB3  PRO   2          1HB       PRO   2   1.919  -6.840   3.043
   10    HG2  PRO   2          2HG       PRO   2   3.832  -7.857   0.986
   11    HG3  PRO   2          1HG       PRO   2   2.882  -8.764   2.175
   12    HD2  PRO   2          2HD       PRO   2   2.156  -8.615  -0.398
   13    HD3  PRO   2          1HD       PRO   2   0.953  -8.648   0.906
   14    H    GLU   3           H        GLU   3   3.742  -6.109  -0.530
   15    HA   GLU   3           HA       GLU   3   5.146  -3.686   0.039
   16    HB2  GLU   3          2HB       GLU   3   5.573  -5.672  -2.190
   17    HB3  GLU   3          1HB       GLU   3   6.646  -4.341  -1.797
   18    HG2  GLU   3          2HG       GLU   3   6.931  -5.336   0.464
   19    HG3  GLU   3          1HG       GLU   3   6.021  -6.735  -0.107
   20    H    ASP   4           H        ASP   4   2.760  -4.665  -2.194
   21    HA   ASP   4           HA       ASP   4   3.210  -2.434  -3.975
   22    HB2  ASP   4          2HB       ASP   4   2.266  -4.529  -4.865
   23    HB3  ASP   4          1HB       ASP   4   0.865  -4.335  -3.820
   24    H    CYS   5           H        CYS   5   0.931  -3.307  -1.458
   25    HA   CYS   5           HA       CYS   5  -0.710  -1.053  -1.513
   26    HB2  CYS   5          2HB       CYS   5  -1.380  -2.942  -0.215
   27    HB3  CYS   5          1HB       CYS   5   0.100  -2.905   0.733
   28    H    ARG   6           H        ARG   6   2.228  -1.668   0.382
   29    HA   ARG   6           HA       ARG   6   2.108   0.979   1.449
   30    HB2  ARG   6          2HB       ARG   6   3.965  -1.327   1.951
   31    HB3  ARG   6          1HB       ARG   6   4.194   0.257   2.688
   32    HG2  ARG   6          2HG       ARG   6   1.995   0.121   3.726
   33    HG3  ARG   6          1HG       ARG   6   1.713  -1.436   2.954
   34    HD2  ARG   6          2HD       ARG   6   4.006  -0.935   4.835
   35    HD3  ARG   6          1HD       ARG   6   2.421  -1.462   5.382
   36    HE   ARG   6           HE       ARG   6   2.688  -3.466   4.173
   37   HH11  ARG   6          1HH1      ARG   6   5.649  -1.544   4.303
   38   HH12  ARG   6          2HH1      ARG   6   6.709  -2.872   4.247
   39   HH21  ARG   6          1HH2      ARG   6   4.182  -5.331   4.147
   40   HH22  ARG   6          2HH2      ARG   6   5.860  -5.051   4.146
   41    H    GLN   7           H        GLN   7   3.128  -0.029  -1.437
   42    HA   GLN   7           HA       GLN   7   5.542   1.566  -1.607
   43    HB2  GLN   7          2HB       GLN   7   5.288  -0.445  -3.006
   44    HB3  GLN   7          1HB       GLN   7   3.900   0.284  -3.792
   45    HG2  GLN   7          2HG       GLN   7   5.299   2.043  -4.701
   46    HG3  GLN   7          1HG       GLN   7   6.705   1.373  -3.877
   47   HE21  GLN   7          1HE2      GLN   7   6.199   1.815  -6.725
   48   HE22  GLN   7          2HE2      GLN   7   6.427   0.273  -7.456
   49    H    ASP   8           H        ASP   8   2.175   1.784  -2.547
   50    HA   ASP   8           HA       ASP   8   2.567   4.375  -3.741
   51    HB2  ASP   8          2HB       ASP   8   0.210   2.577  -3.374
   52    HB3  ASP   8          1HB       ASP   8  -0.054   4.271  -3.758
   53    HA   PRO   9           HA       PRO   9   2.249   6.374   0.244
   54    HB2  PRO   9          2HB       PRO   9   1.754   8.723  -1.516
   55    HB3  PRO   9          1HB       PRO   9   2.913   8.540  -0.199
   56    HG2  PRO   9          2HG       PRO   9   3.741   8.491  -2.719
   57    HG3  PRO   9          1HG       PRO   9   4.442   7.400  -1.512
   58    HD2  PRO   9          2HD       PRO   9   2.452   6.813  -3.663
   59    HD3  PRO   9          1HD       PRO   9   3.801   5.827  -3.053
   60    H    GLU  10           H        GLU  10   0.041   7.072  -2.450
   61    HA   GLU  10           HA       GLU  10  -2.013   8.127  -0.802
   62    HB2  GLU  10          2HB       GLU  10  -1.708   8.549  -3.268
   63    HB3  GLU  10          1HB       GLU  10  -2.342   6.937  -3.553
   64    HG2  GLU  10          2HG       GLU  10  -4.098   8.535  -3.874
   65    HG3  GLU  10          1HG       GLU  10  -4.435   7.605  -2.414
   66    H    ALA  11           H        ALA  11  -1.241   4.894  -1.955
   67    HA   ALA  11           HA       ALA  11  -3.785   3.810  -1.116
   68    HB1  ALA  11          1HB       ALA  11  -2.622   2.910  -3.105
   69    HB2  ALA  11          2HB       ALA  11  -2.966   1.677  -1.894
   70    HB3  ALA  11          3HB       ALA  11  -1.335   2.324  -2.049
   71    H    ASN  12           H        ASN  12  -0.567   4.099   0.147
   72    HA   ASN  12           HA       ASN  12  -0.864   2.182   2.216
   73    HB2  ASN  12          2HB       ASN  12   1.340   3.142   1.390
   74    HB3  ASN  12          1HB       ASN  12   0.949   4.611   2.274
   75   HD21  ASN  12          1HD2      ASN  12   2.743   4.390   3.655
   76   HD22  ASN  12          2HD2      ASN  12   2.815   3.177   4.862
   77    H    LYS  13           H        LYS  13  -2.034   5.315   1.756
   78    HA   LYS  13           HA       LYS  13  -2.587   5.942   4.505
   79    HB2  LYS  13          2HB       LYS  13  -3.627   7.070   1.915
   80    HB3  LYS  13          1HB       LYS  13  -4.062   7.690   3.499
   81    HG2  LYS  13          2HG       LYS  13  -1.875   8.485   3.889
   82    HG3  LYS  13          1HG       LYS  13  -1.220   7.554   2.539
   83    HD2  LYS  13          2HD       LYS  13  -1.428   9.927   1.966
   84    HD3  LYS  13          1HD       LYS  13  -2.470   8.927   0.961
   85    HE2  LYS  13          2HE       LYS  13  -4.360   9.506   2.499
   86    HE3  LYS  13          1HE       LYS  13  -3.277  10.648   3.298
   87    HZ1  LYS  13          1HZ       LYS  13  -3.039  11.838   1.201
   88    HZ2  LYS  13          2HZ       LYS  13  -4.693  11.672   1.565
   89    HZ3  LYS  13          3HZ       LYS  13  -3.979  10.675   0.426
   90    H    SER  14           H        SER  14  -4.445   4.715   1.717
   91    HA   SER  14           HA       SER  14  -6.744   4.380   3.435
   92    HB2  SER  14          2HB       SER  14  -7.848   4.092   1.159
   93    HB3  SER  14          1HB       SER  14  -7.230   5.694   1.578
   94    HG   SER  14           HG       SER  14  -6.448   3.944  -0.362
   95    HA   PRO  15           HA       PRO  15  -5.749  -0.068   3.370
   96    HB2  PRO  15          2HB       PRO  15  -8.223  -0.152   5.003
   97    HB3  PRO  15          1HB       PRO  15  -6.619  -0.794   5.374
   98    HG2  PRO  15          2HG       PRO  15  -7.528   1.377   6.620
   99    HG3  PRO  15          1HG       PRO  15  -5.829   1.256   6.127
  100    HD2  PRO  15          2HD       PRO  15  -8.076   2.743   4.801
  101    HD3  PRO  15          1HD       PRO  15  -6.398   3.254   5.107
  102    H    GLU  16           H        GLU  16  -8.389   1.689   2.270
  103    HA   GLU  16           HA       GLU  16 -10.374  -0.062   1.473
  104    HB2  GLU  16          2HB       GLU  16 -10.397   2.411   1.272
  105    HB3  GLU  16          1HB       GLU  16  -9.286   2.284  -0.077
  106    HG2  GLU  16          2HG       GLU  16 -11.545   2.640  -0.852
  107    HG3  GLU  16          1HG       GLU  16 -10.959   1.053  -1.349
  108    H    GLU  17           H        GLU  17  -7.668   1.069  -0.542
  109    HA   GLU  17           HA       GLU  17  -8.009  -0.737  -2.640
  110    HB2  GLU  17          2HB       GLU  17  -5.621   0.841  -1.694
  111    HB3  GLU  17          1HB       GLU  17  -5.558  -0.184  -3.111
  112    HG2  GLU  17          2HG       GLU  17  -5.881   2.175  -3.675
  113    HG3  GLU  17          1HG       GLU  17  -7.221   1.178  -4.216
  114    H    CYS  18           H        CYS  18  -6.178  -0.921   0.322
  115    HA   CYS  18           HA       CYS  18  -4.719  -3.237  -0.482
  116    HB2  CYS  18          2HB       CYS  18  -4.908  -1.938   2.211
  117    HB3  CYS  18          1HB       CYS  18  -3.687  -3.101   1.682
  118    H    LYS  19           H        LYS  19  -7.813  -2.853   0.915
  119    HA   LYS  19           HA       LYS  19  -7.842  -5.472   2.075
  120    HB2  LYS  19          2HB       LYS  19 -10.117  -3.679   1.199
  121    HB3  LYS  19          1HB       LYS  19 -10.363  -5.228   1.991
  122    HG2  LYS  19          2HG       LYS  19  -9.075  -4.370   3.944
  123    HG3  LYS  19          1HG       LYS  19  -9.005  -2.799   3.149
  124    HD2  LYS  19          2HD       LYS  19 -11.544  -4.252   3.904
  125    HD3  LYS  19          1HD       LYS  19 -10.808  -2.956   4.839
  126    HE2  LYS  19          2HE       LYS  19 -11.136  -1.410   2.994
  127    HE3  LYS  19          1HE       LYS  19 -11.803  -2.704   1.998
  128    HZ1  LYS  19          1HZ       LYS  19 -12.977  -1.693   4.530
  129    HZ2  LYS  19          2HZ       LYS  19 -13.613  -2.926   3.571
  130    HZ3  LYS  19          3HZ       LYS  19 -13.539  -1.355   2.981
  131    H    LYS  20           H        LYS  20  -8.262  -4.133  -1.028
  132    HA   LYS  20           HA       LYS  20  -9.249  -6.588  -2.220
  133    HB2  LYS  20          2HB       LYS  20  -9.999  -4.371  -3.050
  134    HB3  LYS  20          1HB       LYS  20  -8.340  -3.981  -3.470
  135    HG2  LYS  20          2HG       LYS  20  -8.337  -5.837  -5.086
  136    HG3  LYS  20          1HG       LYS  20 -10.027  -6.158  -4.683
  137    HD2  LYS  20          2HD       LYS  20 -10.593  -3.861  -5.388
  138    HD3  LYS  20          1HD       LYS  20  -8.911  -3.617  -5.857
  139    HE2  LYS  20          2HE       LYS  20 -10.787  -5.678  -7.013
  140    HE3  LYS  20          1HE       LYS  20 -10.343  -4.156  -7.776
  141    HZ1  LYS  20          1HZ       LYS  20  -8.006  -4.970  -7.795
  142    HZ2  LYS  20          2HZ       LYS  20  -9.072  -5.873  -8.709
  143    HZ3  LYS  20          3HZ       LYS  20  -8.553  -6.481  -7.240
  144    H    LEU  21           H        LEU  21  -6.385  -4.514  -2.305
  145    HA   LEU  21           HA       LEU  21  -4.825  -6.556  -3.651
  146    HB2  LEU  21          2HB       LEU  21  -4.058  -3.798  -2.697
  147    HB3  LEU  21          1HB       LEU  21  -3.062  -4.855  -3.672
  148    HG   LEU  21           HG       LEU  21  -5.678  -3.630  -4.549
  149   HD11  LEU  21          1HD1      LEU  21  -4.275  -2.251  -6.006
  150   HD12  LEU  21          2HD1      LEU  21  -2.835  -2.949  -5.261
  151   HD13  LEU  21          3HD1      LEU  21  -3.936  -1.965  -4.298
  152   HD21  LEU  21          1HD2      LEU  21  -5.251  -5.772  -5.634
  153   HD22  LEU  21          2HD2      LEU  21  -3.629  -5.239  -6.074
  154   HD23  LEU  21          3HD2      LEU  21  -5.039  -4.443  -6.773
  155    H    LYS  22           H        LYS  22  -4.257  -8.144  -2.305
  156    HA   LYS  22           HA       LYS  22  -3.573  -7.605   0.457
  157    HB2  LYS  22          2HB       LYS  22  -3.771 -10.150  -1.148
  158    HB3  LYS  22          1HB       LYS  22  -3.252 -10.107   0.525
  159    HG2  LYS  22          2HG       LYS  22  -5.912  -9.055  -0.412
  160    HG3  LYS  22          1HG       LYS  22  -5.662 -10.710   0.139
  161    HD2  LYS  22          2HD       LYS  22  -5.118  -8.231   1.793
  162    HD3  LYS  22          1HD       LYS  22  -6.573  -9.219   1.898
  163    HE2  LYS  22          2HE       LYS  22  -5.160 -11.170   2.511
  164    HE3  LYS  22          1HE       LYS  22  -3.747 -10.124   2.487
  165    HZ1  LYS  22          1HZ       LYS  22  -6.083  -9.735   4.281
  166    HZ2  LYS  22          2HZ       LYS  22  -4.645  -8.867   4.326
  167    HZ3  LYS  22          3HZ       LYS  22  -4.665 -10.494   4.718
  Start of MODEL   10
    1    H    ASN   1           H        ASN   1  -1.859  -7.503  -3.264
    2    HA   ASN   1           HA       ASN   1   0.199  -8.503  -1.424
    3    HB2  ASN   1          2HB       ASN   1   0.544  -6.740  -3.855
    4    HB3  ASN   1          1HB       ASN   1   1.843  -7.358  -2.835
    5   HD21  ASN   1          1HD2      ASN   1   2.376  -9.553  -2.995
    6   HD22  ASN   1          2HD2      ASN   1   1.863 -10.507  -4.339
    7    HA   PRO   2           HA       PRO   2  -1.349  -4.677   0.554
    8    HB2  PRO   2          2HB       PRO   2  -0.422  -5.291   3.067
    9    HB3  PRO   2          1HB       PRO   2  -1.982  -5.832   2.442
   10    HG2  PRO   2          2HG       PRO   2   0.594  -7.313   2.669
   11    HG3  PRO   2          1HG       PRO   2  -1.061  -7.895   2.904
   12    HD2  PRO   2          2HD       PRO   2   0.407  -8.368   0.660
   13    HD3  PRO   2          1HD       PRO   2  -1.364  -8.285   0.655
   14    H    GLU   3           H        GLU   3   1.759  -6.154   1.176
   15    HA   GLU   3           HA       GLU   3   3.068  -3.767   1.916
   16    HB2  GLU   3          2HB       GLU   3   5.161  -5.125   1.568
   17    HB3  GLU   3          1HB       GLU   3   3.996  -5.774   2.712
   18    HG2  GLU   3          2HG       GLU   3   3.214  -7.368   1.077
   19    HG3  GLU   3          1HG       GLU   3   4.281  -6.673  -0.141
   20    H    ASP   4           H        ASP   4   2.482  -5.264  -1.172
   21    HA   ASP   4           HA       ASP   4   4.303  -3.552  -2.579
   22    HB2  ASP   4          2HB       ASP   4   2.082  -5.355  -3.522
   23    HB3  ASP   4          1HB       ASP   4   2.917  -4.280  -4.633
   24    H    CYS   5           H        CYS   5   0.900  -3.516  -1.796
   25    HA   CYS   5           HA       CYS   5   0.148  -1.202  -3.167
   26    HB2  CYS   5          2HB       CYS   5  -1.491  -2.619  -2.056
   27    HB3  CYS   5          1HB       CYS   5  -0.778  -2.255  -0.498
   28    H    ARG   6           H        ARG   6   1.825  -1.632  -0.123
   29    HA   ARG   6           HA       ARG   6   1.685   1.069   0.723
   30    HB2  ARG   6          2HB       ARG   6   3.606  -1.096   1.539
   31    HB3  ARG   6          1HB       ARG   6   3.470   0.469   2.327
   32    HG2  ARG   6          2HG       ARG   6   1.156  -0.041   2.928
   33    HG3  ARG   6          1HG       ARG   6   1.308  -1.616   2.145
   34    HD2  ARG   6          2HD       ARG   6   3.161  -2.159   3.680
   35    HD3  ARG   6          1HD       ARG   6   2.909  -0.612   4.488
   36    HE   ARG   6           HE       ARG   6   0.497  -2.017   4.426
   37   HH11  ARG   6          1HH1      ARG   6   3.666  -2.129   6.024
   38   HH12  ARG   6          2HH1      ARG   6   3.128  -2.972   7.378
   39   HH21  ARG   6          1HH2      ARG   6  -0.276  -3.144   6.359
   40   HH22  ARG   6          2HH2      ARG   6   0.820  -3.519   7.597
   41    H    GLN   7           H        GLN   7   3.424  -0.240  -1.802
   42    HA   GLN   7           HA       GLN   7   5.652   1.576  -1.600
   43    HB2  GLN   7          2HB       GLN   7   5.910  -0.641  -2.692
   44    HB3  GLN   7          1HB       GLN   7   4.738  -0.172  -3.911
   45    HG2  GLN   7          2HG       GLN   7   6.255   1.557  -4.720
   46    HG3  GLN   7          1HG       GLN   7   7.408   1.142  -3.457
   47   HE21  GLN   7          1HE2      GLN   7   8.975   0.697  -5.001
   48   HE22  GLN   7          2HE2      GLN   7   8.942  -0.738  -5.954
   49    H    ASP   8           H        ASP   8   2.439   1.646  -2.617
   50    HA   ASP   8           HA       ASP   8   2.773   4.033  -4.240
   51    HB2  ASP   8          2HB       ASP   8   0.497   2.153  -3.718
   52    HB3  ASP   8          1HB       ASP   8   0.112   3.824  -4.094
   53    HA   PRO   9           HA       PRO   9   2.129   6.533  -0.652
   54    HB2  PRO   9          2HB       PRO   9   1.313   8.815  -1.853
   55    HB3  PRO   9          1HB       PRO   9   2.993   8.265  -1.899
   56    HG2  PRO   9          2HG       PRO   9   0.846   7.945  -3.967
   57    HG3  PRO   9          1HG       PRO   9   2.532   8.451  -4.183
   58    HD2  PRO   9          2HD       PRO   9   1.742   5.946  -4.698
   59    HD3  PRO   9          1HD       PRO   9   3.334   6.306  -3.999
   60    H    GLU  10           H        GLU  10  -0.306   5.516  -2.729
   61    HA   GLU  10           HA       GLU  10  -2.445   6.972  -1.538
   62    HB2  GLU  10          2HB       GLU  10  -2.407   6.104  -3.907
   63    HB3  GLU  10          1HB       GLU  10  -2.629   4.487  -3.258
   64    HG2  GLU  10          2HG       GLU  10  -4.693   5.589  -4.111
   65    HG3  GLU  10          1HG       GLU  10  -4.788   5.034  -2.439
   66    H    ALA  11           H        ALA  11  -0.590   4.318  -0.617
   67    HA   ALA  11           HA       ALA  11  -2.488   2.817   0.880
   68    HB1  ALA  11          1HB       ALA  11  -0.343   1.892   0.163
   69    HB2  ALA  11          2HB       ALA  11  -0.512   1.803   1.918
   70    HB3  ALA  11          3HB       ALA  11   0.505   3.046   1.189
   71    H    ASN  12           H        ASN  12  -0.883   5.757   1.346
   72    HA   ASN  12           HA       ASN  12  -0.785   5.961   4.159
   73    HB2  ASN  12          2HB       ASN  12   0.530   7.442   2.754
   74    HB3  ASN  12          1HB       ASN  12  -0.926   8.095   2.023
   75   HD21  ASN  12          1HD2      ASN  12   1.080   8.049   4.841
   76   HD22  ASN  12          2HD2      ASN  12   0.408   9.451   5.584
   77    H    LYS  13           H        LYS  13  -3.357   6.434   1.878
   78    HA   LYS  13           HA       LYS  13  -4.885   7.870   3.870
   79    HB2  LYS  13          2HB       LYS  13  -5.341   7.475   0.932
   80    HB3  LYS  13          1HB       LYS  13  -6.656   7.985   1.972
   81    HG2  LYS  13          2HG       LYS  13  -5.686   9.934   0.958
   82    HG3  LYS  13          1HG       LYS  13  -5.313   9.945   2.670
   83    HD2  LYS  13          2HD       LYS  13  -3.363  10.669   1.449
   84    HD3  LYS  13          1HD       LYS  13  -3.038   9.072   2.122
   85    HE2  LYS  13          2HE       LYS  13  -2.215   9.227  -0.164
   86    HE3  LYS  13          1HE       LYS  13  -3.531   8.066  -0.054
   87    HZ1  LYS  13          1HZ       LYS  13  -3.727  10.845  -1.095
   88    HZ2  LYS  13          2HZ       LYS  13  -5.032   9.782  -0.886
   89    HZ3  LYS  13          3HZ       LYS  13  -3.841   9.400  -1.986
   90    H    SER  14           H        SER  14  -6.170   5.425   1.638
   91    HA   SER  14           HA       SER  14  -7.321   4.242   4.039
   92    HB2  SER  14          2HB       SER  14  -9.170   3.419   2.536
   93    HB3  SER  14          1HB       SER  14  -9.100   5.171   2.731
   94    HG   SER  14           HG       SER  14  -7.644   4.115   0.631
   95    HA   PRO  15           HA       PRO  15  -4.691   0.809   2.936
   96    HB2  PRO  15          2HB       PRO  15  -5.422  -0.800   5.019
   97    HB3  PRO  15          1HB       PRO  15  -4.271   0.531   5.172
   98    HG2  PRO  15          2HG       PRO  15  -7.174   0.447   5.880
   99    HG3  PRO  15          1HG       PRO  15  -5.828   1.194   6.758
  100    HD2  PRO  15          2HD       PRO  15  -7.567   2.585   5.236
  101    HD3  PRO  15          1HD       PRO  15  -5.877   3.081   5.459
  102    H    GLU  16           H        GLU  16  -8.048   0.912   2.895
  103    HA   GLU  16           HA       GLU  16  -8.791  -1.710   2.360
  104    HB2  GLU  16          2HB       GLU  16  -9.956   0.844   1.248
  105    HB3  GLU  16          1HB       GLU  16 -10.654  -0.733   0.932
  106    HG2  GLU  16          2HG       GLU  16 -11.901   0.301   2.673
  107    HG3  GLU  16          1HG       GLU  16 -10.970  -1.004   3.390
  108    H    GLU  17           H        GLU  17  -7.261   0.638   0.294
  109    HA   GLU  17           HA       GLU  17  -7.487  -0.736  -2.158
  110    HB2  GLU  17          2HB       GLU  17  -5.236   1.037  -1.183
  111    HB3  GLU  17          1HB       GLU  17  -5.521   0.577  -2.851
  112    HG2  GLU  17          2HG       GLU  17  -7.289   2.288  -1.122
  113    HG3  GLU  17          1HG       GLU  17  -6.296   2.815  -2.481
  114    H    CYS  18           H        CYS  18  -5.246  -0.923   0.497
  115    HA   CYS  18           HA       CYS  18  -3.405  -2.640  -0.812
  116    HB2  CYS  18          2HB       CYS  18  -3.635  -1.882   2.092
  117    HB3  CYS  18          1HB       CYS  18  -2.245  -2.649   1.322
  118    H    LYS  19           H        LYS  19  -6.198  -3.062   1.215
  119    HA   LYS  19           HA       LYS  19  -5.534  -5.866   1.433
  120    HB2  LYS  19          2HB       LYS  19  -7.972  -4.441   2.486
  121    HB3  LYS  19          1HB       LYS  19  -7.575  -6.123   2.796
  122    HG2  LYS  19          2HG       LYS  19  -6.143  -3.661   3.794
  123    HG3  LYS  19          1HG       LYS  19  -6.955  -4.904   4.740
  124    HD2  LYS  19          2HD       LYS  19  -4.380  -5.225   3.166
  125    HD3  LYS  19          1HD       LYS  19  -4.533  -5.140   4.914
  126    HE2  LYS  19          2HE       LYS  19  -5.696  -7.310   3.168
  127    HE3  LYS  19          1HE       LYS  19  -4.188  -7.440   4.060
  128    HZ1  LYS  19          1HZ       LYS  19  -5.418  -7.213   6.118
  129    HZ2  LYS  19          2HZ       LYS  19  -6.038  -8.491   5.208
  130    HZ3  LYS  19          3HZ       LYS  19  -6.870  -7.037   5.275
  131    H    LYS  20           H        LYS  20  -7.347  -3.834  -0.606
  132    HA   LYS  20           HA       LYS  20  -8.966  -5.870  -1.753
  133    HB2  LYS  20          2HB       LYS  20  -9.566  -3.518  -2.067
  134    HB3  LYS  20          1HB       LYS  20  -8.033  -3.203  -2.860
  135    HG2  LYS  20          2HG       LYS  20  -9.880  -3.334  -4.465
  136    HG3  LYS  20          1HG       LYS  20  -8.682  -4.597  -4.735
  137    HD2  LYS  20          2HD       LYS  20 -10.110  -6.210  -3.578
  138    HD3  LYS  20          1HD       LYS  20 -11.305  -4.948  -3.279
  139    HE2  LYS  20          2HE       LYS  20 -11.954  -6.324  -5.184
  140    HE3  LYS  20          1HE       LYS  20 -11.613  -4.674  -5.683
  141    HZ1  LYS  20          1HZ       LYS  20  -9.529  -5.345  -6.569
  142    HZ2  LYS  20          2HZ       LYS  20 -10.683  -6.416  -7.162
  143    HZ3  LYS  20          3HZ       LYS  20  -9.657  -6.898  -5.938
  144    H    LEU  21           H        LEU  21  -5.829  -4.470  -2.452
  145    HA   LEU  21           HA       LEU  21  -5.235  -6.275  -4.577
  146    HB2  LEU  21          2HB       LEU  21  -3.467  -4.608  -2.775
  147    HB3  LEU  21          1HB       LEU  21  -2.861  -5.537  -4.126
  148    HG   LEU  21           HG       LEU  21  -4.801  -3.226  -4.336
  149   HD11  LEU  21          1HD1      LEU  21  -2.907  -2.052  -5.374
  150   HD12  LEU  21          2HD1      LEU  21  -1.850  -3.400  -4.938
  151   HD13  LEU  21          3HD1      LEU  21  -2.631  -2.437  -3.682
  152   HD21  LEU  21          1HD2      LEU  21  -3.397  -4.853  -6.449
  153   HD22  LEU  21          2HD2      LEU  21  -4.330  -3.390  -6.741
  154   HD23  LEU  21          3HD2      LEU  21  -5.130  -4.831  -6.118
  155    H    LYS  22           H        LYS  22  -3.705  -8.062  -4.382
  156    HA   LYS  22           HA       LYS  22  -4.170  -9.472  -1.904
  157    HB2  LYS  22          2HB       LYS  22  -4.384 -10.629  -4.105
  158    HB3  LYS  22          1HB       LYS  22  -2.666 -10.382  -4.369
  159    HG2  LYS  22          2HG       LYS  22  -3.140 -12.659  -3.633
  160    HG3  LYS  22          1HG       LYS  22  -2.148 -11.801  -2.459
  161    HD2  LYS  22          2HD       LYS  22  -3.873 -13.088  -1.321
  162    HD3  LYS  22          1HD       LYS  22  -4.153 -11.370  -1.087
  163    HE2  LYS  22          2HE       LYS  22  -5.842 -11.442  -2.915
  164    HE3  LYS  22          1HE       LYS  22  -5.583 -13.184  -3.038
  165    HZ1  LYS  22          1HZ       LYS  22  -6.297 -13.367  -0.717
  166    HZ2  LYS  22          2HZ       LYS  22  -7.497 -12.708  -1.686
  167    HZ3  LYS  22          3HZ       LYS  22  -6.601 -11.709  -0.685
  Start of MODEL   11
    1    H    ASN   1           H        ASN   1  -1.224  -7.496  -2.850
    2    HA   ASN   1           HA       ASN   1   0.070  -8.486  -0.425
    3    HB2  ASN   1          2HB       ASN   1   1.347  -7.466  -2.953
    4    HB3  ASN   1          1HB       ASN   1   2.230  -7.651  -1.445
    5   HD21  ASN   1          1HD2      ASN   1   2.549  -9.720  -0.625
    6   HD22  ASN   1          2HD2      ASN   1   2.439 -11.125  -1.620
    7    HA   PRO   2           HA       PRO   2  -0.967  -4.316   1.010
    8    HB2  PRO   2          2HB       PRO   2   0.441  -5.513   3.349
    9    HB3  PRO   2          1HB       PRO   2  -1.058  -4.582   3.301
   10    HG2  PRO   2          2HG       PRO   2  -1.129  -7.210   3.619
   11    HG3  PRO   2          1HG       PRO   2  -2.315  -6.402   2.573
   12    HD2  PRO   2          2HD       PRO   2   0.096  -8.002   1.843
   13    HD3  PRO   2          1HD       PRO   2  -1.489  -7.930   1.053
   14    H    GLU   3           H        GLU   3   2.128  -6.045   1.198
   15    HA   GLU   3           HA       GLU   3   3.664  -3.707   1.735
   16    HB2  GLU   3          2HB       GLU   3   4.477  -5.971   2.277
   17    HB3  GLU   3          1HB       GLU   3   4.550  -6.355   0.566
   18    HG2  GLU   3          2HG       GLU   3   6.302  -4.740   0.242
   19    HG3  GLU   3          1HG       GLU   3   6.153  -4.198   1.911
   20    H    ASP   4           H        ASP   4   2.584  -5.285  -1.183
   21    HA   ASP   4           HA       ASP   4   4.152  -3.616  -2.961
   22    HB2  ASP   4          2HB       ASP   4   3.268  -5.933  -3.556
   23    HB3  ASP   4          1HB       ASP   4   1.668  -5.213  -3.643
   24    H    CYS   5           H        CYS   5   1.070  -3.615  -1.467
   25    HA   CYS   5           HA       CYS   5  -0.171  -1.471  -2.823
   26    HB2  CYS   5          2HB       CYS   5  -1.363  -3.071  -1.337
   27    HB3  CYS   5          1HB       CYS   5  -0.508  -2.401   0.043
   28    H    ARG   6           H        ARG   6   2.094  -1.678  -0.160
   29    HA   ARG   6           HA       ARG   6   1.901   0.984   0.769
   30    HB2  ARG   6          2HB       ARG   6   2.712  -1.077   2.007
   31    HB3  ARG   6          1HB       ARG   6   4.213  -0.923   1.117
   32    HG2  ARG   6          2HG       ARG   6   4.375  -0.009   3.377
   33    HG3  ARG   6          1HG       ARG   6   4.629   1.238   2.151
   34    HD2  ARG   6          2HD       ARG   6   3.157   1.928   4.057
   35    HD3  ARG   6          1HD       ARG   6   2.425   2.106   2.465
   36    HE   ARG   6           HE       ARG   6   1.905  -0.301   4.054
   37   HH11  ARG   6          1HH1      ARG   6   0.686   2.729   2.739
   38   HH12  ARG   6          2HH1      ARG   6  -0.953   2.287   2.820
   39   HH21  ARG   6          1HH2      ARG   6  -0.373  -0.922   4.177
   40   HH22  ARG   6          2HH2      ARG   6  -1.557   0.196   3.677
   41    H    GLN   7           H        GLN   7   3.178  -0.221  -2.034
   42    HA   GLN   7           HA       GLN   7   5.577   1.219  -2.451
   43    HB2  GLN   7          2HB       GLN   7   4.652  -0.782  -3.736
   44    HB3  GLN   7          1HB       GLN   7   3.555   0.334  -4.505
   45    HG2  GLN   7          2HG       GLN   7   5.413   1.508  -5.519
   46    HG3  GLN   7          1HG       GLN   7   6.550   0.436  -4.696
   47   HE21  GLN   7          1HE2      GLN   7   6.653  -1.751  -5.335
   48   HE22  GLN   7          2HE2      GLN   7   6.054  -2.279  -6.859
   49    H    ASP   8           H        ASP   8   2.192   1.935  -2.851
   50    HA   ASP   8           HA       ASP   8   2.727   4.545  -4.051
   51    HB2  ASP   8          2HB       ASP   8   0.187   2.973  -3.636
   52    HB3  ASP   8          1HB       ASP   8   0.171   4.663  -4.108
   53    HA   PRO   9           HA       PRO   9   2.079   6.361   0.042
   54    HB2  PRO   9          2HB       PRO   9   1.768   8.898  -1.411
   55    HB3  PRO   9          1HB       PRO   9   2.987   8.454  -0.215
   56    HG2  PRO   9          2HG       PRO   9   3.600   8.757  -2.808
   57    HG3  PRO   9          1HG       PRO   9   4.397   7.547  -1.790
   58    HD2  PRO   9          2HD       PRO   9   2.200   7.183  -3.792
   59    HD3  PRO   9          1HD       PRO   9   3.641   6.178  -3.482
   60    H    GLU  10           H        GLU  10   0.167   6.551  -2.736
   61    HA   GLU  10           HA       GLU  10  -2.159   7.912  -1.917
   62    HB2  GLU  10          2HB       GLU  10  -1.535   7.169  -4.236
   63    HB3  GLU  10          1HB       GLU  10  -1.954   5.530  -3.765
   64    HG2  GLU  10          2HG       GLU  10  -3.759   6.477  -5.010
   65    HG3  GLU  10          1HG       GLU  10  -4.260   6.316  -3.326
   66    H    ALA  11           H        ALA  11  -0.957   4.667  -1.442
   67    HA   ALA  11           HA       ALA  11  -3.424   3.648  -0.372
   68    HB1  ALA  11          1HB       ALA  11  -0.699   2.408  -0.598
   69    HB2  ALA  11          2HB       ALA  11  -2.008   2.267  -1.771
   70    HB3  ALA  11          3HB       ALA  11  -2.189   1.573  -0.158
   71    H    ASN  12           H        ASN  12  -1.107   5.606   0.861
   72    HA   ASN  12           HA       ASN  12  -0.959   4.309   3.444
   73    HB2  ASN  12          2HB       ASN  12   0.051   7.045   2.618
   74    HB3  ASN  12          1HB       ASN  12   0.337   6.301   4.184
   75   HD21  ASN  12          1HD2      ASN  12   2.286   7.217   2.356
   76   HD22  ASN  12          2HD2      ASN  12   3.231   5.848   1.873
   77    H    LYS  13           H        LYS  13  -3.062   6.159   1.785
   78    HA   LYS  13           HA       LYS  13  -4.113   7.772   3.913
   79    HB2  LYS  13          2HB       LYS  13  -5.259   7.049   1.225
   80    HB3  LYS  13          1HB       LYS  13  -5.925   8.250   2.316
   81    HG2  LYS  13          2HG       LYS  13  -3.954   9.620   2.071
   82    HG3  LYS  13          1HG       LYS  13  -3.195   8.383   1.064
   83    HD2  LYS  13          2HD       LYS  13  -4.986   8.629  -0.582
   84    HD3  LYS  13          1HD       LYS  13  -5.739   9.860   0.431
   85    HE2  LYS  13          2HE       LYS  13  -3.824  11.295   0.171
   86    HE3  LYS  13          1HE       LYS  13  -2.984  10.046  -0.753
   87    HZ1  LYS  13          1HZ       LYS  13  -4.671  10.182  -2.430
   88    HZ2  LYS  13          2HZ       LYS  13  -3.966  11.697  -2.204
   89    HZ3  LYS  13          3HZ       LYS  13  -5.504  11.379  -1.585
   90    H    SER  14           H        SER  14  -4.879   4.647   2.419
   91    HA   SER  14           HA       SER  14  -6.631   4.111   4.626
   92    HB2  SER  14          2HB       SER  14  -8.392   3.297   2.963
   93    HB3  SER  14          1HB       SER  14  -8.220   5.041   3.142
   94    HG   SER  14           HG       SER  14  -6.988   3.502   1.042
   95    HA   PRO  15           HA       PRO  15  -4.983   0.021   3.598
   96    HB2  PRO  15          2HB       PRO  15  -6.896  -1.330   5.240
   97    HB3  PRO  15          1HB       PRO  15  -5.254  -0.867   5.684
   98    HG2  PRO  15          2HG       PRO  15  -7.520   0.210   6.839
   99    HG3  PRO  15          1HG       PRO  15  -5.940   1.006   6.794
  100    HD2  PRO  15          2HD       PRO  15  -8.310   1.401   5.004
  101    HD3  PRO  15          1HD       PRO  15  -7.234   2.618   5.734
  102    H    GLU  16           H        GLU  16  -7.719   1.227   2.601
  103    HA   GLU  16           HA       GLU  16  -9.565  -0.753   1.990
  104    HB2  GLU  16          2HB       GLU  16  -9.916   1.680   1.996
  105    HB3  GLU  16          1HB       GLU  16  -8.952   1.798   0.543
  106    HG2  GLU  16          2HG       GLU  16 -10.586   0.501  -0.677
  107    HG3  GLU  16          1HG       GLU  16 -11.541   0.311   0.795
  108    H    GLU  17           H        GLU  17  -7.118   0.736  -0.103
  109    HA   GLU  17           HA       GLU  17  -7.612  -1.114  -2.182
  110    HB2  GLU  17          2HB       GLU  17  -5.429  -0.163  -3.171
  111    HB3  GLU  17          1HB       GLU  17  -6.802   0.910  -3.021
  112    HG2  GLU  17          2HG       GLU  17  -4.630   0.819  -0.948
  113    HG3  GLU  17          1HG       GLU  17  -4.496   1.813  -2.396
  114    H    CYS  18           H        CYS  18  -5.511  -1.055   0.514
  115    HA   CYS  18           HA       CYS  18  -3.793  -3.104  -0.409
  116    HB2  CYS  18          2HB       CYS  18  -4.353  -2.206   2.425
  117    HB3  CYS  18          1HB       CYS  18  -3.026  -3.256   1.937
  118    H    LYS  19           H        LYS  19  -6.896  -3.114   1.157
  119    HA   LYS  19           HA       LYS  19  -6.895  -5.951   1.690
  120    HB2  LYS  19          2HB       LYS  19  -9.179  -3.974   1.556
  121    HB3  LYS  19          1HB       LYS  19  -9.322  -5.628   2.124
  122    HG2  LYS  19          2HG       LYS  19  -7.660  -3.463   3.400
  123    HG3  LYS  19          1HG       LYS  19  -9.239  -4.009   3.958
  124    HD2  LYS  19          2HD       LYS  19  -8.311  -6.251   4.348
  125    HD3  LYS  19          1HD       LYS  19  -6.734  -5.682   3.797
  126    HE2  LYS  19          2HE       LYS  19  -6.694  -4.044   5.618
  127    HE3  LYS  19          1HE       LYS  19  -8.268  -4.621   6.159
  128    HZ1  LYS  19          1HZ       LYS  19  -7.287  -6.783   6.604
  129    HZ2  LYS  19          2HZ       LYS  19  -6.429  -5.601   7.440
  130    HZ3  LYS  19          3HZ       LYS  19  -5.803  -6.250   6.031
  131    H    LYS  20           H        LYS  20  -7.643  -3.890  -0.923
  132    HA   LYS  20           HA       LYS  20  -9.184  -5.827  -2.403
  133    HB2  LYS  20          2HB       LYS  20  -9.722  -3.468  -2.618
  134    HB3  LYS  20          1HB       LYS  20  -8.082  -3.114  -3.124
  135    HG2  LYS  20          2HG       LYS  20  -8.411  -4.160  -5.229
  136    HG3  LYS  20          1HG       LYS  20  -9.942  -4.862  -4.711
  137    HD2  LYS  20          2HD       LYS  20 -10.279  -2.906  -6.171
  138    HD3  LYS  20          1HD       LYS  20 -10.941  -2.645  -4.563
  139    HE2  LYS  20          2HE       LYS  20  -8.901  -1.367  -3.980
  140    HE3  LYS  20          1HE       LYS  20  -8.321  -1.588  -5.632
  141    HZ1  LYS  20          1HZ       LYS  20 -10.837  -0.192  -4.879
  142    HZ2  LYS  20          2HZ       LYS  20 -10.224  -0.350  -6.437
  143    HZ3  LYS  20          3HZ       LYS  20  -9.394   0.547  -5.297
  144    H    LEU  21           H        LEU  21  -5.934  -4.667  -2.278
  145    HA   LEU  21           HA       LEU  21  -5.053  -6.210  -4.544
  146    HB2  LEU  21          2HB       LEU  21  -3.553  -4.639  -2.449
  147    HB3  LEU  21          1HB       LEU  21  -2.805  -5.416  -3.830
  148    HG   LEU  21           HG       LEU  21  -4.852  -3.206  -4.013
  149   HD11  LEU  21          1HD1      LEU  21  -2.953  -1.805  -4.715
  150   HD12  LEU  21          2HD1      LEU  21  -1.852  -3.117  -4.268
  151   HD13  LEU  21          3HD1      LEU  21  -2.844  -2.338  -3.042
  152   HD21  LEU  21          1HD2      LEU  21  -3.116  -4.522  -6.100
  153   HD22  LEU  21          2HD2      LEU  21  -4.110  -3.093  -6.353
  154   HD23  LEU  21          3HD2      LEU  21  -4.875  -4.633  -5.970
  155    H    LYS  22           H        LYS  22  -3.133  -7.691  -4.141
  156    HA   LYS  22           HA       LYS  22  -3.940  -9.575  -2.071
  157    HB2  LYS  22          2HB       LYS  22  -1.972  -9.806  -4.318
  158    HB3  LYS  22          1HB       LYS  22  -2.229 -11.071  -3.150
  159    HG2  LYS  22          2HG       LYS  22  -4.371  -9.975  -4.974
  160    HG3  LYS  22          1HG       LYS  22  -3.424 -11.425  -5.300
  161    HD2  LYS  22          2HD       LYS  22  -5.281 -11.005  -2.945
  162    HD3  LYS  22          1HD       LYS  22  -5.615 -11.991  -4.368
  163    HE2  LYS  22          2HE       LYS  22  -3.701 -13.439  -3.796
  164    HE3  LYS  22          1HE       LYS  22  -3.414 -12.463  -2.361
  165    HZ1  LYS  22          1HZ       LYS  22  -4.611 -14.438  -1.813
  166    HZ2  LYS  22          2HZ       LYS  22  -5.834 -14.086  -2.905
  167    HZ3  LYS  22          3HZ       LYS  22  -5.609 -13.118  -1.537
  Start of MODEL   12
    1    H    ASN   1           H        ASN   1  -1.712  -6.404  -1.574
    2    HA   ASN   1           HA       ASN   1   0.515  -8.220  -2.017
    3    HB2  ASN   1          2HB       ASN   1  -0.064  -5.757  -3.710
    4    HB3  ASN   1          1HB       ASN   1   1.479  -6.598  -3.712
    5   HD21  ASN   1          1HD2      ASN   1  -1.757  -6.548  -4.879
    6   HD22  ASN   1          2HD2      ASN   1  -1.619  -7.901  -5.942
    7    HA   PRO   2           HA       PRO   2   1.045  -5.655   1.684
    8    HB2  PRO   2          2HB       PRO   2   3.556  -7.267   1.664
    9    HB3  PRO   2          1HB       PRO   2   2.456  -6.914   3.004
   10    HG2  PRO   2          2HG       PRO   2   2.371  -9.283   1.840
   11    HG3  PRO   2          1HG       PRO   2   0.867  -8.446   2.270
   12    HD2  PRO   2          2HD       PRO   2   2.159  -8.769  -0.394
   13    HD3  PRO   2          1HD       PRO   2   0.433  -8.806   0.037
   14    H    GLU   3           H        GLU   3   3.881  -6.308  -0.374
   15    HA   GLU   3           HA       GLU   3   5.250  -3.978   0.557
   16    HB2  GLU   3          2HB       GLU   3   6.261  -6.158  -0.360
   17    HB3  GLU   3          1HB       GLU   3   5.884  -5.513  -1.948
   18    HG2  GLU   3          2HG       GLU   3   8.190  -5.096  -1.413
   19    HG3  GLU   3          1HG       GLU   3   7.304  -3.571  -1.484
   20    H    ASP   4           H        ASP   4   3.282  -4.804  -2.205
   21    HA   ASP   4           HA       ASP   4   3.843  -2.472  -3.724
   22    HB2  ASP   4          2HB       ASP   4   1.580  -4.446  -3.901
   23    HB3  ASP   4          1HB       ASP   4   1.732  -3.074  -4.985
   24    H    CYS   5           H        CYS   5   1.248  -3.310  -1.474
   25    HA   CYS   5           HA       CYS   5  -0.231  -0.952  -1.783
   26    HB2  CYS   5          2HB       CYS   5  -1.252  -2.698  -0.497
   27    HB3  CYS   5          1HB       CYS   5   0.103  -2.749   0.632
   28    H    ARG   6           H        ARG   6   2.411  -1.715   0.431
   29    HA   ARG   6           HA       ARG   6   2.381   0.808   1.709
   30    HB2  ARG   6          2HB       ARG   6   3.221  -1.282   2.732
   31    HB3  ARG   6          1HB       ARG   6   4.571  -1.272   1.613
   32    HG2  ARG   6          2HG       ARG   6   5.345   0.838   2.580
   33    HG3  ARG   6          1HG       ARG   6   3.982   0.813   3.696
   34    HD2  ARG   6          2HD       ARG   6   6.165  -1.255   3.529
   35    HD3  ARG   6          1HD       ARG   6   6.025  -0.004   4.760
   36    HE   ARG   6           HE       ARG   6   3.981  -2.091   4.383
   37   HH11  ARG   6          1HH1      ARG   6   6.045  -0.185   6.556
   38   HH12  ARG   6          2HH1      ARG   6   5.544  -1.017   7.951
   39   HH21  ARG   6          1HH2      ARG   6   3.288  -3.184   6.278
   40   HH22  ARG   6          2HH2      ARG   6   3.906  -2.751   7.801
   41    H    GLN   7           H        GLN   7   3.632  -0.252  -1.268
   42    HA   GLN   7           HA       GLN   7   5.841   1.535  -1.470
   43    HB2  GLN   7          2HB       GLN   7   5.611  -0.549  -2.826
   44    HB3  GLN   7          1HB       GLN   7   4.288   0.206  -3.703
   45    HG2  GLN   7          2HG       GLN   7   6.358   0.326  -4.971
   46    HG3  GLN   7          1HG       GLN   7   5.806   1.939  -4.510
   47   HE21  GLN   7          1HE2      GLN   7   8.185  -0.504  -3.996
   48   HE22  GLN   7          2HE2      GLN   7   9.278   0.471  -3.082
   49    H    ASP   8           H        ASP   8   2.459   1.664  -2.371
   50    HA   ASP   8           HA       ASP   8   2.837   4.326  -3.493
   51    HB2  ASP   8          2HB       ASP   8   0.608   2.339  -3.667
   52    HB3  ASP   8          1HB       ASP   8   0.273   4.041  -3.954
   53    HA   PRO   9           HA       PRO   9   1.779   6.027   0.524
   54    HB2  PRO   9          2HB       PRO   9   1.541   8.455  -1.188
   55    HB3  PRO   9          1HB       PRO   9   2.416   8.236   0.331
   56    HG2  PRO   9          2HG       PRO   9   3.738   8.331  -1.968
   57    HG3  PRO   9          1HG       PRO   9   4.212   7.187  -0.699
   58    HD2  PRO   9          2HD       PRO   9   2.729   6.674  -3.246
   59    HD3  PRO   9          1HD       PRO   9   3.935   5.680  -2.410
   60    H    GLU  10           H        GLU  10  -0.019   6.486  -2.450
   61    HA   GLU  10           HA       GLU  10  -2.393   7.475  -1.177
   62    HB2  GLU  10          2HB       GLU  10  -1.831   7.903  -3.569
   63    HB3  GLU  10          1HB       GLU  10  -2.067   6.199  -3.901
   64    HG2  GLU  10          2HG       GLU  10  -4.005   7.475  -4.604
   65    HG3  GLU  10          1HG       GLU  10  -4.423   6.390  -3.282
   66    H    ALA  11           H        ALA  11  -1.402   4.332  -2.516
   67    HA   ALA  11           HA       ALA  11  -3.822   2.984  -1.929
   68    HB1  ALA  11          1HB       ALA  11  -2.234   2.230  -3.661
   69    HB2  ALA  11          2HB       ALA  11  -2.642   0.955  -2.512
   70    HB3  ALA  11          3HB       ALA  11  -1.094   1.789  -2.389
   71    H    ASN  12           H        ASN  12  -0.786   3.304  -0.235
   72    HA   ASN  12           HA       ASN  12  -1.296   1.425   1.816
   73    HB2  ASN  12          2HB       ASN  12   0.950   2.338   1.206
   74    HB3  ASN  12          1HB       ASN  12   0.481   3.871   1.919
   75   HD21  ASN  12          1HD2      ASN  12   2.103   3.812   3.435
   76   HD22  ASN  12          2HD2      ASN  12   2.086   2.747   4.785
   77    H    LYS  13           H        LYS  13  -2.217   4.728   1.334
   78    HA   LYS  13           HA       LYS  13  -2.864   5.228   4.086
   79    HB2  LYS  13          2HB       LYS  13  -2.124   7.008   2.507
   80    HB3  LYS  13          1HB       LYS  13  -3.627   6.804   1.624
   81    HG2  LYS  13          2HG       LYS  13  -3.782   8.737   3.048
   82    HG3  LYS  13          1HG       LYS  13  -4.868   7.482   3.650
   83    HD2  LYS  13          2HD       LYS  13  -3.234   6.864   5.350
   84    HD3  LYS  13          1HD       LYS  13  -2.109   8.071   4.724
   85    HE2  LYS  13          2HE       LYS  13  -4.830   8.633   5.896
   86    HE3  LYS  13          1HE       LYS  13  -3.297   8.847   6.728
   87    HZ1  LYS  13          1HZ       LYS  13  -2.689  10.502   5.033
   88    HZ2  LYS  13          2HZ       LYS  13  -4.082  10.934   5.867
   89    HZ3  LYS  13          3HZ       LYS  13  -4.207  10.347   4.317
   90    H    SER  14           H        SER  14  -4.636   4.568   1.092
   91    HA   SER  14           HA       SER  14  -7.209   4.666   2.212
   92    HB2  SER  14          2HB       SER  14  -7.759   3.386   0.069
   93    HB3  SER  14          1HB       SER  14  -7.018   4.969  -0.125
   94    HG   SER  14           HG       SER  14  -5.292   2.804   0.092
   95    HA   PRO  15           HA       PRO  15  -6.707   0.866   4.597
   96    HB2  PRO  15          2HB       PRO  15  -9.620   1.269   5.012
   97    HB3  PRO  15          1HB       PRO  15  -8.339   1.021   6.203
   98    HG2  PRO  15          2HG       PRO  15  -9.379   3.436   5.885
   99    HG3  PRO  15          1HG       PRO  15  -7.629   3.242   6.091
  100    HD2  PRO  15          2HD       PRO  15  -9.192   3.713   3.576
  101    HD3  PRO  15          1HD       PRO  15  -7.670   4.453   4.129
  102    H    GLU  16           H        GLU  16  -9.673   1.262   2.651
  103    HA   GLU  16           HA       GLU  16  -9.923  -1.578   2.487
  104    HB2  GLU  16          2HB       GLU  16 -11.586   0.571   1.200
  105    HB3  GLU  16          1HB       GLU  16 -11.945  -1.150   1.164
  106    HG2  GLU  16          2HG       GLU  16 -11.835   0.624   3.583
  107    HG3  GLU  16          1HG       GLU  16 -13.260  -0.132   2.863
  108    H    GLU  17           H        GLU  17  -8.474   0.837   0.617
  109    HA   GLU  17           HA       GLU  17  -8.421  -0.828  -1.716
  110    HB2  GLU  17          2HB       GLU  17  -6.981   1.733  -1.097
  111    HB3  GLU  17          1HB       GLU  17  -6.774   0.843  -2.599
  112    HG2  GLU  17          2HG       GLU  17  -9.357   1.986  -1.572
  113    HG3  GLU  17          1HG       GLU  17  -8.373   2.650  -2.877
  114    H    CYS  18           H        CYS  18  -6.392  -0.260   1.043
  115    HA   CYS  18           HA       CYS  18  -4.273  -1.846  -0.036
  116    HB2  CYS  18          2HB       CYS  18  -4.013  -0.134   1.843
  117    HB3  CYS  18          1HB       CYS  18  -4.788  -1.313   2.898
  118    H    LYS  19           H        LYS  19  -7.200  -2.362   1.742
  119    HA   LYS  19           HA       LYS  19  -6.875  -5.125   2.322
  120    HB2  LYS  19          2HB       LYS  19  -8.608  -3.668   3.332
  121    HB3  LYS  19          1HB       LYS  19  -9.358  -3.491   1.760
  122    HG2  LYS  19          2HG       LYS  19 -10.648  -5.033   3.033
  123    HG3  LYS  19          1HG       LYS  19  -9.813  -5.920   1.762
  124    HD2  LYS  19          2HD       LYS  19  -8.154  -6.704   3.339
  125    HD3  LYS  19          1HD       LYS  19  -8.873  -5.720   4.618
  126    HE2  LYS  19          2HE       LYS  19 -10.960  -7.003   4.397
  127    HE3  LYS  19          1HE       LYS  19 -10.194  -8.017   3.179
  128    HZ1  LYS  19          1HZ       LYS  19 -10.164  -9.058   5.338
  129    HZ2  LYS  19          2HZ       LYS  19  -9.352  -7.748   6.008
  130    HZ3  LYS  19          3HZ       LYS  19  -8.578  -8.712   4.873
  131    H    LYS  20           H        LYS  20  -8.039  -3.275  -0.375
  132    HA   LYS  20           HA       LYS  20  -9.084  -5.251  -2.051
  133    HB2  LYS  20          2HB       LYS  20  -9.385  -2.778  -2.238
  134    HB3  LYS  20          1HB       LYS  20  -7.723  -2.663  -2.770
  135    HG2  LYS  20          2HG       LYS  20  -9.127  -2.513  -4.667
  136    HG3  LYS  20          1HG       LYS  20  -8.299  -4.068  -4.723
  137    HD2  LYS  20          2HD       LYS  20 -10.644  -4.305  -5.335
  138    HD3  LYS  20          1HD       LYS  20 -10.295  -5.164  -3.838
  139    HE2  LYS  20          2HE       LYS  20 -12.427  -3.938  -3.751
  140    HE3  LYS  20          1HE       LYS  20 -11.299  -3.377  -2.530
  141    HZ1  LYS  20          1HZ       LYS  20 -10.861  -1.392  -3.844
  142    HZ2  LYS  20          2HZ       LYS  20 -12.516  -1.587  -3.715
  143    HZ3  LYS  20          3HZ       LYS  20 -11.742  -2.016  -5.141
  144    H    LEU  21           H        LEU  21  -5.941  -3.610  -2.125
  145    HA   LEU  21           HA       LEU  21  -4.910  -5.497  -4.043
  146    HB2  LEU  21          2HB       LEU  21  -3.575  -3.185  -2.644
  147    HB3  LEU  21          1HB       LEU  21  -2.888  -4.114  -3.959
  148    HG   LEU  21           HG       LEU  21  -5.347  -2.372  -4.152
  149   HD11  LEU  21          1HD1      LEU  21  -2.547  -1.922  -5.172
  150   HD12  LEU  21          2HD1      LEU  21  -3.327  -1.059  -3.848
  151   HD13  LEU  21          3HD1      LEU  21  -3.943  -0.894  -5.490
  152   HD21  LEU  21          1HD2      LEU  21  -5.124  -2.744  -6.576
  153   HD22  LEU  21          2HD2      LEU  21  -5.450  -4.239  -5.707
  154   HD23  LEU  21          3HD2      LEU  21  -3.816  -3.886  -6.272
  155    H    LYS  22           H        LYS  22  -4.669  -7.433  -3.082
  156    HA   LYS  22           HA       LYS  22  -3.469  -7.653  -0.473
  157    HB2  LYS  22          2HB       LYS  22  -5.308  -9.197  -1.238
  158    HB3  LYS  22          1HB       LYS  22  -4.183  -9.894  -2.389
  159    HG2  LYS  22          2HG       LYS  22  -2.740 -10.613  -0.523
  160    HG3  LYS  22          1HG       LYS  22  -3.891  -9.933   0.616
  161    HD2  LYS  22          2HD       LYS  22  -4.370 -12.236   0.604
  162    HD3  LYS  22          1HD       LYS  22  -5.605 -11.532  -0.426
  163    HE2  LYS  22          2HE       LYS  22  -3.065 -12.801  -1.477
  164    HE3  LYS  22          1HE       LYS  22  -4.562 -13.687  -1.255
  165    HZ1  LYS  22          1HZ       LYS  22  -4.122 -11.412  -3.128
  166    HZ2  LYS  22          2HZ       LYS  22  -5.603 -12.186  -2.887
  167    HZ3  LYS  22          3HZ       LYS  22  -4.297 -13.028  -3.517
  Start of MODEL   13
    1    H    ASN   1           H        ASN   1  -2.298  -7.532  -1.950
    2    HA   ASN   1           HA       ASN   1   0.314  -8.477  -1.023
    3    HB2  ASN   1          2HB       ASN   1  -0.289  -7.316  -3.746
    4    HB3  ASN   1          1HB       ASN   1   1.314  -7.710  -3.150
    5   HD21  ASN   1          1HD2      ASN   1   1.826  -9.914  -2.804
    6   HD22  ASN   1          2HD2      ASN   1   0.973 -11.151  -3.665
    7    HA   PRO   2           HA       PRO   2   0.131  -4.148   0.513
    8    HB2  PRO   2          2HB       PRO   2   1.928  -5.540   2.426
    9    HB3  PRO   2          1HB       PRO   2   0.663  -4.346   2.749
   10    HG2  PRO   2          2HG       PRO   2   0.223  -6.887   3.294
   11    HG3  PRO   2          1HG       PRO   2  -1.048  -5.914   2.523
   12    HD2  PRO   2          2HD       PRO   2   0.809  -7.914   1.283
   13    HD3  PRO   2          1HD       PRO   2  -0.922  -7.652   1.003
   14    H    GLU   3           H        GLU   3   2.630  -6.521  -0.194
   15    HA   GLU   3           HA       GLU   3   4.942  -4.965  -0.208
   16    HB2  GLU   3          2HB       GLU   3   4.352  -6.828  -2.512
   17    HB3  GLU   3          1HB       GLU   3   5.909  -6.420  -1.832
   18    HG2  GLU   3          2HG       GLU   3   5.568  -8.597  -1.142
   19    HG3  GLU   3          1HG       GLU   3   5.054  -7.656   0.261
   20    H    ASP   4           H        ASP   4   2.405  -5.226  -2.579
   21    HA   ASP   4           HA       ASP   4   3.690  -3.397  -4.391
   22    HB2  ASP   4          2HB       ASP   4   1.035  -4.812  -4.518
   23    HB3  ASP   4          1HB       ASP   4   1.615  -3.702  -5.753
   24    H    CYS   5           H        CYS   5   0.622  -3.460  -2.564
   25    HA   CYS   5           HA       CYS   5  -0.033  -0.872  -3.490
   26    HB2  CYS   5          2HB       CYS   5  -1.892  -0.928  -1.895
   27    HB3  CYS   5          1HB       CYS   5  -1.774  -2.401  -2.856
   28    H    ARG   6           H        ARG   6   1.648  -1.878  -0.528
   29    HA   ARG   6           HA       ARG   6   1.307   0.636   0.784
   30    HB2  ARG   6          2HB       ARG   6   3.190  -1.655   1.326
   31    HB3  ARG   6          1HB       ARG   6   3.132  -0.207   2.320
   32    HG2  ARG   6          2HG       ARG   6   0.740  -1.969   1.832
   33    HG3  ARG   6          1HG       ARG   6   1.849  -2.192   3.185
   34    HD2  ARG   6          2HD       ARG   6   0.292   0.337   2.615
   35    HD3  ARG   6          1HD       ARG   6  -0.161  -0.888   3.799
   36    HE   ARG   6           HE       ARG   6   2.489  -0.029   4.231
   37   HH11  ARG   6          1HH1      ARG   6  -0.839   1.139   4.739
   38   HH12  ARG   6          2HH1      ARG   6  -0.425   2.051   6.101
   39   HH21  ARG   6          1HH2      ARG   6   3.004   1.203   6.054
   40   HH22  ARG   6          2HH2      ARG   6   1.804   2.104   6.879
   41    H    GLN   7           H        GLN   7   3.088  -0.092  -1.855
   42    HA   GLN   7           HA       GLN   7   5.350   1.596  -1.272
   43    HB2  GLN   7          2HB       GLN   7   5.492  -0.293  -2.888
   44    HB3  GLN   7          1HB       GLN   7   4.350   0.543  -3.927
   45    HG2  GLN   7          2HG       GLN   7   5.960   2.399  -4.142
   46    HG3  GLN   7          1HG       GLN   7   7.111   1.472  -3.184
   47   HE21  GLN   7          1HE2      GLN   7   5.429   1.711  -6.179
   48   HE22  GLN   7          2HE2      GLN   7   6.414   0.610  -7.060
   49    H    ASP   8           H        ASP   8   2.115   2.018  -2.152
   50    HA   ASP   8           HA       ASP   8   2.543   4.551  -3.478
   51    HB2  ASP   8          2HB       ASP   8   0.181   2.790  -3.061
   52    HB3  ASP   8          1HB       ASP   8  -0.093   4.504  -3.332
   53    HA   PRO   9           HA       PRO   9   2.226   7.043   0.239
   54    HB2  PRO   9          2HB       PRO   9   1.112   8.922  -1.791
   55    HB3  PRO   9          1HB       PRO   9   2.362   9.207  -0.576
   56    HG2  PRO   9          2HG       PRO   9   3.048   8.873  -3.104
   57    HG3  PRO   9          1HG       PRO   9   3.997   8.101  -1.822
   58    HD2  PRO   9          2HD       PRO   9   2.012   6.894  -3.693
   59    HD3  PRO   9          1HD       PRO   9   3.538   6.239  -3.064
   60    H    GLU  10           H        GLU  10  -0.349   6.539  -2.061
   61    HA   GLU  10           HA       GLU  10  -2.440   7.788  -0.587
   62    HB2  GLU  10          2HB       GLU  10  -2.421   7.338  -3.061
   63    HB3  GLU  10          1HB       GLU  10  -2.677   5.640  -2.700
   64    HG2  GLU  10          2HG       GLU  10  -4.770   6.636  -3.298
   65    HG3  GLU  10          1HG       GLU  10  -4.800   6.250  -1.578
   66    H    ALA  11           H        ALA  11  -0.876   4.722  -0.331
   67    HA   ALA  11           HA       ALA  11  -3.044   3.161   0.582
   68    HB1  ALA  11          1HB       ALA  11  -0.112   2.683   1.076
   69    HB2  ALA  11          2HB       ALA  11  -0.997   2.191  -0.365
   70    HB3  ALA  11          3HB       ALA  11  -1.411   1.498   1.203
   71    H    ASN  12           H        ASN  12  -0.915   5.331   2.282
   72    HA   ASN  12           HA       ASN  12  -1.722   4.262   4.827
   73    HB2  ASN  12          2HB       ASN  12  -0.455   6.101   5.883
   74    HB3  ASN  12          1HB       ASN  12   0.514   5.207   4.731
   75   HD21  ASN  12          1HD2      ASN  12   1.972   6.815   4.435
   76   HD22  ASN  12          2HD2      ASN  12   1.618   8.291   3.616
   77    H    LYS  13           H        LYS  13  -2.926   6.514   2.662
   78    HA   LYS  13           HA       LYS  13  -4.583   7.907   4.580
   79    HB2  LYS  13          2HB       LYS  13  -3.674   8.803   2.315
   80    HB3  LYS  13          1HB       LYS  13  -4.928   7.835   1.579
   81    HG2  LYS  13          2HG       LYS  13  -5.373  10.131   3.500
   82    HG3  LYS  13          1HG       LYS  13  -5.558  10.183   1.755
   83    HD2  LYS  13          2HD       LYS  13  -7.387   8.491   1.966
   84    HD3  LYS  13          1HD       LYS  13  -7.208   8.594   3.711
   85    HE2  LYS  13          2HE       LYS  13  -9.043  10.008   2.963
   86    HE3  LYS  13          1HE       LYS  13  -7.739  10.972   3.648
   87    HZ1  LYS  13          1HZ       LYS  13  -8.613  11.948   1.638
   88    HZ2  LYS  13          2HZ       LYS  13  -8.245  10.585   0.734
   89    HZ3  LYS  13          3HZ       LYS  13  -7.008  11.526   1.396
   90    H    SER  14           H        SER  14  -5.102   5.817   1.771
   91    HA   SER  14           HA       SER  14  -7.305   4.568   3.186
   92    HB2  SER  14          2HB       SER  14  -8.370   4.386   0.875
   93    HB3  SER  14          1HB       SER  14  -8.330   6.001   1.588
   94    HG   SER  14           HG       SER  14  -6.382   5.022  -0.233
   95    HA   PRO  15           HA       PRO  15  -4.640   1.141   1.935
   96    HB2  PRO  15          2HB       PRO  15  -5.580  -0.651   3.686
   97    HB3  PRO  15          1HB       PRO  15  -4.540   0.675   4.211
   98    HG2  PRO  15          2HG       PRO  15  -7.508   0.395   4.427
   99    HG3  PRO  15          1HG       PRO  15  -6.355   1.046   5.606
  100    HD2  PRO  15          2HD       PRO  15  -7.906   2.583   3.908
  101    HD3  PRO  15          1HD       PRO  15  -6.393   3.122   4.660
  102    H    GLU  16           H        GLU  16  -7.002   1.860   0.471
  103    HA   GLU  16           HA       GLU  16  -8.990  -0.115   0.396
  104    HB2  GLU  16          2HB       GLU  16  -9.119   2.248  -0.526
  105    HB3  GLU  16          1HB       GLU  16  -8.200   1.669  -1.904
  106    HG2  GLU  16          2HG       GLU  16 -10.612   1.767  -2.349
  107    HG3  GLU  16          1HG       GLU  16  -9.963   0.133  -2.493
  108    H    GLU  17           H        GLU  17  -6.125   0.365  -1.666
  109    HA   GLU  17           HA       GLU  17  -6.568  -1.999  -3.153
  110    HB2  GLU  17          2HB       GLU  17  -4.052  -0.370  -2.758
  111    HB3  GLU  17          1HB       GLU  17  -4.089  -1.822  -3.726
  112    HG2  GLU  17          2HG       GLU  17  -4.199   0.074  -5.164
  113    HG3  GLU  17          1HG       GLU  17  -5.751  -0.748  -5.205
  114    H    CYS  18           H        CYS  18  -4.791  -1.284  -0.242
  115    HA   CYS  18           HA       CYS  18  -3.453  -3.777  -0.079
  116    HB2  CYS  18          2HB       CYS  18  -3.981  -1.716   2.052
  117    HB3  CYS  18          1HB       CYS  18  -2.946  -3.128   2.272
  118    H    LYS  19           H        LYS  19  -6.627  -2.848   0.881
  119    HA   LYS  19           HA       LYS  19  -6.860  -5.298   2.432
  120    HB2  LYS  19          2HB       LYS  19  -8.766  -2.978   2.125
  121    HB3  LYS  19          1HB       LYS  19  -9.105  -4.432   3.054
  122    HG2  LYS  19          2HG       LYS  19  -6.844  -2.517   3.593
  123    HG3  LYS  19          1HG       LYS  19  -8.373  -2.556   4.471
  124    HD2  LYS  19          2HD       LYS  19  -7.891  -4.852   5.189
  125    HD3  LYS  19          1HD       LYS  19  -6.361  -4.809   4.318
  126    HE2  LYS  19          2HE       LYS  19  -5.623  -2.948   5.736
  127    HE3  LYS  19          1HE       LYS  19  -7.147  -3.029   6.615
  128    HZ1  LYS  19          1HZ       LYS  19  -6.565  -5.303   7.293
  129    HZ2  LYS  19          2HZ       LYS  19  -5.393  -4.199   7.787
  130    HZ3  LYS  19          3HZ       LYS  19  -5.110  -5.180   6.465
  131    H    LYS  20           H        LYS  20  -7.386  -4.233  -0.676
  132    HA   LYS  20           HA       LYS  20  -9.459  -6.247  -1.130
  133    HB2  LYS  20          2HB       LYS  20  -9.658  -3.899  -2.109
  134    HB3  LYS  20          1HB       LYS  20  -8.305  -4.321  -3.145
  135    HG2  LYS  20          2HG       LYS  20  -9.587  -6.047  -4.217
  136    HG3  LYS  20          1HG       LYS  20 -10.916  -5.820  -3.081
  137    HD2  LYS  20          2HD       LYS  20 -11.484  -4.706  -5.140
  138    HD3  LYS  20          1HD       LYS  20 -11.154  -3.492  -3.908
  139    HE2  LYS  20          2HE       LYS  20 -10.126  -2.791  -5.946
  140    HE3  LYS  20          1HE       LYS  20  -8.847  -3.284  -4.841
  141    HZ1  LYS  20          1HZ       LYS  20  -8.402  -4.186  -7.001
  142    HZ2  LYS  20          2HZ       LYS  20  -9.946  -4.775  -7.122
  143    HZ3  LYS  20          3HZ       LYS  20  -8.886  -5.492  -6.034
  144    H    LEU  21           H        LEU  21  -6.290  -5.218  -2.353
  145    HA   LEU  21           HA       LEU  21  -5.729  -7.782  -3.557
  146    HB2  LEU  21          2HB       LEU  21  -3.958  -5.405  -2.944
  147    HB3  LEU  21          1HB       LEU  21  -3.499  -6.790  -3.902
  148    HG   LEU  21           HG       LEU  21  -5.656  -4.836  -4.700
  149   HD11  LEU  21          1HD1      LEU  21  -2.773  -5.016  -5.571
  150   HD12  LEU  21          2HD1      LEU  21  -3.455  -3.770  -4.530
  151   HD13  LEU  21          3HD1      LEU  21  -3.991  -3.907  -6.208
  152   HD21  LEU  21          1HD2      LEU  21  -5.839  -7.068  -5.698
  153   HD22  LEU  21          2HD2      LEU  21  -4.163  -6.957  -6.238
  154   HD23  LEU  21          3HD2      LEU  21  -5.374  -5.857  -6.893
  155    H    LYS  22           H        LYS  22  -4.135  -9.150  -2.608
  156    HA   LYS  22           HA       LYS  22  -3.916  -8.663   0.267
  157    HB2  LYS  22          2HB       LYS  22  -3.414 -11.270  -1.160
  158    HB3  LYS  22          1HB       LYS  22  -3.593 -11.027   0.567
  159    HG2  LYS  22          2HG       LYS  22  -5.738 -10.741  -1.520
  160    HG3  LYS  22          1HG       LYS  22  -5.608 -12.042  -0.331
  161    HD2  LYS  22          2HD       LYS  22  -5.972 -10.367   1.450
  162    HD3  LYS  22          1HD       LYS  22  -6.120  -9.110   0.221
  163    HE2  LYS  22          2HE       LYS  22  -7.945 -11.491   0.609
  164    HE3  LYS  22          1HE       LYS  22  -8.327  -9.808   0.930
  165    HZ1  LYS  22          1HZ       LYS  22  -9.277 -10.489  -1.189
  166    HZ2  LYS  22          2HZ       LYS  22  -7.784 -10.973  -1.766
  167    HZ3  LYS  22          3HZ       LYS  22  -8.087  -9.349  -1.477
  Start of MODEL   14
    1    H    ASN   1           H        ASN   1  -2.183  -6.632  -2.983
    2    HA   ASN   1           HA       ASN   1   0.291  -7.825  -1.963
    3    HB2  ASN   1          2HB       ASN   1   0.049  -5.629  -4.023
    4    HB3  ASN   1          1HB       ASN   1   1.554  -6.152  -3.286
    5   HD21  ASN   1          1HD2      ASN   1   2.377  -8.183  -3.811
    6   HD22  ASN   1          2HD2      ASN   1   1.897  -9.014  -5.238
    7    HA   PRO   2           HA       PRO   2  -0.866  -4.720   1.182
    8    HB2  PRO   2          2HB       PRO   2   1.058  -6.269   2.774
    9    HB3  PRO   2          1HB       PRO   2  -0.628  -5.891   3.129
   10    HG2  PRO   2          2HG       PRO   2   0.142  -8.374   2.462
   11    HG3  PRO   2          1HG       PRO   2  -1.421  -7.709   1.956
   12    HD2  PRO   2          2HD       PRO   2   1.102  -8.026   0.383
   13    HD3  PRO   2          1HD       PRO   2  -0.583  -8.309  -0.107
   14    H    GLU   3           H        GLU   3   2.426  -6.043   0.684
   15    HA   GLU   3           HA       GLU   3   3.736  -3.798   1.794
   16    HB2  GLU   3          2HB       GLU   3   4.737  -6.080   1.574
   17    HB3  GLU   3          1HB       GLU   3   4.855  -5.823  -0.161
   18    HG2  GLU   3          2HG       GLU   3   6.983  -5.417   0.876
   19    HG3  GLU   3          1HG       GLU   3   6.319  -3.905   0.248
   20    H    ASP   4           H        ASP   4   2.767  -4.710  -1.414
   21    HA   ASP   4           HA       ASP   4   4.044  -2.495  -2.667
   22    HB2  ASP   4          2HB       ASP   4   1.900  -4.333  -3.705
   23    HB3  ASP   4          1HB       ASP   4   2.596  -3.025  -4.636
   24    H    CYS   5           H        CYS   5   0.892  -3.001  -1.266
   25    HA   CYS   5           HA       CYS   5  -0.201  -0.574  -2.184
   26    HB2  CYS   5          2HB       CYS   5  -1.551  -2.358  -1.108
   27    HB3  CYS   5          1HB       CYS   5  -0.751  -2.023   0.423
   28    H    ARG   6           H        ARG   6   1.833  -1.411   0.579
   29    HA   ARG   6           HA       ARG   6   1.878   1.175   1.759
   30    HB2  ARG   6          2HB       ARG   6   3.790  -1.141   2.014
   31    HB3  ARG   6          1HB       ARG   6   3.879   0.329   2.975
   32    HG2  ARG   6          2HG       ARG   6   1.624  -0.131   3.834
   33    HG3  ARG   6          1HG       ARG   6   1.614  -1.638   2.919
   34    HD2  ARG   6          2HD       ARG   6   3.639  -0.931   5.026
   35    HD3  ARG   6          1HD       ARG   6   2.205  -1.900   5.326
   36    HE   ARG   6           HE       ARG   6   4.535  -2.669   3.698
   37   HH11  ARG   6          1HH1      ARG   6   1.401  -3.563   5.047
   38   HH12  ARG   6          2HH1      ARG   6   1.775  -5.211   5.211
   39   HH21  ARG   6          1HH2      ARG   6   5.062  -4.962   3.922
   40   HH22  ARG   6          2HH2      ARG   6   3.887  -6.032   4.535
   41    H    GLN   7           H        GLN   7   3.445  -0.181  -0.904
   42    HA   GLN   7           HA       GLN   7   5.772   1.458  -0.972
   43    HB2  GLN   7          2HB       GLN   7   5.676  -0.715  -2.093
   44    HB3  GLN   7          1HB       GLN   7   4.390  -0.136  -3.134
   45    HG2  GLN   7          2HG       GLN   7   6.492  -0.202  -4.317
   46    HG3  GLN   7          1HG       GLN   7   5.920   1.456  -4.146
   47   HE21  GLN   7          1HE2      GLN   7   7.031   2.863  -2.843
   48   HE22  GLN   7          2HE2      GLN   7   8.627   2.537  -2.265
   49    H    ASP   8           H        ASP   8   2.500   1.789  -2.081
   50    HA   ASP   8           HA       ASP   8   3.221   4.331  -3.348
   51    HB2  ASP   8          2HB       ASP   8   0.858   2.505  -3.833
   52    HB3  ASP   8          1HB       ASP   8   0.858   4.180  -4.360
   53    HA   PRO   9           HA       PRO   9   1.625   6.017   0.545
   54    HB2  PRO   9          2HB       PRO   9   1.913   8.437  -1.188
   55    HB3  PRO   9          1HB       PRO   9   2.379   8.208   0.502
   56    HG2  PRO   9          2HG       PRO   9   4.225   8.138  -1.393
   57    HG3  PRO   9          1HG       PRO   9   4.279   6.982  -0.051
   58    HD2  PRO   9          2HD       PRO   9   3.466   6.554  -2.886
   59    HD3  PRO   9          1HD       PRO   9   4.285   5.453  -1.765
   60    H    GLU  10           H        GLU  10   0.428   6.817  -2.692
   61    HA   GLU  10           HA       GLU  10  -2.009   7.995  -1.876
   62    HB2  GLU  10          2HB       GLU  10  -1.140   8.333  -4.124
   63    HB3  GLU  10          1HB       GLU  10  -1.274   6.614  -4.462
   64    HG2  GLU  10          2HG       GLU  10  -3.671   6.735  -4.342
   65    HG3  GLU  10          1HG       GLU  10  -3.594   8.433  -3.874
   66    H    ALA  11           H        ALA  11  -1.086   4.691  -2.553
   67    HA   ALA  11           HA       ALA  11  -3.765   3.685  -2.394
   68    HB1  ALA  11          1HB       ALA  11  -1.115   2.235  -2.389
   69    HB2  ALA  11          2HB       ALA  11  -2.100   2.578  -3.812
   70    HB3  ALA  11          3HB       ALA  11  -2.695   1.477  -2.567
   71    H    ASN  12           H        ASN  12  -0.865   3.615  -0.369
   72    HA   ASN  12           HA       ASN  12  -1.950   2.105   1.743
   73    HB2  ASN  12          2HB       ASN  12   0.473   2.450   1.375
   74    HB3  ASN  12          1HB       ASN  12   0.302   4.111   1.916
   75   HD21  ASN  12          1HD2      ASN  12   0.048   4.532   4.130
   76   HD22  ASN  12          2HD2      ASN  12   0.254   3.319   5.340
   77    H    LYS  13           H        LYS  13  -2.351   5.397   0.946
   78    HA   LYS  13           HA       LYS  13  -3.059   6.567   3.370
   79    HB2  LYS  13          2HB       LYS  13  -2.878   7.848   1.293
   80    HB3  LYS  13          1HB       LYS  13  -4.244   6.984   0.616
   81    HG2  LYS  13          2HG       LYS  13  -4.888   9.208   1.311
   82    HG3  LYS  13          1HG       LYS  13  -5.713   7.992   2.288
   83    HD2  LYS  13          2HD       LYS  13  -4.062   8.341   4.075
   84    HD3  LYS  13          1HD       LYS  13  -3.269   9.577   3.101
   85    HE2  LYS  13          2HE       LYS  13  -6.097   9.634   4.135
   86    HE3  LYS  13          1HE       LYS  13  -4.749  10.591   4.750
   87    HZ1  LYS  13          1HZ       LYS  13  -6.133  11.889   3.288
   88    HZ2  LYS  13          2HZ       LYS  13  -5.951  10.776   2.046
   89    HZ3  LYS  13          3HZ       LYS  13  -4.619  11.667   2.580
   90    H    SER  14           H        SER  14  -4.754   4.362   1.321
   91    HA   SER  14           HA       SER  14  -6.909   4.252   3.263
   92    HB2  SER  14          2HB       SER  14  -8.223   3.306   1.298
   93    HB3  SER  14          1HB       SER  14  -7.813   5.022   1.207
   94    HG   SER  14           HG       SER  14  -5.978   3.233   0.126
   95    HA   PRO  15           HA       PRO  15  -4.690   0.227   3.788
   96    HB2  PRO  15          2HB       PRO  15  -6.321  -0.533   5.909
   97    HB3  PRO  15          1HB       PRO  15  -4.807   0.360   6.075
   98    HG2  PRO  15          2HG       PRO  15  -7.613   1.374   6.032
   99    HG3  PRO  15          1HG       PRO  15  -6.253   1.877   7.055
  100    HD2  PRO  15          2HD       PRO  15  -7.036   3.346   4.993
  101    HD3  PRO  15          1HD       PRO  15  -5.312   3.164   5.355
  102    H    GLU  16           H        GLU  16  -7.957   1.009   3.389
  103    HA   GLU  16           HA       GLU  16  -9.197  -1.465   2.942
  104    HB2  GLU  16          2HB       GLU  16  -9.757   1.219   1.692
  105    HB3  GLU  16          1HB       GLU  16 -10.863  -0.145   1.732
  106    HG2  GLU  16          2HG       GLU  16 -10.978  -0.019   4.148
  107    HG3  GLU  16          1HG       GLU  16  -9.798   1.289   4.154
  108    H    GLU  17           H        GLU  17  -7.206   0.599   0.891
  109    HA   GLU  17           HA       GLU  17  -7.715  -0.680  -1.607
  110    HB2  GLU  17          2HB       GLU  17  -6.728   1.619  -1.297
  111    HB3  GLU  17          1HB       GLU  17  -5.272   0.858  -0.684
  112    HG2  GLU  17          2HG       GLU  17  -4.827   1.421  -2.920
  113    HG3  GLU  17          1HG       GLU  17  -5.105  -0.321  -2.915
  114    H    CYS  18           H        CYS  18  -5.294  -0.894   0.929
  115    HA   CYS  18           HA       CYS  18  -3.629  -2.836  -0.192
  116    HB2  CYS  18          2HB       CYS  18  -4.157  -2.399   2.750
  117    HB3  CYS  18          1HB       CYS  18  -2.700  -3.062   2.018
  118    H    LYS  19           H        LYS  19  -6.534  -3.071   1.778
  119    HA   LYS  19           HA       LYS  19  -6.361  -5.923   1.978
  120    HB2  LYS  19          2HB       LYS  19  -8.611  -4.033   2.675
  121    HB3  LYS  19          1HB       LYS  19  -8.656  -5.764   2.970
  122    HG2  LYS  19          2HG       LYS  19  -6.673  -3.825   4.163
  123    HG3  LYS  19          1HG       LYS  19  -8.063  -4.532   4.994
  124    HD2  LYS  19          2HD       LYS  19  -7.104  -6.769   4.696
  125    HD3  LYS  19          1HD       LYS  19  -5.730  -6.082   3.841
  126    HE2  LYS  19          2HE       LYS  19  -6.478  -5.560   6.711
  127    HE3  LYS  19          1HE       LYS  19  -5.178  -6.609   6.161
  128    HZ1  LYS  19          1HZ       LYS  19  -5.327  -3.653   5.829
  129    HZ2  LYS  19          2HZ       LYS  19  -4.133  -4.603   5.146
  130    HZ3  LYS  19          3HZ       LYS  19  -4.274  -4.509   6.819
  131    H    LYS  20           H        LYS  20  -7.614  -3.757  -0.323
  132    HA   LYS  20           HA       LYS  20  -9.308  -5.713  -1.582
  133    HB2  LYS  20          2HB       LYS  20  -9.809  -3.315  -1.761
  134    HB3  LYS  20          1HB       LYS  20  -8.272  -3.046  -2.565
  135    HG2  LYS  20          2HG       LYS  20  -9.002  -4.399  -4.447
  136    HG3  LYS  20          1HG       LYS  20 -10.535  -4.718  -3.634
  137    HD2  LYS  20          2HD       LYS  20 -11.044  -2.329  -3.653
  138    HD3  LYS  20          1HD       LYS  20  -9.506  -2.004  -4.451
  139    HE2  LYS  20          2HE       LYS  20 -11.337  -2.024  -6.061
  140    HE3  LYS  20          1HE       LYS  20 -10.207  -3.340  -6.358
  141    HZ1  LYS  20          1HZ       LYS  20 -12.791  -3.625  -4.925
  142    HZ2  LYS  20          2HZ       LYS  20 -11.744  -4.882  -5.325
  143    HZ3  LYS  20          3HZ       LYS  20 -12.535  -4.028  -6.536
  144    H    LEU  21           H        LEU  21  -6.184  -4.198  -2.201
  145    HA   LEU  21           HA       LEU  21  -5.506  -5.764  -4.461
  146    HB2  LEU  21          2HB       LEU  21  -3.765  -4.258  -2.509
  147    HB3  LEU  21          1HB       LEU  21  -3.190  -4.972  -3.997
  148    HG   LEU  21           HG       LEU  21  -5.206  -2.728  -3.812
  149   HD11  LEU  21          1HD1      LEU  21  -2.289  -2.696  -4.569
  150   HD12  LEU  21          2HD1      LEU  21  -2.987  -2.017  -3.098
  151   HD13  LEU  21          3HD1      LEU  21  -3.394  -1.325  -4.668
  152   HD21  LEU  21          1HD2      LEU  21  -5.527  -4.092  -5.809
  153   HD22  LEU  21          2HD2      LEU  21  -3.808  -3.975  -6.179
  154   HD23  LEU  21          3HD2      LEU  21  -4.821  -2.532  -6.238
  155    H    LYS  22           H        LYS  22  -3.878  -7.394  -4.546
  156    HA   LYS  22           HA       LYS  22  -3.983  -9.225  -2.291
  157    HB2  LYS  22          2HB       LYS  22  -2.634  -9.504  -4.976
  158    HB3  LYS  22          1HB       LYS  22  -2.835 -10.781  -3.789
  159    HG2  LYS  22          2HG       LYS  22  -5.255 -10.668  -4.075
  160    HG3  LYS  22          1HG       LYS  22  -5.042  -9.365  -5.248
  161    HD2  LYS  22          2HD       LYS  22  -3.745 -10.846  -6.678
  162    HD3  LYS  22          1HD       LYS  22  -3.937 -12.152  -5.509
  163    HE2  LYS  22          2HE       LYS  22  -6.372 -12.046  -5.833
  164    HE3  LYS  22          1HE       LYS  22  -6.148 -10.774  -7.028
  165    HZ1  LYS  22          1HZ       LYS  22  -6.427 -12.876  -8.099
  166    HZ2  LYS  22          2HZ       LYS  22  -5.171 -13.574  -7.231
  167    HZ3  LYS  22          3HZ       LYS  22  -4.848 -12.352  -8.353
  Start of MODEL   15
    1    H    ASN   1           H        ASN   1  -1.860  -7.618  -2.415
    2    HA   ASN   1           HA       ASN   1   0.581  -8.970  -1.523
    3    HB2  ASN   1          2HB       ASN   1   0.202  -6.643  -3.427
    4    HB3  ASN   1          1HB       ASN   1   1.711  -7.500  -3.138
    5   HD21  ASN   1          1HD2      ASN   1   1.990  -9.525  -4.042
    6   HD22  ASN   1          2HD2      ASN   1   0.971 -10.126  -5.295
    7    HA   PRO   2           HA       PRO   2   0.038  -5.882   1.822
    8    HB2  PRO   2          2HB       PRO   2   2.408  -7.220   2.960
    9    HB3  PRO   2          1HB       PRO   2   0.807  -6.973   3.664
   10    HG2  PRO   2          2HG       PRO   2   1.583  -9.388   2.844
   11    HG3  PRO   2          1HG       PRO   2  -0.087  -8.835   2.616
   12    HD2  PRO   2          2HD       PRO   2   2.158  -8.945   0.633
   13    HD3  PRO   2          1HD       PRO   2   0.452  -9.417   0.440
   14    H    GLU   3           H        GLU   3   3.097  -6.549   0.239
   15    HA   GLU   3           HA       GLU   3   4.236  -4.080   1.277
   16    HB2  GLU   3          2HB       GLU   3   5.638  -6.132   1.060
   17    HB3  GLU   3          1HB       GLU   3   5.407  -6.077  -0.677
   18    HG2  GLU   3          2HG       GLU   3   7.581  -5.197  -0.048
   19    HG3  GLU   3          1HG       GLU   3   6.577  -3.948  -0.785
   20    H    ASP   4           H        ASP   4   3.311  -5.528  -1.769
   21    HA   ASP   4           HA       ASP   4   4.026  -3.413  -3.456
   22    HB2  ASP   4          2HB       ASP   4   1.960  -5.570  -3.839
   23    HB3  ASP   4          1HB       ASP   4   2.415  -4.429  -5.089
   24    H    CYS   5           H        CYS   5   0.993  -4.034  -1.763
   25    HA   CYS   5           HA       CYS   5  -0.478  -2.027  -3.105
   26    HB2  CYS   5          2HB       CYS   5  -2.119  -2.275  -1.322
   27    HB3  CYS   5          1HB       CYS   5  -1.552  -3.847  -1.874
   28    H    ARG   6           H        ARG   6   1.702  -1.957  -0.416
   29    HA   ARG   6           HA       ARG   6   0.790   0.568   0.634
   30    HB2  ARG   6          2HB       ARG   6   1.655  -1.343   2.030
   31    HB3  ARG   6          1HB       ARG   6   3.246  -1.047   1.361
   32    HG2  ARG   6          2HG       ARG   6   3.117  -0.078   3.554
   33    HG3  ARG   6          1HG       ARG   6   3.197   1.215   2.358
   34    HD2  ARG   6          2HD       ARG   6   0.777   1.541   2.534
   35    HD3  ARG   6          1HD       ARG   6   0.675   0.220   3.700
   36    HE   ARG   6           HE       ARG   6   2.495   2.302   4.430
   37   HH11  ARG   6          1HH1      ARG   6  -0.902   1.252   4.647
   38   HH12  ARG   6          2HH1      ARG   6  -1.269   2.217   5.992
   39   HH21  ARG   6          1HH2      ARG   6   1.976   3.641   6.302
   40   HH22  ARG   6          2HH2      ARG   6   0.407   3.611   6.956
   41    H    GLN   7           H        GLN   7   2.482  -0.213  -2.012
   42    HA   GLN   7           HA       GLN   7   4.733   1.512  -1.988
   43    HB2  GLN   7          2HB       GLN   7   4.566  -0.355  -3.532
   44    HB3  GLN   7          1HB       GLN   7   3.124   0.330  -4.253
   45    HG2  GLN   7          2HG       GLN   7   5.014   0.668  -5.711
   46    HG3  GLN   7          1HG       GLN   7   4.453   2.210  -5.086
   47   HE21  GLN   7          1HE2      GLN   7   6.401   3.189  -5.464
   48   HE22  GLN   7          2HE2      GLN   7   7.803   2.871  -4.527
   49    H    ASP   8           H        ASP   8   1.370   1.973  -2.616
   50    HA   ASP   8           HA       ASP   8   1.740   4.446  -4.039
   51    HB2  ASP   8          2HB       ASP   8  -0.712   2.990  -3.096
   52    HB3  ASP   8          1HB       ASP   8  -0.779   4.563  -3.876
   53    HA   PRO   9           HA       PRO   9   1.794   7.101  -0.476
   54    HB2  PRO   9          2HB       PRO   9   0.792   9.367  -1.713
   55    HB3  PRO   9          1HB       PRO   9   2.487   8.878  -1.757
   56    HG2  PRO   9          2HG       PRO   9   0.343   8.486  -3.796
   57    HG3  PRO   9          1HG       PRO   9   2.051   8.889  -4.032
   58    HD2  PRO   9          2HD       PRO   9   1.117   6.409  -4.447
   59    HD3  PRO   9          1HD       PRO   9   2.735   6.691  -3.776
   60    H    GLU  10           H        GLU  10  -1.072   6.748  -2.494
   61    HA   GLU  10           HA       GLU  10  -2.804   7.909  -0.519
   62    HB2  GLU  10          2HB       GLU  10  -3.234   7.992  -2.998
   63    HB3  GLU  10          1HB       GLU  10  -3.557   6.266  -2.943
   64    HG2  GLU  10          2HG       GLU  10  -5.619   7.546  -2.987
   65    HG3  GLU  10          1HG       GLU  10  -5.457   6.666  -1.469
   66    H    ALA  11           H        ALA  11  -1.300   4.899  -0.904
   67    HA   ALA  11           HA       ALA  11  -3.343   3.291   0.332
   68    HB1  ALA  11          1HB       ALA  11  -1.640   1.551   0.419
   69    HB2  ALA  11          2HB       ALA  11  -0.409   2.722  -0.054
   70    HB3  ALA  11          3HB       ALA  11  -1.694   2.290  -1.181
   71    H    ASN  12           H        ASN  12  -0.806   5.338   1.346
   72    HA   ASN  12           HA       ASN  12  -0.467   4.450   4.021
   73    HB2  ASN  12          2HB       ASN  12  -0.274   7.274   2.919
   74    HB3  ASN  12          1HB       ASN  12   0.265   6.764   4.504
   75   HD21  ASN  12          1HD2      ASN  12   2.317   7.465   4.140
   76   HD22  ASN  12          2HD2      ASN  12   3.419   6.699   3.047
   77    H    LYS  13           H        LYS  13  -2.529   6.716   2.417
   78    HA   LYS  13           HA       LYS  13  -3.900   7.604   4.768
   79    HB2  LYS  13          2HB       LYS  13  -3.449   8.787   2.452
   80    HB3  LYS  13          1HB       LYS  13  -4.915   7.968   1.965
   81    HG2  LYS  13          2HG       LYS  13  -4.664   9.963   4.222
   82    HG3  LYS  13          1HG       LYS  13  -5.320  10.286   2.628
   83    HD2  LYS  13          2HD       LYS  13  -6.475   8.377   4.663
   84    HD3  LYS  13          1HD       LYS  13  -7.064  10.003   4.343
   85    HE2  LYS  13          2HE       LYS  13  -7.065   7.665   2.434
   86    HE3  LYS  13          1HE       LYS  13  -8.466   8.360   3.241
   87    HZ1  LYS  13          1HZ       LYS  13  -8.429   9.162   1.052
   88    HZ2  LYS  13          2HZ       LYS  13  -6.820   9.542   1.085
   89    HZ3  LYS  13          3HZ       LYS  13  -7.933  10.476   1.978
   90    H    SER  14           H        SER  14  -4.785   5.686   1.895
   91    HA   SER  14           HA       SER  14  -6.965   4.559   3.469
   92    HB2  SER  14          2HB       SER  14  -8.095   4.134   1.250
   93    HB3  SER  14          1HB       SER  14  -7.943   5.827   1.707
   94    HG   SER  14           HG       SER  14  -5.771   5.281   0.328
   95    HA   PRO  15           HA       PRO  15  -4.484   0.813   2.888
   96    HB2  PRO  15          2HB       PRO  15  -6.406  -0.301   4.814
   97    HB3  PRO  15          1HB       PRO  15  -4.654  -0.143   4.950
   98    HG2  PRO  15          2HG       PRO  15  -6.305   1.362   6.424
   99    HG3  PRO  15          1HG       PRO  15  -4.765   1.983   5.804
  100    HD2  PRO  15          2HD       PRO  15  -7.533   2.409   4.741
  101    HD3  PRO  15          1HD       PRO  15  -6.208   3.576   4.979
  102    H    GLU  16           H        GLU  16  -7.442   1.643   1.895
  103    HA   GLU  16           HA       GLU  16  -8.837  -0.712   1.334
  104    HB2  GLU  16          2HB       GLU  16  -9.670   1.675   1.155
  105    HB3  GLU  16          1HB       GLU  16  -8.801   1.782  -0.369
  106    HG2  GLU  16          2HG       GLU  16 -10.165  -0.047  -1.258
  107    HG3  GLU  16          1HG       GLU  16 -11.051  -0.111   0.265
  108    H    GLU  17           H        GLU  17  -6.156   0.855  -0.197
  109    HA   GLU  17           HA       GLU  17  -5.990  -0.495  -2.652
  110    HB2  GLU  17          2HB       GLU  17  -3.728   0.399  -0.849
  111    HB3  GLU  17          1HB       GLU  17  -3.590   0.032  -2.559
  112    HG2  GLU  17          2HG       GLU  17  -5.238   2.265  -1.390
  113    HG3  GLU  17          1HG       GLU  17  -3.637   2.444  -2.100
  114    H    CYS  18           H        CYS  18  -4.871  -1.338   0.578
  115    HA   CYS  18           HA       CYS  18  -3.674  -3.824  -0.247
  116    HB2  CYS  18          2HB       CYS  18  -4.112  -2.589   2.464
  117    HB3  CYS  18          1HB       CYS  18  -3.213  -4.080   2.182
  118    H    LYS  19           H        LYS  19  -6.670  -2.694   0.905
  119    HA   LYS  19           HA       LYS  19  -7.736  -5.152   1.833
  120    HB2  LYS  19          2HB       LYS  19  -8.700  -2.920   2.320
  121    HB3  LYS  19          1HB       LYS  19  -9.096  -2.741   0.623
  122    HG2  LYS  19          2HG       LYS  19 -10.674  -4.590   0.792
  123    HG3  LYS  19          1HG       LYS  19 -10.271  -4.772   2.506
  124    HD2  LYS  19          2HD       LYS  19 -10.993  -2.474   2.919
  125    HD3  LYS  19          1HD       LYS  19 -11.411  -2.297   1.215
  126    HE2  LYS  19          2HE       LYS  19 -13.065  -4.091   1.455
  127    HE3  LYS  19          1HE       LYS  19 -12.645  -4.237   3.158
  128    HZ1  LYS  19          1HZ       LYS  19 -13.386  -1.949   3.497
  129    HZ2  LYS  19          2HZ       LYS  19 -14.620  -2.883   2.834
  130    HZ3  LYS  19          3HZ       LYS  19 -13.767  -1.819   1.860
  131    H    LYS  20           H        LYS  20  -7.717  -3.470  -1.248
  132    HA   LYS  20           HA       LYS  20  -9.078  -5.488  -2.714
  133    HB2  LYS  20          2HB       LYS  20  -9.078  -3.171  -3.460
  134    HB3  LYS  20          1HB       LYS  20  -7.330  -3.192  -3.611
  135    HG2  LYS  20          2HG       LYS  20  -7.503  -4.844  -5.408
  136    HG3  LYS  20          1HG       LYS  20  -9.259  -4.826  -5.249
  137    HD2  LYS  20          2HD       LYS  20  -9.298  -2.461  -5.862
  138    HD3  LYS  20          1HD       LYS  20  -7.540  -2.455  -5.969
  139    HE2  LYS  20          2HE       LYS  20  -7.597  -4.035  -7.790
  140    HE3  LYS  20          1HE       LYS  20  -9.346  -4.195  -7.645
  141    HZ1  LYS  20          1HZ       LYS  20  -8.677  -2.725  -9.458
  142    HZ2  LYS  20          2HZ       LYS  20  -7.918  -1.689  -8.384
  143    HZ3  LYS  20          3HZ       LYS  20  -9.595  -1.920  -8.306
  144    H    LEU  21           H        LEU  21  -5.649  -4.509  -2.568
  145    HA   LEU  21           HA       LEU  21  -4.911  -6.828  -4.144
  146    HB2  LEU  21          2HB       LEU  21  -3.232  -4.594  -3.038
  147    HB3  LEU  21          1HB       LEU  21  -2.677  -5.834  -4.143
  148    HG   LEU  21           HG       LEU  21  -4.760  -3.739  -4.765
  149   HD11  LEU  21          1HD1      LEU  21  -3.049  -2.784  -6.214
  150   HD12  LEU  21          2HD1      LEU  21  -1.895  -3.993  -5.639
  151   HD13  LEU  21          3HD1      LEU  21  -2.552  -2.797  -4.521
  152   HD21  LEU  21          1HD2      LEU  21  -4.533  -4.531  -7.078
  153   HD22  LEU  21          2HD2      LEU  21  -5.148  -5.791  -6.014
  154   HD23  LEU  21          3HD2      LEU  21  -3.460  -5.820  -6.529
  155    H    LYS  22           H        LYS  22  -4.213  -8.626  -3.323
  156    HA   LYS  22           HA       LYS  22  -3.959  -9.072  -0.507
  157    HB2  LYS  22          2HB       LYS  22  -3.495 -11.402  -1.169
  158    HB3  LYS  22          1HB       LYS  22  -4.930 -10.756  -1.952
  159    HG2  LYS  22          2HG       LYS  22  -3.619 -10.367  -4.004
  160    HG3  LYS  22          1HG       LYS  22  -2.206 -11.054  -3.209
  161    HD2  LYS  22          2HD       LYS  22  -3.361 -13.191  -2.975
  162    HD3  LYS  22          1HD       LYS  22  -4.804 -12.502  -3.720
  163    HE2  LYS  22          2HE       LYS  22  -3.576 -12.105  -5.782
  164    HE3  LYS  22          1HE       LYS  22  -2.104 -12.733  -5.046
  165    HZ1  LYS  22          1HZ       LYS  22  -3.163 -14.406  -6.426
  166    HZ2  LYS  22          2HZ       LYS  22  -4.590 -14.293  -5.546
  167    HZ3  LYS  22          3HZ       LYS  22  -3.199 -14.884  -4.824
  Start of MODEL   16
    1    H    ASN   1           H        ASN   1  -1.487  -6.845  -2.738
    2    HA   ASN   1           HA       ASN   1   0.626  -8.456  -1.477
    3    HB2  ASN   1          2HB       ASN   1   0.937  -6.448  -3.722
    4    HB3  ASN   1          1HB       ASN   1   2.269  -7.212  -2.876
    5   HD21  ASN   1          1HD2      ASN   1   2.646  -9.408  -3.220
    6   HD22  ASN   1          2HD2      ASN   1   2.089 -10.191  -4.650
    7    HA   PRO   2           HA       PRO   2   0.152  -4.895   1.365
    8    HB2  PRO   2          2HB       PRO   2   2.141  -6.610   2.775
    9    HB3  PRO   2          1HB       PRO   2   0.704  -5.802   3.416
   10    HG2  PRO   2          2HG       PRO   2   0.666  -8.406   3.011
   11    HG3  PRO   2          1HG       PRO   2  -0.734  -7.411   2.568
   12    HD2  PRO   2          2HD       PRO   2   1.379  -8.587   0.813
   13    HD3  PRO   2          1HD       PRO   2  -0.369  -8.461   0.536
   14    H    GLU   3           H        GLU   3   3.067  -6.485   0.196
   15    HA   GLU   3           HA       GLU   3   4.924  -4.446   0.886
   16    HB2  GLU   3          2HB       GLU   3   5.574  -6.766   0.392
   17    HB3  GLU   3          1HB       GLU   3   5.058  -6.560  -1.272
   18    HG2  GLU   3          2HG       GLU   3   6.822  -4.924  -1.624
   19    HG3  GLU   3          1HG       GLU   3   7.323  -5.091   0.060
   20    H    ASP   4           H        ASP   4   2.785  -4.967  -1.781
   21    HA   ASP   4           HA       ASP   4   3.950  -2.897  -3.435
   22    HB2  ASP   4          2HB       ASP   4   2.768  -4.901  -4.385
   23    HB3  ASP   4          1HB       ASP   4   1.272  -4.270  -3.711
   24    H    CYS   5           H        CYS   5   1.265  -3.361  -1.269
   25    HA   CYS   5           HA       CYS   5  -0.137  -0.993  -1.540
   26    HB2  CYS   5          2HB       CYS   5  -1.088  -2.667  -0.152
   27    HB3  CYS   5          1HB       CYS   5   0.347  -2.740   0.867
   28    H    ARG   6           H        ARG   6   2.706  -1.624   0.501
   29    HA   ARG   6           HA       ARG   6   2.697   1.002   1.609
   30    HB2  ARG   6          2HB       ARG   6   4.777  -1.160   1.605
   31    HB3  ARG   6          1HB       ARG   6   5.027   0.396   2.379
   32    HG2  ARG   6          2HG       ARG   6   3.135  -0.030   3.855
   33    HG3  ARG   6          1HG       ARG   6   2.863  -1.583   3.059
   34    HD2  ARG   6          2HD       ARG   6   5.018  -2.378   3.771
   35    HD3  ARG   6          1HD       ARG   6   5.420  -0.804   4.454
   36    HE   ARG   6           HE       ARG   6   3.326  -1.304   5.875
   37   HH11  ARG   6          1HH1      ARG   6   5.775  -3.690   4.912
   38   HH12  ARG   6          2HH1      ARG   6   5.596  -4.646   6.295
   39   HH21  ARG   6          1HH2      ARG   6   3.081  -2.645   7.796
   40   HH22  ARG   6          2HH2      ARG   6   4.031  -4.046   7.970
   41    H    GLN   7           H        GLN   7   3.639  -0.118  -1.411
   42    HA   GLN   7           HA       GLN   7   5.816   1.749  -1.753
   43    HB2  GLN   7          2HB       GLN   7   5.784  -0.540  -2.791
   44    HB3  GLN   7          1HB       GLN   7   4.459  -0.000  -3.805
   45    HG2  GLN   7          2HG       GLN   7   5.906   1.683  -4.817
   46    HG3  GLN   7          1HG       GLN   7   7.227   1.177  -3.775
   47   HE21  GLN   7          1HE2      GLN   7   4.967  -1.018  -5.267
   48   HE22  GLN   7          2HE2      GLN   7   6.101  -1.754  -6.333
   49    H    ASP   8           H        ASP   8   2.430   1.715  -2.056
   50    HA   ASP   8           HA       ASP   8   2.561   4.210  -3.578
   51    HB2  ASP   8          2HB       ASP   8   0.401   2.116  -3.579
   52    HB3  ASP   8          1HB       ASP   8   0.082   3.771  -4.080
   53    HA   PRO   9           HA       PRO   9   1.445   5.865   0.421
   54    HB2  PRO   9          2HB       PRO   9   1.215   8.284  -1.303
   55    HB3  PRO   9          1HB       PRO   9   2.057   8.090   0.241
   56    HG2  PRO   9          2HG       PRO   9   3.416   8.202  -2.030
   57    HG3  PRO   9          1HG       PRO   9   3.888   7.066  -0.755
   58    HD2  PRO   9          2HD       PRO   9   2.435   6.543  -3.312
   59    HD3  PRO   9          1HD       PRO   9   3.659   5.559  -2.480
   60    H    GLU  10           H        GLU  10  -0.248   6.557  -2.621
   61    HA   GLU  10           HA       GLU  10  -2.669   7.484  -1.528
   62    HB2  GLU  10          2HB       GLU  10  -1.990   7.695  -3.904
   63    HB3  GLU  10          1HB       GLU  10  -2.240   5.967  -4.113
   64    HG2  GLU  10          2HG       GLU  10  -4.117   7.140  -5.003
   65    HG3  GLU  10          1HG       GLU  10  -4.626   6.321  -3.527
   66    H    ALA  11           H        ALA  11  -1.608   4.249  -2.500
   67    HA   ALA  11           HA       ALA  11  -4.079   2.959  -1.973
   68    HB1  ALA  11          1HB       ALA  11  -2.418   2.102  -3.573
   69    HB2  ALA  11          2HB       ALA  11  -2.886   0.905  -2.366
   70    HB3  ALA  11          3HB       ALA  11  -1.340   1.741  -2.223
   71    H    ASN  12           H        ASN  12  -1.091   3.333  -0.152
   72    HA   ASN  12           HA       ASN  12  -1.933   1.558   1.929
   73    HB2  ASN  12          2HB       ASN  12   0.447   1.866   1.426
   74    HB3  ASN  12          1HB       ASN  12   0.343   3.546   1.933
   75   HD21  ASN  12          1HD2      ASN  12   0.259   0.232   3.003
   76   HD22  ASN  12          2HD2      ASN  12   0.577   0.548   4.673
   77    H    LYS  13           H        LYS  13  -2.239   4.947   1.379
   78    HA   LYS  13           HA       LYS  13  -2.724   5.894   3.972
   79    HB2  LYS  13          2HB       LYS  13  -2.399   7.360   2.039
   80    HB3  LYS  13          1HB       LYS  13  -3.887   6.755   1.332
   81    HG2  LYS  13          2HG       LYS  13  -5.154   7.765   3.189
   82    HG3  LYS  13          1HG       LYS  13  -3.647   8.406   3.843
   83    HD2  LYS  13          2HD       LYS  13  -4.828  10.121   2.551
   84    HD3  LYS  13          1HD       LYS  13  -3.296   9.690   1.792
   85    HE2  LYS  13          2HE       LYS  13  -4.456   8.274   0.181
   86    HE3  LYS  13          1HE       LYS  13  -5.996   8.595   0.975
   87    HZ1  LYS  13          1HZ       LYS  13  -4.309  10.658  -0.347
   88    HZ2  LYS  13          2HZ       LYS  13  -5.878  10.869   0.243
   89    HZ3  LYS  13          3HZ       LYS  13  -5.583   9.851  -1.067
   90    H    SER  14           H        SER  14  -4.953   4.715   1.502
   91    HA   SER  14           HA       SER  14  -7.141   4.721   3.364
   92    HB2  SER  14          2HB       SER  14  -8.287   3.943   1.159
   93    HB3  SER  14          1HB       SER  14  -7.727   5.614   1.318
   94    HG   SER  14           HG       SER  14  -6.172   3.523   0.200
   95    HA   PRO  15           HA       PRO  15  -6.068   0.430   4.389
   96    HB2  PRO  15          2HB       PRO  15  -8.425  -0.035   5.791
   97    HB3  PRO  15          1HB       PRO  15  -6.939   0.624   6.480
   98    HG2  PRO  15          2HG       PRO  15  -9.385   2.047   5.530
   99    HG3  PRO  15          1HG       PRO  15  -8.367   2.381   6.942
  100    HD2  PRO  15          2HD       PRO  15  -8.210   3.861   4.751
  101    HD3  PRO  15          1HD       PRO  15  -6.749   3.457   5.673
  102    H    GLU  16           H        GLU  16  -9.172   1.408   3.020
  103    HA   GLU  16           HA       GLU  16 -10.071  -1.183   2.341
  104    HB2  GLU  16          2HB       GLU  16 -11.619   0.680   2.479
  105    HB3  GLU  16          1HB       GLU  16 -10.786   1.507   1.175
  106    HG2  GLU  16          2HG       GLU  16 -11.461  -0.233  -0.372
  107    HG3  GLU  16          1HG       GLU  16 -12.274  -1.095   0.928
  108    H    GLU  17           H        GLU  17  -8.234   1.235   0.522
  109    HA   GLU  17           HA       GLU  17  -8.165  -0.247  -1.911
  110    HB2  GLU  17          2HB       GLU  17  -6.262   1.878  -0.908
  111    HB3  GLU  17          1HB       GLU  17  -6.322   1.269  -2.553
  112    HG2  GLU  17          2HG       GLU  17  -8.517   2.752  -1.136
  113    HG3  GLU  17          1HG       GLU  17  -7.427   3.422  -2.344
  114    H    CYS  18           H        CYS  18  -6.033   0.064   0.843
  115    HA   CYS  18           HA       CYS  18  -3.964  -1.556  -0.145
  116    HB2  CYS  18          2HB       CYS  18  -3.753   0.009   1.780
  117    HB3  CYS  18          1HB       CYS  18  -4.723  -1.099   2.742
  118    H    LYS  19           H        LYS  19  -6.981  -2.290   1.488
  119    HA   LYS  19           HA       LYS  19  -6.360  -5.036   1.980
  120    HB2  LYS  19          2HB       LYS  19  -8.002  -3.635   3.280
  121    HB3  LYS  19          1HB       LYS  19  -9.063  -3.692   1.887
  122    HG2  LYS  19          2HG       LYS  19  -9.785  -5.300   3.508
  123    HG3  LYS  19          1HG       LYS  19  -9.145  -6.159   2.103
  124    HD2  LYS  19          2HD       LYS  19  -7.064  -6.575   3.247
  125    HD3  LYS  19          1HD       LYS  19  -7.575  -5.585   4.615
  126    HE2  LYS  19          2HE       LYS  19  -9.437  -7.188   4.977
  127    HE3  LYS  19          1HE       LYS  19  -8.770  -8.192   3.696
  128    HZ1  LYS  19          1HZ       LYS  19  -6.783  -8.528   4.970
  129    HZ2  LYS  19          2HZ       LYS  19  -8.103  -8.875   5.971
  130    HZ3  LYS  19          3HZ       LYS  19  -7.281  -7.429   6.143
  131    H    LYS  20           H        LYS  20  -7.700  -3.171  -0.616
  132    HA   LYS  20           HA       LYS  20  -8.889  -5.294  -2.091
  133    HB2  LYS  20          2HB       LYS  20  -9.414  -2.894  -2.516
  134    HB3  LYS  20          1HB       LYS  20  -7.772  -2.649  -3.066
  135    HG2  LYS  20          2HG       LYS  20  -9.200  -2.814  -4.991
  136    HG3  LYS  20          1HG       LYS  20  -8.170  -4.243  -4.924
  137    HD2  LYS  20          2HD       LYS  20 -10.408  -4.922  -5.516
  138    HD3  LYS  20          1HD       LYS  20 -10.073  -5.488  -3.882
  139    HE2  LYS  20          2HE       LYS  20 -11.266  -3.550  -2.982
  140    HE3  LYS  20          1HE       LYS  20 -11.618  -3.006  -4.620
  141    HZ1  LYS  20          1HZ       LYS  20 -12.899  -5.067  -4.935
  142    HZ2  LYS  20          2HZ       LYS  20 -13.489  -4.124  -3.679
  143    HZ3  LYS  20          3HZ       LYS  20 -12.589  -5.499  -3.330
  144    H    LEU  21           H        LEU  21  -5.750  -3.738  -2.039
  145    HA   LEU  21           HA       LEU  21  -4.557  -5.277  -4.097
  146    HB2  LEU  21          2HB       LEU  21  -3.248  -3.914  -1.741
  147    HB3  LEU  21          1HB       LEU  21  -2.416  -4.498  -3.164
  148    HG   LEU  21           HG       LEU  21  -4.384  -2.215  -3.048
  149   HD11  LEU  21          1HD1      LEU  21  -2.240  -1.664  -2.100
  150   HD12  LEU  21          2HD1      LEU  21  -2.444  -0.857  -3.657
  151   HD13  LEU  21          3HD1      LEU  21  -1.419  -2.285  -3.531
  152   HD21  LEU  21          1HD2      LEU  21  -2.861  -3.329  -5.406
  153   HD22  LEU  21          2HD2      LEU  21  -3.799  -1.837  -5.406
  154   HD23  LEU  21          3HD2      LEU  21  -4.610  -3.383  -5.173
  155    H    LYS  22           H        LYS  22  -3.314  -7.121  -3.974
  156    HA   LYS  22           HA       LYS  22  -3.804  -8.722  -1.577
  157    HB2  LYS  22          2HB       LYS  22  -3.332 -10.680  -3.014
  158    HB3  LYS  22          1HB       LYS  22  -4.687  -9.719  -3.580
  159    HG2  LYS  22          2HG       LYS  22  -3.204  -8.688  -5.262
  160    HG3  LYS  22          1HG       LYS  22  -1.897  -9.739  -4.710
  161    HD2  LYS  22          2HD       LYS  22  -3.238 -11.698  -5.274
  162    HD3  LYS  22          1HD       LYS  22  -4.545 -10.651  -5.820
  163    HE2  LYS  22          2HE       LYS  22  -3.087  -9.718  -7.538
  164    HE3  LYS  22          1HE       LYS  22  -1.771 -10.764  -7.001
  165    HZ1  LYS  22          1HZ       LYS  22  -4.374 -11.643  -8.081
  166    HZ2  LYS  22          2HZ       LYS  22  -3.165 -12.678  -7.580
  167    HZ3  LYS  22          3HZ       LYS  22  -2.917 -11.661  -8.926
  Start of MODEL   17
    1    H    ASN   1           H        ASN   1  -1.579  -7.130  -2.901
    2    HA   ASN   1           HA       ASN   1   0.918  -8.598  -2.461
    3    HB2  ASN   1          2HB       ASN   1   0.265  -6.261  -4.263
    4    HB3  ASN   1          1HB       ASN   1   1.912  -6.785  -3.953
    5   HD21  ASN   1          1HD2      ASN   1   0.333  -6.646  -6.399
    6   HD22  ASN   1          2HD2      ASN   1   0.401  -8.210  -7.101
    7    HA   PRO   2           HA       PRO   2   1.010  -5.720   1.075
    8    HB2  PRO   2          2HB       PRO   2   3.304  -6.826   2.172
    9    HB3  PRO   2          1HB       PRO   2   1.663  -7.370   2.522
   10    HG2  PRO   2          2HG       PRO   2   3.690  -8.521   0.673
   11    HG3  PRO   2          1HG       PRO   2   2.496  -9.350   1.683
   12    HD2  PRO   2          2HD       PRO   2   2.201  -9.044  -0.975
   13    HD3  PRO   2          1HD       PRO   2   0.814  -9.077   0.128
   14    H    GLU   3           H        GLU   3   4.004  -6.736  -0.508
   15    HA   GLU   3           HA       GLU   3   5.545  -4.485   0.018
   16    HB2  GLU   3          2HB       GLU   3   6.902  -5.261  -1.953
   17    HB3  GLU   3          1HB       GLU   3   6.620  -6.467  -0.706
   18    HG2  GLU   3          2HG       GLU   3   4.874  -7.477  -2.053
   19    HG3  GLU   3          1HG       GLU   3   5.090  -6.235  -3.283
   20    H    ASP   4           H        ASP   4   3.373  -5.138  -2.643
   21    HA   ASP   4           HA       ASP   4   4.042  -2.845  -4.190
   22    HB2  ASP   4          2HB       ASP   4   2.978  -4.739  -5.257
   23    HB3  ASP   4          1HB       ASP   4   1.588  -4.592  -4.188
   24    H    CYS   5           H        CYS   5   1.463  -3.574  -1.887
   25    HA   CYS   5           HA       CYS   5   0.221  -1.063  -2.033
   26    HB2  CYS   5          2HB       CYS   5  -0.937  -2.951  -1.018
   27    HB3  CYS   5          1HB       CYS   5   0.287  -3.064   0.243
   28    H    ARG   6           H        ARG   6   2.974  -2.219  -0.182
   29    HA   ARG   6           HA       ARG   6   3.127   0.079   1.457
   30    HB2  ARG   6          2HB       ARG   6   4.132  -2.121   2.065
   31    HB3  ARG   6          1HB       ARG   6   5.328  -1.891   0.803
   32    HG2  ARG   6          2HG       ARG   6   6.239  -1.340   3.001
   33    HG3  ARG   6          1HG       ARG   6   6.188   0.081   1.951
   34    HD2  ARG   6          2HD       ARG   6   4.097   0.784   3.016
   35    HD3  ARG   6          1HD       ARG   6   4.173  -0.615   4.084
   36    HE   ARG   6           HE       ARG   6   6.388   0.449   4.772
   37   HH11  ARG   6          1HH1      ARG   6   3.542   2.280   3.757
   38   HH12  ARG   6          2HH1      ARG   6   3.794   3.572   4.836
   39   HH21  ARG   6          1HH2      ARG   6   6.764   2.301   6.272
   40   HH22  ARG   6          2HH2      ARG   6   5.646   3.590   6.290
   41    H    GLN   7           H        GLN   7   4.084  -0.625  -1.735
   42    HA   GLN   7           HA       GLN   7   6.152   1.329  -1.974
   43    HB2  GLN   7          2HB       GLN   7   6.033  -0.669  -3.433
   44    HB3  GLN   7          1HB       GLN   7   4.516  -0.090  -4.091
   45    HG2  GLN   7          2HG       GLN   7   6.339   0.321  -5.624
   46    HG3  GLN   7          1HG       GLN   7   5.647   1.833  -5.049
   47   HE21  GLN   7          1HE2      GLN   7   7.861  -0.116  -3.108
   48   HE22  GLN   7          2HE2      GLN   7   9.178   0.982  -3.224
   49    H    ASP   8           H        ASP   8   2.719   1.290  -2.172
   50    HA   ASP   8           HA       ASP   8   2.671   3.914  -3.402
   51    HB2  ASP   8          2HB       ASP   8   0.525   1.894  -2.896
   52    HB3  ASP   8          1HB       ASP   8   0.123   3.575  -3.219
   53    HA   PRO   9           HA       PRO   9   1.983   5.819   0.606
   54    HB2  PRO   9          2HB       PRO   9   1.404   8.191  -1.052
   55    HB3  PRO   9          1HB       PRO   9   2.636   7.991   0.196
   56    HG2  PRO   9          2HG       PRO   9   3.283   8.144  -2.388
   57    HG3  PRO   9          1HG       PRO   9   4.158   7.083  -1.266
   58    HD2  PRO   9          2HD       PRO   9   2.054   6.398  -3.277
   59    HD3  PRO   9          1HD       PRO   9   3.573   5.556  -2.882
   60    H    GLU  10           H        GLU  10   0.012   5.333  -2.041
   61    HA   GLU  10           HA       GLU  10  -2.355   6.753  -1.567
   62    HB2  GLU  10          2HB       GLU  10  -1.528   5.174  -3.531
   63    HB3  GLU  10          1HB       GLU  10  -2.454   3.977  -2.638
   64    HG2  GLU  10          2HG       GLU  10  -3.903   4.843  -4.263
   65    HG3  GLU  10          1HG       GLU  10  -4.388   5.590  -2.741
   66    H    ALA  11           H        ALA  11  -1.061   3.861  -0.127
   67    HA   ALA  11           HA       ALA  11  -3.435   2.852   1.034
   68    HB1  ALA  11          1HB       ALA  11  -1.437   1.490   0.656
   69    HB2  ALA  11          2HB       ALA  11  -1.969   1.431   2.337
   70    HB3  ALA  11          3HB       ALA  11  -0.584   2.424   1.884
   71    H    ASN  12           H        ASN  12  -1.386   5.467   1.918
   72    HA   ASN  12           HA       ASN  12  -2.127   5.482   4.714
   73    HB2  ASN  12          2HB       ASN  12   0.030   6.458   3.969
   74    HB3  ASN  12          1HB       ASN  12  -0.840   7.643   3.003
   75   HD21  ASN  12          1HD2      ASN  12   0.078   9.361   4.100
   76   HD22  ASN  12          2HD2      ASN  12  -0.373   9.764   5.721
   77    H    LYS  13           H        LYS  13  -3.335   6.575   1.748
   78    HA   LYS  13           HA       LYS  13  -5.131   8.565   2.862
   79    HB2  LYS  13          2HB       LYS  13  -3.950   8.888   0.710
   80    HB3  LYS  13          1HB       LYS  13  -4.799   7.504   0.053
   81    HG2  LYS  13          2HG       LYS  13  -6.941   8.741   0.443
   82    HG3  LYS  13          1HG       LYS  13  -5.970  10.153   0.870
   83    HD2  LYS  13          2HD       LYS  13  -5.808   8.666  -1.753
   84    HD3  LYS  13          1HD       LYS  13  -6.690  10.170  -1.505
   85    HE2  LYS  13          2HE       LYS  13  -4.662  11.356  -1.064
   86    HE3  LYS  13          1HE       LYS  13  -3.730   9.863  -1.015
   87    HZ1  LYS  13          1HZ       LYS  13  -5.149  10.851  -3.418
   88    HZ2  LYS  13          2HZ       LYS  13  -4.092   9.526  -3.302
   89    HZ3  LYS  13          3HZ       LYS  13  -3.510  11.095  -3.107
   90    H    SER  14           H        SER  14  -5.398   5.616   0.841
   91    HA   SER  14           HA       SER  14  -7.855   4.973   2.241
   92    HB2  SER  14          2HB       SER  14  -8.511   4.014  -0.107
   93    HB3  SER  14          1HB       SER  14  -8.722   5.732   0.235
   94    HG   SER  14           HG       SER  14  -7.109   4.522  -1.623
   95    HA   PRO  15           HA       PRO  15  -5.306   1.220   2.529
   96    HB2  PRO  15          2HB       PRO  15  -6.157   0.432   4.959
   97    HB3  PRO  15          1HB       PRO  15  -4.952   1.708   4.759
   98    HG2  PRO  15          2HG       PRO  15  -7.855   1.927   5.395
   99    HG3  PRO  15          1HG       PRO  15  -6.503   2.903   5.983
  100    HD2  PRO  15          2HD       PRO  15  -8.257   3.640   3.958
  101    HD3  PRO  15          1HD       PRO  15  -6.653   4.349   4.222
  102    H    GLU  16           H        GLU  16  -8.643   1.767   2.469
  103    HA   GLU  16           HA       GLU  16  -9.687  -0.808   2.854
  104    HB2  GLU  16          2HB       GLU  16 -11.055   1.225   2.873
  105    HB3  GLU  16          1HB       GLU  16 -10.761   1.451   1.160
  106    HG2  GLU  16          2HG       GLU  16 -11.971  -0.603   0.676
  107    HG3  GLU  16          1HG       GLU  16 -12.241  -0.852   2.402
  108    H    GLU  17           H        GLU  17  -8.566   0.832  -0.090
  109    HA   GLU  17           HA       GLU  17  -9.138  -1.416  -1.721
  110    HB2  GLU  17          2HB       GLU  17  -7.923  -0.230  -3.484
  111    HB3  GLU  17          1HB       GLU  17  -9.082   0.820  -2.690
  112    HG2  GLU  17          2HG       GLU  17  -7.229   1.786  -1.368
  113    HG3  GLU  17          1HG       GLU  17  -6.114   0.766  -2.282
  114    H    CYS  18           H        CYS  18  -6.535  -0.585   0.344
  115    HA   CYS  18           HA       CYS  18  -4.607  -2.333  -0.836
  116    HB2  CYS  18          2HB       CYS  18  -3.907  -0.497   0.704
  117    HB3  CYS  18          1HB       CYS  18  -4.730  -1.319   2.021
  118    H    LYS  19           H        LYS  19  -7.147  -2.626   1.552
  119    HA   LYS  19           HA       LYS  19  -6.594  -5.293   2.347
  120    HB2  LYS  19          2HB       LYS  19  -9.242  -3.854   2.193
  121    HB3  LYS  19          1HB       LYS  19  -8.964  -5.383   3.014
  122    HG2  LYS  19          2HG       LYS  19  -7.460  -4.271   4.578
  123    HG3  LYS  19          1HG       LYS  19  -7.714  -2.738   3.740
  124    HD2  LYS  19          2HD       LYS  19  -9.101  -2.880   5.753
  125    HD3  LYS  19          1HD       LYS  19 -10.103  -2.836   4.303
  126    HE2  LYS  19          2HE       LYS  19 -10.379  -5.265   4.411
  127    HE3  LYS  19          1HE       LYS  19  -9.341  -5.323   5.835
  128    HZ1  LYS  19          1HZ       LYS  19 -11.659  -5.439   6.367
  129    HZ2  LYS  19          2HZ       LYS  19 -11.960  -3.960   5.625
  130    HZ3  LYS  19          3HZ       LYS  19 -10.978  -4.032   7.024
  131    H    LYS  20           H        LYS  20  -8.181  -3.890  -0.366
  132    HA   LYS  20           HA       LYS  20  -9.373  -6.230  -1.458
  133    HB2  LYS  20          2HB       LYS  20 -10.130  -3.996  -2.062
  134    HB3  LYS  20          1HB       LYS  20  -8.547  -3.604  -2.692
  135    HG2  LYS  20          2HG       LYS  20  -8.842  -5.170  -4.509
  136    HG3  LYS  20          1HG       LYS  20 -10.400  -5.677  -3.849
  137    HD2  LYS  20          2HD       LYS  20 -11.227  -3.386  -4.079
  138    HD3  LYS  20          1HD       LYS  20  -9.683  -2.901  -4.766
  139    HE2  LYS  20          2HE       LYS  20 -10.017  -4.333  -6.665
  140    HE3  LYS  20          1HE       LYS  20 -11.487  -5.000  -5.959
  141    HZ1  LYS  20          1HZ       LYS  20 -11.931  -3.299  -7.648
  142    HZ2  LYS  20          2HZ       LYS  20 -11.119  -2.151  -6.737
  143    HZ3  LYS  20          3HZ       LYS  20 -12.536  -2.843  -6.147
  144    H    LEU  21           H        LEU  21  -6.345  -4.515  -1.953
  145    HA   LEU  21           HA       LEU  21  -5.233  -6.229  -3.925
  146    HB2  LEU  21          2HB       LEU  21  -3.897  -4.442  -1.906
  147    HB3  LEU  21          1HB       LEU  21  -3.092  -5.177  -3.270
  148    HG   LEU  21           HG       LEU  21  -5.277  -3.104  -3.409
  149   HD11  LEU  21          1HD1      LEU  21  -2.324  -2.953  -3.941
  150   HD12  LEU  21          2HD1      LEU  21  -3.188  -2.206  -2.595
  151   HD13  LEU  21          3HD1      LEU  21  -3.487  -1.667  -4.248
  152   HD21  LEU  21          1HD2      LEU  21  -5.369  -4.614  -5.332
  153   HD22  LEU  21          2HD2      LEU  21  -3.643  -4.383  -5.606
  154   HD23  LEU  21          3HD2      LEU  21  -4.753  -3.032  -5.809
  155    H    LYS  22           H        LYS  22  -3.349  -7.628  -3.559
  156    HA   LYS  22           HA       LYS  22  -3.273  -8.724  -0.860
  157    HB2  LYS  22          2HB       LYS  22  -3.149 -11.032  -1.716
  158    HB3  LYS  22          1HB       LYS  22  -4.683 -10.260  -2.058
  159    HG2  LYS  22          2HG       LYS  22  -3.959  -9.909  -4.381
  160    HG3  LYS  22          1HG       LYS  22  -2.434 -10.726  -4.009
  161    HD2  LYS  22          2HD       LYS  22  -3.676 -12.742  -3.358
  162    HD3  LYS  22          1HD       LYS  22  -5.188 -11.927  -3.744
  163    HE2  LYS  22          2HE       LYS  22  -4.504 -11.763  -6.082
  164    HE3  LYS  22          1HE       LYS  22  -2.975 -12.550  -5.694
  165    HZ1  LYS  22          1HZ       LYS  22  -4.587 -14.099  -6.616
  166    HZ2  LYS  22          2HZ       LYS  22  -5.665 -13.763  -5.375
  167    HZ3  LYS  22          3HZ       LYS  22  -4.202 -14.522  -5.031
  Start of MODEL   18
    1    H    ASN   1           H        ASN   1  -1.312  -7.562  -2.683
    2    HA   ASN   1           HA       ASN   1   0.180  -8.985  -0.577
    3    HB2  ASN   1          2HB       ASN   1   1.209  -7.831  -3.181
    4    HB3  ASN   1          1HB       ASN   1   2.255  -8.411  -1.898
    5   HD21  ASN   1          1HD2      ASN   1   1.984  -9.296  -4.640
    6   HD22  ASN   1          2HD2      ASN   1   1.595 -10.966  -4.603
    7    HA   PRO   2           HA       PRO   2  -0.122  -4.837   1.309
    8    HB2  PRO   2          2HB       PRO   2   1.557  -6.384   3.236
    9    HB3  PRO   2          1HB       PRO   2   0.207  -5.283   3.554
   10    HG2  PRO   2          2HG       PRO   2  -0.190  -7.879   3.692
   11    HG3  PRO   2          1HG       PRO   2  -1.390  -6.847   2.888
   12    HD2  PRO   2          2HD       PRO   2   0.664  -8.655   1.695
   13    HD3  PRO   2          1HD       PRO   2  -1.007  -8.343   1.178
   14    H    GLU   3           H        GLU   3   2.804  -6.803   1.006
   15    HA   GLU   3           HA       GLU   3   4.698  -4.773   1.487
   16    HB2  GLU   3          2HB       GLU   3   5.114  -7.249   1.469
   17    HB3  GLU   3          1HB       GLU   3   5.000  -7.209  -0.280
   18    HG2  GLU   3          2HG       GLU   3   7.300  -7.267   0.411
   19    HG3  GLU   3          1HG       GLU   3   6.943  -5.718  -0.350
   20    H    ASP   4           H        ASP   4   3.122  -5.910  -1.440
   21    HA   ASP   4           HA       ASP   4   4.580  -4.152  -3.195
   22    HB2  ASP   4          2HB       ASP   4   3.687  -6.362  -3.908
   23    HB3  ASP   4          1HB       ASP   4   2.062  -5.731  -3.707
   24    H    CYS   5           H        CYS   5   1.659  -4.113  -1.405
   25    HA   CYS   5           HA       CYS   5   0.314  -1.980  -2.650
   26    HB2  CYS   5          2HB       CYS   5  -0.785  -3.553  -1.091
   27    HB3  CYS   5          1HB       CYS   5   0.191  -2.927   0.226
   28    H    ARG   6           H        ARG   6   2.995  -2.097  -0.483
   29    HA   ARG   6           HA       ARG   6   2.784   0.568   0.516
   30    HB2  ARG   6          2HB       ARG   6   5.220  -1.216   0.396
   31    HB3  ARG   6          1HB       ARG   6   5.065   0.249   1.347
   32    HG2  ARG   6          2HG       ARG   6   3.499  -2.297   1.718
   33    HG3  ARG   6          1HG       ARG   6   4.813  -1.711   2.734
   34    HD2  ARG   6          2HD       ARG   6   2.156  -0.333   2.324
   35    HD3  ARG   6          1HD       ARG   6   2.619  -1.292   3.723
   36    HE   ARG   6           HE       ARG   6   4.512   0.730   3.344
   37   HH11  ARG   6          1HH1      ARG   6   1.160   0.303   4.424
   38   HH12  ARG   6          2HH1      ARG   6   1.169   1.708   5.399
   39   HH21  ARG   6          1HH2      ARG   6   4.504   2.631   4.718
   40   HH22  ARG   6          2HH2      ARG   6   3.086   3.030   5.583
   41    H    GLN   7           H        GLN   7   3.407  -0.450  -2.542
   42    HA   GLN   7           HA       GLN   7   5.487   1.444  -3.157
   43    HB2  GLN   7          2HB       GLN   7   5.265  -0.711  -4.389
   44    HB3  GLN   7          1HB       GLN   7   3.731  -0.155  -5.034
   45    HG2  GLN   7          2HG       GLN   7   4.869   1.679  -6.180
   46    HG3  GLN   7          1HG       GLN   7   6.409   1.134  -5.527
   47   HE21  GLN   7          1HE2      GLN   7   5.740  -1.714  -5.900
   48   HE22  GLN   7          2HE2      GLN   7   5.870  -1.978  -7.596
   49    H    ASP   8           H        ASP   8   2.023   1.401  -3.016
   50    HA   ASP   8           HA       ASP   8   1.958   3.941  -4.431
   51    HB2  ASP   8          2HB       ASP   8  -0.206   1.881  -3.998
   52    HB3  ASP   8          1HB       ASP   8  -0.576   3.523  -4.499
   53    HA   PRO   9           HA       PRO   9   1.177   5.803  -0.555
   54    HB2  PRO   9          2HB       PRO   9   0.652   8.278  -1.281
   55    HB3  PRO   9          1HB       PRO   9   2.207   7.535  -1.679
   56    HG2  PRO   9          2HG       PRO   9  -0.171   7.992  -3.425
   57    HG3  PRO   9          1HG       PRO   9   1.548   8.163  -3.811
   58    HD2  PRO   9          2HD       PRO   9  -0.053   5.938  -4.395
   59    HD3  PRO   9          1HD       PRO   9   1.726   5.971  -4.399
   60    H    GLU  10           H        GLU  10  -1.528   4.997  -2.401
   61    HA   GLU  10           HA       GLU  10  -3.311   6.823  -1.038
   62    HB2  GLU  10          2HB       GLU  10  -3.639   6.062  -3.439
   63    HB3  GLU  10          1HB       GLU  10  -4.090   4.492  -2.797
   64    HG2  GLU  10          2HG       GLU  10  -6.000   5.424  -1.700
   65    HG3  GLU  10          1HG       GLU  10  -5.494   7.061  -2.117
   66    H    ALA  11           H        ALA  11  -2.076   3.699  -0.662
   67    HA   ALA  11           HA       ALA  11  -3.788   2.671   1.312
   68    HB1  ALA  11          1HB       ALA  11  -1.902   1.241   1.910
   69    HB2  ALA  11          2HB       ALA  11  -0.818   2.276   0.980
   70    HB3  ALA  11          3HB       ALA  11  -2.076   1.354   0.159
   71    H    ASN  12           H        ASN  12  -1.745   5.348   1.404
   72    HA   ASN  12           HA       ASN  12  -1.346   5.302   4.285
   73    HB2  ASN  12          2HB       ASN  12  -0.577   7.363   2.207
   74    HB3  ASN  12          1HB       ASN  12  -0.227   7.510   3.922
   75   HD21  ASN  12          1HD2      ASN  12   1.331   6.149   4.834
   76   HD22  ASN  12          2HD2      ASN  12   2.488   5.323   3.854
   77    H    LYS  13           H        LYS  13  -3.752   6.140   2.200
   78    HA   LYS  13           HA       LYS  13  -4.803   8.297   3.886
   79    HB2  LYS  13          2HB       LYS  13  -5.691   7.232   1.198
   80    HB3  LYS  13          1HB       LYS  13  -6.557   8.467   2.092
   81    HG2  LYS  13          2HG       LYS  13  -3.712   8.737   1.142
   82    HG3  LYS  13          1HG       LYS  13  -5.121   9.345   0.270
   83    HD2  LYS  13          2HD       LYS  13  -5.687  10.762   2.201
   84    HD3  LYS  13          1HD       LYS  13  -4.257  10.172   3.049
   85    HE2  LYS  13          2HE       LYS  13  -2.830  11.093   1.338
   86    HE3  LYS  13          1HE       LYS  13  -4.229  11.633   0.409
   87    HZ1  LYS  13          1HZ       LYS  13  -4.782  13.127   2.251
   88    HZ2  LYS  13          2HZ       LYS  13  -3.245  13.427   1.654
   89    HZ3  LYS  13          3HZ       LYS  13  -3.425  12.608   3.105
   90    H    SER  14           H        SER  14  -5.624   5.122   2.578
   91    HA   SER  14           HA       SER  14  -7.231   4.558   4.885
   92    HB2  SER  14          2HB       SER  14  -9.150   3.861   3.367
   93    HB3  SER  14          1HB       SER  14  -8.890   5.603   3.464
   94    HG   SER  14           HG       SER  14  -8.598   5.592   1.420
   95    HA   PRO  15           HA       PRO  15  -5.492   0.535   3.965
   96    HB2  PRO  15          2HB       PRO  15  -7.351  -1.167   4.931
   97    HB3  PRO  15          1HB       PRO  15  -6.378  -0.144   5.995
   98    HG2  PRO  15          2HG       PRO  15  -9.167   0.296   4.998
   99    HG3  PRO  15          1HG       PRO  15  -8.536   0.456   6.649
  100    HD2  PRO  15          2HD       PRO  15  -8.897   2.590   5.050
  101    HD3  PRO  15          1HD       PRO  15  -7.555   2.502   6.210
  102    H    GLU  16           H        GLU  16  -8.182   1.655   2.409
  103    HA   GLU  16           HA       GLU  16  -9.450  -0.452   1.162
  104    HB2  GLU  16          2HB       GLU  16 -10.018   2.044   1.145
  105    HB3  GLU  16          1HB       GLU  16  -8.889   2.174  -0.184
  106    HG2  GLU  16          2HG       GLU  16 -11.157   2.007  -0.997
  107    HG3  GLU  16          1HG       GLU  16 -10.210   0.596  -1.479
  108    H    GLU  17           H        GLU  17  -6.597   1.343   0.051
  109    HA   GLU  17           HA       GLU  17  -6.300  -0.070  -2.340
  110    HB2  GLU  17          2HB       GLU  17  -5.299   2.120  -2.003
  111    HB3  GLU  17          1HB       GLU  17  -4.266   1.487  -0.736
  112    HG2  GLU  17          2HG       GLU  17  -2.941   0.305  -2.274
  113    HG3  GLU  17          1HG       GLU  17  -4.134   0.489  -3.560
  114    H    CYS  18           H        CYS  18  -5.018  -0.738   0.885
  115    HA   CYS  18           HA       CYS  18  -3.588  -3.018  -0.145
  116    HB2  CYS  18          2HB       CYS  18  -3.955  -2.053   2.693
  117    HB3  CYS  18          1HB       CYS  18  -3.072  -3.517   2.282
  118    H    LYS  19           H        LYS  19  -6.751  -2.437   0.733
  119    HA   LYS  19           HA       LYS  19  -7.361  -5.247   1.205
  120    HB2  LYS  19          2HB       LYS  19  -9.161  -2.853   0.722
  121    HB3  LYS  19          1HB       LYS  19  -9.747  -4.477   1.020
  122    HG2  LYS  19          2HG       LYS  19  -8.134  -2.813   2.946
  123    HG3  LYS  19          1HG       LYS  19  -9.878  -3.072   3.013
  124    HD2  LYS  19          2HD       LYS  19  -9.483  -5.489   3.269
  125    HD3  LYS  19          1HD       LYS  19  -7.745  -5.186   3.256
  126    HE2  LYS  19          2HE       LYS  19  -7.993  -3.781   5.247
  127    HE3  LYS  19          1HE       LYS  19  -9.719  -4.135   5.273
  128    HZ1  LYS  19          1HZ       LYS  19  -7.528  -6.108   5.585
  129    HZ2  LYS  19          2HZ       LYS  19  -9.170  -6.486   5.551
  130    HZ3  LYS  19          3HZ       LYS  19  -8.551  -5.567   6.810
  131    H    LYS  20           H        LYS  20  -6.984  -3.054  -1.330
  132    HA   LYS  20           HA       LYS  20  -8.458  -4.538  -3.310
  133    HB2  LYS  20          2HB       LYS  20  -8.040  -1.977  -3.238
  134    HB3  LYS  20          1HB       LYS  20  -6.429  -2.364  -3.779
  135    HG2  LYS  20          2HG       LYS  20  -7.776  -1.727  -5.674
  136    HG3  LYS  20          1HG       LYS  20  -7.348  -3.436  -5.792
  137    HD2  LYS  20          2HD       LYS  20  -9.693  -3.065  -6.381
  138    HD3  LYS  20          1HD       LYS  20  -9.560  -4.057  -4.931
  139    HE2  LYS  20          2HE       LYS  20  -9.960  -2.010  -3.561
  140    HE3  LYS  20          1HE       LYS  20 -10.177  -1.106  -5.061
  141    HZ1  LYS  20          1HZ       LYS  20 -11.831  -3.360  -4.099
  142    HZ2  LYS  20          2HZ       LYS  20 -12.042  -2.564  -5.570
  143    HZ3  LYS  20          3HZ       LYS  20 -12.264  -1.724  -4.113
  144    H    LEU  21           H        LEU  21  -5.102  -3.705  -2.622
  145    HA   LEU  21           HA       LEU  21  -4.087  -5.670  -4.451
  146    HB2  LEU  21          2HB       LEU  21  -2.805  -3.709  -2.563
  147    HB3  LEU  21          1HB       LEU  21  -1.859  -4.953  -3.346
  148    HG   LEU  21           HG       LEU  21  -2.428  -3.999  -5.554
  149   HD11  LEU  21          1HD1      LEU  21  -3.827  -1.838  -4.006
  150   HD12  LEU  21          2HD1      LEU  21  -4.587  -3.026  -5.073
  151   HD13  LEU  21          3HD1      LEU  21  -3.468  -1.827  -5.732
  152   HD21  LEU  21          1HD2      LEU  21  -0.421  -3.266  -4.381
  153   HD22  LEU  21          2HD2      LEU  21  -1.366  -1.954  -3.650
  154   HD23  LEU  21          3HD2      LEU  21  -1.116  -1.994  -5.390
  155    H    LYS  22           H        LYS  22  -3.330  -7.624  -3.945
  156    HA   LYS  22           HA       LYS  22  -4.214  -8.601  -1.379
  157    HB2  LYS  22          2HB       LYS  22  -3.184 -10.064  -3.803
  158    HB3  LYS  22          1HB       LYS  22  -3.730 -10.847  -2.325
  159    HG2  LYS  22          2HG       LYS  22  -5.955  -9.925  -2.618
  160    HG3  LYS  22          1HG       LYS  22  -5.427  -9.061  -4.061
  161    HD2  LYS  22          2HD       LYS  22  -4.984 -11.156  -5.187
  162    HD3  LYS  22          1HD       LYS  22  -5.399 -12.058  -3.731
  163    HE2  LYS  22          2HE       LYS  22  -7.275 -10.283  -5.305
  164    HE3  LYS  22          1HE       LYS  22  -7.231 -12.040  -5.382
  165    HZ1  LYS  22          1HZ       LYS  22  -9.003 -11.264  -3.910
  166    HZ2  LYS  22          2HZ       LYS  22  -7.910 -10.423  -2.979
  167    HZ3  LYS  22          3HZ       LYS  22  -7.850 -12.099  -3.014
  Start of MODEL   19
    1    H    ASN   1           H        ASN   1  -1.959  -6.659  -1.869
    2    HA   ASN   1           HA       ASN   1   0.689  -7.914  -2.003
    3    HB2  ASN   1          2HB       ASN   1  -0.311  -5.626  -3.722
    4    HB3  ASN   1          1HB       ASN   1   1.353  -6.179  -3.664
    5   HD21  ASN   1          1HD2      ASN   1  -0.616  -6.013  -5.821
    6   HD22  ASN   1          2HD2      ASN   1  -0.676  -7.582  -6.534
    7    HA   PRO   2           HA       PRO   2   0.261  -4.792   1.364
    8    HB2  PRO   2          2HB       PRO   2   2.135  -5.906   3.003
    9    HB3  PRO   2          1HB       PRO   2   0.440  -6.395   2.975
   10    HG2  PRO   2          2HG       PRO   2   2.797  -7.675   1.649
   11    HG3  PRO   2          1HG       PRO   2   1.446  -8.438   2.505
   12    HD2  PRO   2          2HD       PRO   2   1.574  -8.341  -0.176
   13    HD3  PRO   2          1HD       PRO   2   0.026  -8.240   0.688
   14    H    GLU   3           H        GLU   3   3.215  -5.996  -0.130
   15    HA   GLU   3           HA       GLU   3   4.782  -3.785   0.806
   16    HB2  GLU   3          2HB       GLU   3   5.393  -5.841  -1.332
   17    HB3  GLU   3          1HB       GLU   3   6.519  -4.653  -0.716
   18    HG2  GLU   3          2HG       GLU   3   5.221  -6.798   0.931
   19    HG3  GLU   3          1HG       GLU   3   6.862  -6.847   0.285
   20    H    ASP   4           H        ASP   4   2.985  -4.622  -2.042
   21    HA   ASP   4           HA       ASP   4   3.934  -2.441  -3.606
   22    HB2  ASP   4          2HB       ASP   4   2.909  -4.420  -4.663
   23    HB3  ASP   4          1HB       ASP   4   1.369  -4.014  -3.911
   24    H    CYS   5           H        CYS   5   1.203  -2.909  -1.432
   25    HA   CYS   5           HA       CYS   5  -0.087  -0.445  -1.672
   26    HB2  CYS   5          2HB       CYS   5   0.473  -1.949   0.882
   27    HB3  CYS   5          1HB       CYS   5  -0.678  -0.639   0.711
   28    H    ARG   6           H        ARG   6   2.931  -1.275  -0.062
   29    HA   ARG   6           HA       ARG   6   3.082   1.294   1.218
   30    HB2  ARG   6          2HB       ARG   6   3.999  -0.732   2.311
   31    HB3  ARG   6          1HB       ARG   6   5.187  -0.865   1.020
   32    HG2  ARG   6          2HG       ARG   6   6.138   1.276   1.645
   33    HG3  ARG   6          1HG       ARG   6   4.925   1.456   2.909
   34    HD2  ARG   6          2HD       ARG   6   5.815  -0.534   4.027
   35    HD3  ARG   6          1HD       ARG   6   7.040  -0.689   2.764
   36    HE   ARG   6           HE       ARG   6   6.926   1.858   4.064
   37   HH11  ARG   6          1HH1      ARG   6   8.408  -1.369   4.181
   38   HH12  ARG   6          2HH1      ARG   6   9.789  -0.834   5.015
   39   HH21  ARG   6          1HH2      ARG   6   8.896   2.559   5.172
   40   HH22  ARG   6          2HH2      ARG   6  10.089   1.395   5.552
   41    H    GLN   7           H        GLN   7   4.149  -0.195  -1.677
   42    HA   GLN   7           HA       GLN   7   6.195   1.642  -2.353
   43    HB2  GLN   7          2HB       GLN   7   6.020  -0.620  -3.304
   44    HB3  GLN   7          1HB       GLN   7   4.547  -0.157  -4.135
   45    HG2  GLN   7          2HG       GLN   7   5.753   1.399  -5.513
   46    HG3  GLN   7          1HG       GLN   7   7.234   1.108  -4.605
   47   HE21  GLN   7          1HE2      GLN   7   6.815  -1.775  -4.413
   48   HE22  GLN   7          2HE2      GLN   7   7.116  -2.397  -5.983
   49    H    ASP   8           H        ASP   8   2.734   1.590  -2.773
   50    HA   ASP   8           HA       ASP   8   2.859   4.213  -4.078
   51    HB2  ASP   8          2HB       ASP   8   0.523   2.368  -3.534
   52    HB3  ASP   8          1HB       ASP   8   0.324   4.010  -4.121
   53    HA   PRO   9           HA       PRO   9   2.970   5.737   0.150
   54    HB2  PRO   9          2HB       PRO   9   2.280   8.191  -1.399
   55    HB3  PRO   9          1HB       PRO   9   3.462   7.988  -0.099
   56    HG2  PRO   9          2HG       PRO   9   4.283   8.100  -2.604
   57    HG3  PRO   9          1HG       PRO   9   4.992   6.917  -1.493
   58    HD2  PRO   9          2HD       PRO   9   3.018   6.495  -3.690
   59    HD3  PRO   9          1HD       PRO   9   4.328   5.441  -3.122
   60    H    GLU  10           H        GLU  10   0.433   6.855  -2.105
   61    HA   GLU  10           HA       GLU  10  -1.321   7.477   0.071
   62    HB2  GLU  10          2HB       GLU  10  -1.326   8.827  -1.987
   63    HB3  GLU  10          1HB       GLU  10  -1.896   7.437  -2.897
   64    HG2  GLU  10          2HG       GLU  10  -3.982   7.447  -1.684
   65    HG3  GLU  10          1HG       GLU  10  -3.408   8.752  -0.651
   66    H    ALA  11           H        ALA  11  -0.630   4.537  -1.501
   67    HA   ALA  11           HA       ALA  11  -3.280   3.436  -1.330
   68    HB1  ALA  11          1HB       ALA  11  -1.637   2.529  -2.924
   69    HB2  ALA  11          2HB       ALA  11  -2.233   1.284  -1.825
   70    HB3  ALA  11          3HB       ALA  11  -0.637   1.992  -1.574
   71    H    ASN  12           H        ASN  12  -0.921   4.156   0.873
   72    HA   ASN  12           HA       ASN  12  -1.726   2.171   2.845
   73    HB2  ASN  12          2HB       ASN  12   0.095   4.574   3.206
   74    HB3  ASN  12          1HB       ASN  12  -0.146   3.283   4.372
   75   HD21  ASN  12          1HD2      ASN  12   1.440   4.304   1.533
   76   HD22  ASN  12          2HD2      ASN  12   2.448   2.929   1.313
   77    H    LYS  13           H        LYS  13  -2.815   5.155   1.719
   78    HA   LYS  13           HA       LYS  13  -3.844   6.026   4.299
   79    HB2  LYS  13          2HB       LYS  13  -2.822   7.641   2.632
   80    HB3  LYS  13          1HB       LYS  13  -4.218   7.353   1.606
   81    HG2  LYS  13          2HG       LYS  13  -5.688   8.241   3.341
   82    HG3  LYS  13          1HG       LYS  13  -4.295   8.501   4.392
   83    HD2  LYS  13          2HD       LYS  13  -3.351   9.990   2.607
   84    HD3  LYS  13          1HD       LYS  13  -4.892   9.847   1.762
   85    HE2  LYS  13          2HE       LYS  13  -4.499  10.934   4.550
   86    HE3  LYS  13          1HE       LYS  13  -4.746  11.901   3.104
   87    HZ1  LYS  13          1HZ       LYS  13  -6.768  11.688   4.338
   88    HZ2  LYS  13          2HZ       LYS  13  -6.698  10.008   4.307
   89    HZ3  LYS  13          3HZ       LYS  13  -6.952  10.874   2.880
   90    H    SER  14           H        SER  14  -4.872   4.447   1.373
   91    HA   SER  14           HA       SER  14  -7.597   4.523   2.351
   92    HB2  SER  14          2HB       SER  14  -8.039   3.609  -0.016
   93    HB3  SER  14          1HB       SER  14  -7.534   5.293   0.122
   94    HG   SER  14           HG       SER  14  -6.470   3.831  -1.480
   95    HA   PRO  15           HA       PRO  15  -6.250   0.478   3.922
   96    HB2  PRO  15          2HB       PRO  15  -8.952   0.577   5.138
   97    HB3  PRO  15          1HB       PRO  15  -7.395   0.295   5.911
   98    HG2  PRO  15          2HG       PRO  15  -8.638   2.614   6.242
   99    HG3  PRO  15          1HG       PRO  15  -6.880   2.552   6.017
  100    HD2  PRO  15          2HD       PRO  15  -9.011   3.256   4.033
  101    HD3  PRO  15          1HD       PRO  15  -7.440   4.036   4.338
  102    H    GLU  16           H        GLU  16  -9.466   1.209   2.701
  103    HA   GLU  16           HA       GLU  16 -10.361  -1.364   2.193
  104    HB2  GLU  16          2HB       GLU  16 -11.924  -0.343   0.571
  105    HB3  GLU  16          1HB       GLU  16 -11.889   0.491   2.114
  106    HG2  GLU  16          2HG       GLU  16 -10.523   2.256   1.165
  107    HG3  GLU  16          1HG       GLU  16 -10.440   1.389  -0.368
  108    H    GLU  17           H        GLU  17  -8.359   0.722   0.164
  109    HA   GLU  17           HA       GLU  17  -8.557  -0.995  -2.087
  110    HB2  GLU  17          2HB       GLU  17  -6.519   1.155  -1.531
  111    HB3  GLU  17          1HB       GLU  17  -6.770   0.355  -3.076
  112    HG2  GLU  17          2HG       GLU  17  -9.127   1.209  -3.007
  113    HG3  GLU  17          1HG       GLU  17  -8.643   2.193  -1.628
  114    H    CYS  18           H        CYS  18  -6.180  -0.550   0.463
  115    HA   CYS  18           HA       CYS  18  -4.424  -2.477  -0.671
  116    HB2  CYS  18          2HB       CYS  18  -3.602  -0.711   0.865
  117    HB3  CYS  18          1HB       CYS  18  -4.479  -1.481   2.187
  118    H    LYS  19           H        LYS  19  -7.210  -2.696   1.326
  119    HA   LYS  19           HA       LYS  19  -6.640  -5.424   2.079
  120    HB2  LYS  19          2HB       LYS  19  -9.092  -3.707   2.457
  121    HB3  LYS  19          1HB       LYS  19  -8.964  -5.373   3.011
  122    HG2  LYS  19          2HG       LYS  19  -7.094  -3.174   3.864
  123    HG3  LYS  19          1HG       LYS  19  -8.526  -3.656   4.772
  124    HD2  LYS  19          2HD       LYS  19  -7.639  -5.856   5.131
  125    HD3  LYS  19          1HD       LYS  19  -6.298  -5.561   4.031
  126    HE2  LYS  19          2HE       LYS  19  -5.651  -5.425   6.408
  127    HE3  LYS  19          1HE       LYS  19  -5.363  -3.933   5.521
  128    HZ1  LYS  19          1HZ       LYS  19  -7.736  -4.406   7.247
  129    HZ2  LYS  19          2HZ       LYS  19  -7.264  -2.940   6.540
  130    HZ3  LYS  19          3HZ       LYS  19  -6.338  -3.623   7.736
  131    H    LYS  20           H        LYS  20  -8.257  -3.750  -0.432
  132    HA   LYS  20           HA       LYS  20  -9.615  -6.036  -1.485
  133    HB2  LYS  20          2HB       LYS  20 -10.257  -3.653  -1.956
  134    HB3  LYS  20          1HB       LYS  20  -8.775  -3.479  -2.878
  135    HG2  LYS  20          2HG       LYS  20  -9.552  -5.149  -4.469
  136    HG3  LYS  20          1HG       LYS  20 -11.029  -5.367  -3.526
  137    HD2  LYS  20          2HD       LYS  20 -11.570  -2.988  -3.881
  138    HD3  LYS  20          1HD       LYS  20 -10.134  -2.829  -4.889
  139    HE2  LYS  20          2HE       LYS  20 -12.474  -4.656  -5.423
  140    HE3  LYS  20          1HE       LYS  20 -12.162  -3.126  -6.235
  141    HZ1  LYS  20          1HZ       LYS  20 -10.089  -4.080  -7.101
  142    HZ2  LYS  20          2HZ       LYS  20 -11.443  -4.963  -7.566
  143    HZ3  LYS  20          3HZ       LYS  20 -10.457  -5.562  -6.360
  144    H    LEU  21           H        LEU  21  -6.523  -4.528  -1.784
  145    HA   LEU  21           HA       LEU  21  -5.572  -6.320  -3.827
  146    HB2  LEU  21          2HB       LEU  21  -4.092  -4.373  -2.058
  147    HB3  LEU  21          1HB       LEU  21  -3.403  -5.229  -3.422
  148    HG   LEU  21           HG       LEU  21  -5.595  -3.164  -3.566
  149   HD11  LEU  21          1HD1      LEU  21  -3.894  -1.766  -4.639
  150   HD12  LEU  21          2HD1      LEU  21  -2.678  -2.999  -4.292
  151   HD13  LEU  21          3HD1      LEU  21  -3.486  -2.163  -2.971
  152   HD21  LEU  21          1HD2      LEU  21  -5.815  -4.814  -5.341
  153   HD22  LEU  21          2HD2      LEU  21  -4.112  -4.623  -5.755
  154   HD23  LEU  21          3HD2      LEU  21  -5.235  -3.284  -5.997
  155    H    LYS  22           H        LYS  22  -3.524  -7.523  -3.334
  156    HA   LYS  22           HA       LYS  22  -3.515  -8.681  -0.641
  157    HB2  LYS  22          2HB       LYS  22  -3.159 -10.913  -1.682
  158    HB3  LYS  22          1HB       LYS  22  -4.731 -10.234  -2.070
  159    HG2  LYS  22          2HG       LYS  22  -3.925  -9.593  -4.278
  160    HG3  LYS  22          1HG       LYS  22  -2.323 -10.220  -3.883
  161    HD2  LYS  22          2HD       LYS  22  -3.283 -12.457  -3.590
  162    HD3  LYS  22          1HD       LYS  22  -4.876 -11.820  -3.999
  163    HE2  LYS  22          2HE       LYS  22  -4.084 -11.209  -6.214
  164    HE3  LYS  22          1HE       LYS  22  -2.465 -11.767  -5.802
  165    HZ1  LYS  22          1HZ       LYS  22  -3.320 -13.986  -5.546
  166    HZ2  LYS  22          2HZ       LYS  22  -3.676 -13.416  -7.085
  167    HZ3  LYS  22          3HZ       LYS  22  -4.883 -13.477  -5.910
  Start of MODEL   20
    1    H    ASN   1           H        ASN   1  -1.379  -6.803  -3.447
    2    HA   ASN   1           HA       ASN   1   0.561  -8.385  -1.920
    3    HB2  ASN   1          2HB       ASN   1   1.082  -6.461  -4.198
    4    HB3  ASN   1          1HB       ASN   1   2.338  -7.221  -3.232
    5   HD21  ASN   1          1HD2      ASN   1   1.879  -7.387  -6.096
    6   HD22  ASN   1          2HD2      ASN   1   1.641  -9.045  -6.443
    7    HA   PRO   2           HA       PRO   2   0.016  -4.898   0.964
    8    HB2  PRO   2          2HB       PRO   2   1.992  -6.680   2.326
    9    HB3  PRO   2          1HB       PRO   2   0.588  -5.842   3.003
   10    HG2  PRO   2          2HG       PRO   2   0.434  -8.426   2.526
   11    HG3  PRO   2          1HG       PRO   2  -0.923  -7.372   2.090
   12    HD2  PRO   2          2HD       PRO   2   1.153  -8.601   0.325
   13    HD3  PRO   2          1HD       PRO   2  -0.578  -8.362   0.033
   14    H    GLU   3           H        GLU   3   3.039  -6.446  -0.058
   15    HA   GLU   3           HA       GLU   3   4.797  -4.377   0.718
   16    HB2  GLU   3          2HB       GLU   3   5.472  -6.693   0.087
   17    HB3  GLU   3          1HB       GLU   3   5.122  -6.298  -1.591
   18    HG2  GLU   3          2HG       GLU   3   7.494  -6.143  -1.170
   19    HG3  GLU   3          1HG       GLU   3   6.830  -4.545  -1.516
   20    H    ASP   4           H        ASP   4   3.077  -5.044  -2.254
   21    HA   ASP   4           HA       ASP   4   4.104  -2.898  -3.791
   22    HB2  ASP   4          2HB       ASP   4   3.019  -4.726  -4.923
   23    HB3  ASP   4          1HB       ASP   4   1.543  -4.466  -4.001
   24    H    CYS   5           H        CYS   5   1.282  -3.259  -1.735
   25    HA   CYS   5           HA       CYS   5   0.227  -0.694  -2.205
   26    HB2  CYS   5          2HB       CYS   5  -1.038  -2.559  -1.112
   27    HB3  CYS   5          1HB       CYS   5  -0.058  -2.317   0.332
   28    H    ARG   6           H        ARG   6   2.551  -1.905   0.183
   29    HA   ARG   6           HA       ARG   6   2.920   0.467   1.670
   30    HB2  ARG   6          2HB       ARG   6   4.919  -1.695   1.015
   31    HB3  ARG   6          1HB       ARG   6   5.183  -0.434   2.196
   32    HG2  ARG   6          2HG       ARG   6   3.340  -1.335   3.536
   33    HG3  ARG   6          1HG       ARG   6   3.112  -2.612   2.333
   34    HD2  ARG   6          2HD       ARG   6   4.480  -3.463   4.145
   35    HD3  ARG   6          1HD       ARG   6   5.452  -3.318   2.684
   36    HE   ARG   6           HE       ARG   6   5.480  -1.226   4.743
   37   HH11  ARG   6          1HH1      ARG   6   7.351  -3.446   2.614
   38   HH12  ARG   6          2HH1      ARG   6   8.830  -2.938   3.241
   39   HH21  ARG   6          1HH2      ARG   6   7.508  -0.532   5.467
   40   HH22  ARG   6          2HH2      ARG   6   8.951  -1.233   4.870
   41    H    GLN   7           H        GLN   7   4.133  -0.625  -1.365
   42    HA   GLN   7           HA       GLN   7   6.287   1.208  -1.582
   43    HB2  GLN   7          2HB       GLN   7   6.198  -1.054  -2.611
   44    HB3  GLN   7          1HB       GLN   7   4.946  -0.482  -3.692
   45    HG2  GLN   7          2HG       GLN   7   6.468   0.993  -4.780
   46    HG3  GLN   7          1HG       GLN   7   7.710   0.672  -3.567
   47   HE21  GLN   7          1HE2      GLN   7   6.019  -0.604  -6.312
   48   HE22  GLN   7          2HE2      GLN   7   7.119  -1.897  -6.614
   49    H    ASP   8           H        ASP   8   2.929   1.475  -2.089
   50    HA   ASP   8           HA       ASP   8   3.369   3.923  -3.642
   51    HB2  ASP   8          2HB       ASP   8   0.994   2.058  -3.655
   52    HB3  ASP   8          1HB       ASP   8   0.901   3.696  -4.284
   53    HA   PRO   9           HA       PRO   9   1.810   6.277  -0.255
   54    HB2  PRO   9          2HB       PRO   9   0.460   8.260  -1.612
   55    HB3  PRO   9          1HB       PRO   9   2.208   8.233  -1.359
   56    HG2  PRO   9          2HG       PRO   9   0.631   7.441  -3.762
   57    HG3  PRO   9          1HG       PRO   9   2.177   8.297  -3.668
   58    HD2  PRO   9          2HD       PRO   9   2.022   5.679  -4.292
   59    HD3  PRO   9          1HD       PRO   9   3.380   6.351  -3.371
   60    H    GLU  10           H        GLU  10  -0.224   4.813  -2.529
   61    HA   GLU  10           HA       GLU  10  -2.788   5.517  -1.714
   62    HB2  GLU  10          2HB       GLU  10  -2.332   4.305  -3.787
   63    HB3  GLU  10          1HB       GLU  10  -1.816   2.900  -2.872
   64    HG2  GLU  10          2HG       GLU  10  -4.008   2.443  -2.145
   65    HG3  GLU  10          1HG       GLU  10  -4.598   4.019  -2.663
   66    H    ALA  11           H        ALA  11  -0.499   3.390  -0.231
   67    HA   ALA  11           HA       ALA  11  -2.191   1.938   1.477
   68    HB1  ALA  11          1HB       ALA  11   0.171   1.379   1.102
   69    HB2  ALA  11          2HB       ALA  11  -0.209   1.521   2.817
   70    HB3  ALA  11          3HB       ALA  11   0.643   2.827   1.991
   71    H    ASN  12           H        ASN  12  -1.075   5.232   1.597
   72    HA   ASN  12           HA       ASN  12  -1.959   5.527   4.377
   73    HB2  ASN  12          2HB       ASN  12  -0.568   7.560   2.607
   74    HB3  ASN  12          1HB       ASN  12  -0.967   7.774   4.304
   75   HD21  ASN  12          1HD2      ASN  12   1.260   6.572   2.063
   76   HD22  ASN  12          2HD2      ASN  12   2.387   5.885   3.169
   77    H    LYS  13           H        LYS  13  -3.259   5.572   1.449
   78    HA   LYS  13           HA       LYS  13  -4.989   7.854   1.994
   79    HB2  LYS  13          2HB       LYS  13  -3.908   7.960  -0.173
   80    HB3  LYS  13          1HB       LYS  13  -4.493   6.355  -0.578
   81    HG2  LYS  13          2HG       LYS  13  -5.780   8.089  -1.720
   82    HG3  LYS  13          1HG       LYS  13  -6.786   7.174  -0.599
   83    HD2  LYS  13          2HD       LYS  13  -6.558   8.982   1.055
   84    HD3  LYS  13          1HD       LYS  13  -5.586   9.902  -0.097
   85    HE2  LYS  13          2HE       LYS  13  -7.469   9.996  -1.633
   86    HE3  LYS  13          1HE       LYS  13  -8.426   8.996  -0.542
   87    HZ1  LYS  13          1HZ       LYS  13  -8.277  10.754   1.115
   88    HZ2  LYS  13          2HZ       LYS  13  -9.020  11.275  -0.285
   89    HZ3  LYS  13          3HZ       LYS  13  -7.424  11.734   0.031
   90    H    SER  14           H        SER  14  -5.153   4.499   0.796
   91    HA   SER  14           HA       SER  14  -7.815   4.418   1.971
   92    HB2  SER  14          2HB       SER  14  -8.427   2.977  -0.049
   93    HB3  SER  14          1HB       SER  14  -8.233   4.711  -0.313
   94    HG   SER  14           HG       SER  14  -6.150   2.826  -0.738
   95    HA   PRO  15           HA       PRO  15  -5.707   0.796   3.871
   96    HB2  PRO  15          2HB       PRO  15  -8.124   0.962   5.575
   97    HB3  PRO  15          1HB       PRO  15  -6.425   0.887   6.052
   98    HG2  PRO  15          2HG       PRO  15  -7.826   3.147   6.282
   99    HG3  PRO  15          1HG       PRO  15  -6.119   3.161   5.809
  100    HD2  PRO  15          2HD       PRO  15  -8.559   3.500   4.126
  101    HD3  PRO  15          1HD       PRO  15  -7.000   4.346   4.031
  102    H    GLU  16           H        GLU  16  -9.159   1.251   3.208
  103    HA   GLU  16           HA       GLU  16 -10.019  -1.430   3.245
  104    HB2  GLU  16          2HB       GLU  16 -11.529   0.522   3.239
  105    HB3  GLU  16          1HB       GLU  16 -11.000   0.901   1.612
  106    HG2  GLU  16          2HG       GLU  16 -11.947  -1.205   0.823
  107    HG3  GLU  16          1HG       GLU  16 -12.569  -1.515   2.447
  108    H    GLU  17           H        GLU  17  -8.836   0.624   0.705
  109    HA   GLU  17           HA       GLU  17  -9.125  -1.436  -1.254
  110    HB2  GLU  17          2HB       GLU  17  -8.070   1.383  -1.481
  111    HB3  GLU  17          1HB       GLU  17  -8.398   0.302  -2.840
  112    HG2  GLU  17          2HG       GLU  17 -10.714   0.145  -2.243
  113    HG3  GLU  17          1HG       GLU  17 -10.448   1.110  -0.804
  114    H    CYS  18           H        CYS  18  -6.682  -0.319   0.834
  115    HA   CYS  18           HA       CYS  18  -4.491  -1.448  -0.573
  116    HB2  CYS  18          2HB       CYS  18  -4.246   0.244   1.279
  117    HB3  CYS  18          1HB       CYS  18  -4.771  -0.989   2.419
  118    H    LYS  19           H        LYS  19  -6.861  -2.578   1.776
  119    HA   LYS  19           HA       LYS  19  -5.803  -5.198   2.080
  120    HB2  LYS  19          2HB       LYS  19  -8.629  -4.189   2.455
  121    HB3  LYS  19          1HB       LYS  19  -8.063  -5.775   2.948
  122    HG2  LYS  19          2HG       LYS  19  -6.464  -4.689   4.481
  123    HG3  LYS  19          1HG       LYS  19  -7.131  -3.123   4.015
  124    HD2  LYS  19          2HD       LYS  19  -9.327  -3.809   4.842
  125    HD3  LYS  19          1HD       LYS  19  -8.666  -5.381   5.292
  126    HE2  LYS  19          2HE       LYS  19  -7.101  -4.241   6.833
  127    HE3  LYS  19          1HE       LYS  19  -7.854  -2.702   6.415
  128    HZ1  LYS  19          1HZ       LYS  19  -9.949  -3.566   7.284
  129    HZ2  LYS  19          2HZ       LYS  19  -8.762  -3.583   8.471
  130    HZ3  LYS  19          3HZ       LYS  19  -9.201  -5.005   7.698
  131    H    LYS  20           H        LYS  20  -7.942  -3.670  -0.141
  132    HA   LYS  20           HA       LYS  20  -8.913  -5.895  -1.563
  133    HB2  LYS  20          2HB       LYS  20  -9.873  -3.673  -1.828
  134    HB3  LYS  20          1HB       LYS  20  -8.350  -3.062  -2.445
  135    HG2  LYS  20          2HG       LYS  20  -8.590  -4.383  -4.445
  136    HG3  LYS  20          1HG       LYS  20 -10.075  -5.106  -3.830
  137    HD2  LYS  20          2HD       LYS  20 -11.109  -2.870  -3.757
  138    HD3  LYS  20          1HD       LYS  20  -9.622  -2.175  -4.407
  139    HE2  LYS  20          2HE       LYS  20  -9.875  -3.491  -6.430
  140    HE3  LYS  20          1HE       LYS  20 -11.329  -4.244  -5.774
  141    HZ1  LYS  20          1HZ       LYS  20 -12.372  -2.047  -5.742
  142    HZ2  LYS  20          2HZ       LYS  20 -11.905  -2.479  -7.291
  143    HZ3  LYS  20          3HZ       LYS  20 -10.994  -1.361  -6.412
  144    H    LEU  21           H        LEU  21  -6.037  -3.878  -1.987
  145    HA   LEU  21           HA       LEU  21  -4.932  -5.200  -4.189
  146    HB2  LEU  21          2HB       LEU  21  -3.529  -3.844  -1.891
  147    HB3  LEU  21          1HB       LEU  21  -2.754  -4.315  -3.389
  148    HG   LEU  21           HG       LEU  21  -4.943  -2.265  -3.105
  149   HD11  LEU  21          1HD1      LEU  21  -2.010  -1.951  -3.690
  150   HD12  LEU  21          2HD1      LEU  21  -2.819  -1.530  -2.182
  151   HD13  LEU  21          3HD1      LEU  21  -3.208  -0.656  -3.663
  152   HD21  LEU  21          1HD2      LEU  21  -5.088  -3.384  -5.255
  153   HD22  LEU  21          2HD2      LEU  21  -3.362  -3.150  -5.516
  154   HD23  LEU  21          3HD2      LEU  21  -4.441  -1.757  -5.471
  155    H    LYS  22           H        LYS  22  -3.565  -6.899  -4.393
  156    HA   LYS  22           HA       LYS  22  -3.889  -8.919  -2.353
  157    HB2  LYS  22          2HB       LYS  22  -4.282  -9.349  -4.758
  158    HB3  LYS  22          1HB       LYS  22  -2.567  -9.123  -5.053
  159    HG2  LYS  22          2HG       LYS  22  -2.053 -11.048  -3.659
  160    HG3  LYS  22          1HG       LYS  22  -3.763 -11.252  -3.287
  161    HD2  LYS  22          2HD       LYS  22  -2.493 -11.481  -6.018
  162    HD3  LYS  22          1HD       LYS  22  -3.053 -12.821  -5.022
  163    HE2  LYS  22          2HE       LYS  22  -4.737 -10.652  -6.288
  164    HE3  LYS  22          1HE       LYS  22  -4.697 -12.352  -6.717
  165    HZ1  LYS  22          1HZ       LYS  22  -5.703 -11.277  -4.114
  166    HZ2  LYS  22          2HZ       LYS  22  -5.647 -12.898  -4.547
  167    HZ3  LYS  22          3HZ       LYS  22  -6.630 -11.845  -5.394