*HEADER    DE NOVO PROTEIN                         19-JUL-16   5KX0              
*TITLE     NMR SOLUTION STRUCTURE OF DESIGNED PEPTIDE NC_CHH_DL_D1               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DESIGNED PEPTIDE NC_CHH_DL_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 5KX0    0                                                
# Restraints file 1: design26pdb.restraints
!distance restraints
assign (resid   1 and name   HA)   (resid   2 and name  HD2)   2.685    0.885    0.885  
assign (resid   1 and name   HA)   (resid   2 and name  HD1)   2.685    0.885    0.885  
assign (resid   1 and name   HN)   (resid   4 and name  HB2)   3.455    1.655    1.655  
assign (resid   1 and name   HN)   (resid   4 and name  HB1)   3.455    1.655    1.655  
assign (resid   1 and name   HN)   (resid   1 and name  HB2)   2.725    0.925    0.925  
assign (resid   1 and name   HN)   (resid   1 and name  HB1)   2.725    0.925    0.925  
assign (resid   1 and name   HN)   (resid  25 and name   HA)   3.330    1.530    1.530  
assign (resid   1 and name   HN)   (resid  26 and name   HN)   2.815    1.015    1.015  
assign (resid   1 and name   HA)   (resid   3 and name   HN)   3.560    1.760    1.760  
assign (resid   4 and name   HA)   (resid   4 and name HD2#)   3.130    1.330    1.330  
assign (resid   4 and name   HN)   (resid   4 and name HD1#)   3.505    1.705    1.705  
assign (resid   4 and name   HN)   (resid   4 and name HD2#)   3.505    1.705    1.705  
assign (resid   4 and name   HN)   (resid   4 and name  HB1)   2.665    0.865    0.865  
assign (resid   4 and name   HN)   (resid   4 and name  HB2)   2.665    0.865    0.865  
assign (resid   3 and name  HB2)   (resid   4 and name   HN)   2.930    1.130    1.130  
assign (resid   3 and name  HB1)   (resid   4 and name   HN)   2.930    1.130    1.130  
assign (resid   3 and name   HN)   (resid   4 and name   HN)   2.710    0.910    0.910  
assign (resid   4 and name  HB2)   (resid   5 and name   HN)   2.995    1.195    1.195  
assign (resid   4 and name  HB1)   (resid   5 and name   HN)   2.995    1.195    1.195  
assign (resid   5 and name   HN)   (resid   5 and name  HB2)   2.925    1.125    1.125  
assign (resid   5 and name   HN)   (resid   5 and name  HB1)   2.925    1.125    1.125  
assign (resid   5 and name   HN)   (resid   5 and name  HG2)   3.095    1.295    1.295  
assign (resid   5 and name   HN)   (resid   5 and name  HG1)   3.095    1.295    1.295  
assign (resid   2 and name   HA)   (resid   5 and name   HN)   2.885    1.085    1.085  
assign (resid   5 and name   HN)   (resid   6 and name   HN)   2.795    0.995    0.995  
assign (resid   4 and name   HN)   (resid   5 and name   HN)   2.665    0.865    0.865  
assign (resid   6 and name   HA)   (resid   6 and name  HG2)   2.975    1.175    1.175  
assign (resid   6 and name   HA)   (resid   6 and name  HG1)   2.975    1.175    1.175  
assign (resid  17 and name  HB#)   (resid  18 and name   HN)   2.835    1.035    1.035  
assign (resid   6 and name   HN)   (resid   6 and name  HB2)   2.780    0.980    0.980  
assign (resid   6 and name   HN)   (resid   6 and name  HB1)   2.780    0.980    0.980  
assign (resid   6 and name   HN)   (resid   6 and name  HG2)   3.290    1.490    1.490  
assign (resid   6 and name   HN)   (resid   6 and name  HG1)   3.290    1.490    1.490  
assign (resid   6 and name   HN)   (resid   6 and name  HD2)   3.650    1.850    1.850  
assign (resid   6 and name   HN)   (resid   6 and name  HD1)   3.650    1.850    1.850  
assign (resid  15 and name   HA)   (resid  18 and name   HN)   3.220    1.420    1.420  
assign (resid   2 and name   HA)   (resid   6 and name   HN)   3.375    1.575    1.575  
assign (resid   6 and name   HN)   (resid   7 and name   HN)   3.060    1.260    1.260  
assign (resid   7 and name   HN)   (resid   7 and name  HG2)   3.650    1.850    1.850  
assign (resid   7 and name   HN)   (resid   7 and name  HG1)   3.650    1.850    1.850  
assign (resid   7 and name   HN)   (resid   8 and name   HN)   2.675    0.875    0.875  
assign (resid   8 and name   HN)   (resid   8 and name  HB2)   2.755    0.955    0.955  
assign (resid   8 and name   HN)   (resid   8 and name  HB1)   2.755    0.955    0.955  
assign (resid   9 and name   HN)   (resid   9 and name  HG2)   3.565    1.765    1.765  
assign (resid   9 and name   HN)   (resid   9 and name  HG1)   3.565    1.765    1.765  
assign (resid   8 and name  HB2)   (resid   9 and name   HN)   3.010    1.210    1.210  
assign (resid   8 and name  HB1)   (resid   9 and name   HN)   3.010    1.210    1.210  
assign (resid   9 and name   HN)   (resid  10 and name   HN)   2.780    0.980    0.980  
assign (resid   9 and name  HB2)   (resid  10 and name   HN)   3.150    1.350    1.350  
assign (resid   9 and name  HB1)   (resid  10 and name   HN)   3.150    1.350    1.350  
assign (resid  10 and name   HN)   (resid  11 and name  HB2)   3.270    1.470    1.470  
assign (resid   8 and name   HA)   (resid  10 and name   HN)   3.575    1.775    1.775  
assign (resid  10 and name   HN)   (resid  11 and name   HN)   3.130    1.330    1.330  
assign (resid  11 and name   HN)   (resid  11 and name HD1#)   3.455    1.655    1.655  
assign (resid  11 and name   HN)   (resid  11 and name HD2#)   3.455    1.655    1.655  
assign (resid  11 and name   HN)   (resid  11 and name  HB1)   2.860    1.060    1.060  
assign (resid  11 and name   HN)   (resid  11 and name  HB2)   2.480    0.680    0.680  
assign (resid  10 and name  HB2)   (resid  11 and name   HN)   3.240    1.440    1.440  
assign (resid  10 and name  HB1)   (resid  11 and name   HN)   3.240    1.440    1.440  
assign (resid   8 and name   HA)   (resid  11 and name   HN)   3.200    1.400    1.400  
assign (resid  11 and name   HN)   (resid  12 and name   HN)   2.785    0.985    0.985  
assign (resid  11 and name  HB1)   (resid  12 and name   HN)   3.065    1.265    1.265  
assign (resid  11 and name  HB2)   (resid  12 and name   HN)   2.955    1.155    1.155  
assign (resid  12 and name   HN)   (resid  12 and name  HB2)   2.750    0.950    0.950  
assign (resid  12 and name   HN)   (resid  12 and name  HB1)   2.750    0.950    0.950  
assign (resid  12 and name   HN)   (resid  13 and name   HN)   3.415    1.615    1.615  
assign (resid  13 and name   HA)   (resid  13 and name HG2#)   2.610    0.810    0.810  
assign (resid  13 and name   HN)   (resid  13 and name HG2#)   2.875    1.075    1.075  
assign (resid  13 and name   HN)   (resid  14 and name  HB2)   3.300    1.500    1.500  
assign (resid  12 and name  HB2)   (resid  13 and name   HN)   3.535    1.735    1.735  
assign (resid  12 and name  HB1)   (resid  13 and name   HN)   3.535    1.735    1.735  
assign (resid  12 and name   HA)   (resid  13 and name   HN)   2.395    0.595    0.595  
assign (resid  13 and name   HN)   (resid  14 and name   HN)   2.605    0.805    0.805  
assign (resid  14 and name   HA)   (resid  15 and name  HG2)   3.650    1.850    1.850  
assign (resid  14 and name   HA)   (resid  15 and name  HG1)   3.650    1.850    1.850  
assign (resid  14 and name   HA)   (resid  15 and name  HD2)   2.695    0.895    0.895  
assign (resid  14 and name   HA)   (resid  15 and name  HD1)   2.695    0.895    0.895  
assign (resid  13 and name HG2#)   (resid  14 and name   HN)   3.510    1.710    1.710  
assign (resid  14 and name   HN)   (resid  17 and name  HB#)   3.055    1.255    1.255  
assign (resid  14 and name   HN)   (resid  14 and name  HG2)   3.350    1.550    1.550  
assign (resid  14 and name   HN)   (resid  14 and name  HG1)   3.350    1.550    1.550  
assign (resid  11 and name  HB1)   (resid  14 and name   HN)   3.240    1.440    1.440  
assign (resid  14 and name   HN)   (resid  14 and name  HB2)   2.495    0.695    0.695  
assign (resid  12 and name   HA)   (resid  14 and name   HN)   3.050    1.250    1.250  
assign (resid  16 and name   HN)   (resid  17 and name  HB#)   3.425    1.625    1.625  
assign (resid  16 and name   HN)   (resid  16 and name  HG2)   3.555    1.755    1.755  
assign (resid  16 and name   HN)   (resid  16 and name  HG1)   3.555    1.755    1.755  
assign (resid  14 and name   HA)   (resid  16 and name   HN)   3.240    1.440    1.440  
assign (resid  16 and name   HN)   (resid  17 and name   HN)   2.680    0.880    0.880  
assign (resid  17 and name   HN)   (resid  17 and name  HB#)   2.530    0.730    0.730  
assign (resid  16 and name  HB2)   (resid  17 and name   HN)   3.230    1.430    1.430  
assign (resid  16 and name  HB1)   (resid  17 and name   HN)   3.230    1.430    1.430  
assign (resid  16 and name  HG2)   (resid  17 and name   HN)   3.650    1.850    1.850  
assign (resid  16 and name  HG1)   (resid  17 and name   HN)   3.650    1.850    1.850  
assign (resid  13 and name   HA)   (resid  17 and name   HN)   3.350    1.550    1.550  
assign (resid  15 and name   HA)   (resid  17 and name   HN)   3.615    1.815    1.815  
assign (resid  17 and name   HN)   (resid  18 and name   HN)   2.705    0.905    0.905  
assign (resid  18 and name  HB2)   (resid  19 and name   HN)   3.305    1.505    1.505  
assign (resid  18 and name  HB1)   (resid  19 and name   HN)   3.305    1.505    1.505  
assign (resid  19 and name   HN)   (resid  19 and name  HB2)   2.750    0.950    0.950  
assign (resid  19 and name   HN)   (resid  19 and name  HB1)   2.750    0.950    0.950  
assign (resid  19 and name   HN)   (resid  19 and name  HG2)   3.420    1.620    1.620  
assign (resid  19 and name   HN)   (resid  19 and name  HG1)   3.420    1.620    1.620  
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  19 and name   HN)   (resid  20 and name   HN)   3.500    1.700    1.700  
assign (resid  20 and name   HN)   (resid  20 and name  HG1)   3.420    1.620    1.620  
assign (resid  20 and name   HN)   (resid  20 and name  HG2)   3.420    1.620    1.620  
assign (resid  20 and name   HN)   (resid  21 and name   HN)   2.655    0.855    0.855  
assign (resid  17 and name  HB#)   (resid  21 and name   HN)   3.455    1.655    1.655  
assign (resid  18 and name   HA)   (resid  21 and name   HN)   3.210    1.410    1.410  
assign (resid   8 and name   HN)   (resid   9 and name   HN)   2.755    0.955    0.955  
assign (resid  21 and name   HN)   (resid  22 and name   HN)   2.865    1.065    1.065  
assign (resid  22 and name   HN)   (resid  22 and name  HG2)   3.010    1.210    1.210  
assign (resid  18 and name   HA)   (resid  22 and name   HN)   3.520    1.720    1.720  
assign (resid  23 and name   HN)   (resid  23 and name  HB2)   2.710    0.910    0.910  
assign (resid  23 and name   HN)   (resid  23 and name  HB1)   2.710    0.910    0.910  
assign (resid  22 and name   HN)   (resid  22 and name  HG1)   3.010    1.210    1.210  
assign (resid  24 and name   HN)   (resid  24 and name  HG2)   2.990    1.190    1.190  
assign (resid  24 and name   HN)   (resid  24 and name  HG1)   2.990    1.190    1.190  
assign (resid  24 and name  HG2)   (resid  25 and name   HN)   3.505    1.705    1.705  
assign (resid  24 and name  HG1)   (resid  25 and name   HN)   3.505    1.705    1.705  
assign (resid  25 and name   HN)   (resid  25 and name  HB1)   2.810    1.010    1.010  
assign (resid  25 and name   HN)   (resid  25 and name  HB2)   2.810    1.010    1.010  
assign (resid  25 and name   HN)   (resid  26 and name   HN)   3.355    1.555    1.555  
assign (resid  24 and name   HN)   (resid  25 and name   HN)   2.835    1.035    1.035  
assign (resid  26 and name   HN)   (resid  26 and name  HB2)   2.990    1.190    1.190  
assign (resid  26 and name   HN)   (resid  26 and name  HB1)   2.990    1.190    1.190  
assign (resid  25 and name   HA)   (resid  26 and name   HN)   2.410    0.610    0.610  
assign (resid  13 and name   HB)   (resid  17 and name  HB#)   3.485    1.685    1.685  
assign (resid  13 and name   HA)   (resid  17 and name  HB#)   2.755    0.955    0.955  
assign (resid   8 and name   HA)   (resid  11 and name  HB2)   2.995    1.195    1.195  
assign (resid   4 and name   HA)   (resid   4 and name HD1#)   3.130    1.330    1.330  
assign (resid  22 and name   HA)   (resid  22 and name  HG2)   3.010    1.210    1.210  
assign (resid  22 and name   HA)   (resid  22 and name  HG1)   3.010    1.210    1.210  
assign (resid  14 and name   HA)   (resid  16 and name  HB2)   3.650    1.850    1.850  
assign (resid  14 and name   HA)   (resid  16 and name  HB1)   3.650    1.850    1.850  
assign (resid   1 and name   HN)   (resid   1 and name  HB#)   2.465    0.665    0.665  
assign (resid   1 and name   HN)   (resid   2 and name  HD#)   3.435    1.635    1.635  
assign (resid   1 and name   HN)   (resid   4 and name  HB#)   3.105    1.305    1.305  
assign (resid   1 and name   HN)   (resid  25 and name  HB#)   3.100    1.300    1.300  
assign (resid   1 and name   HA)   (resid   1 and name HD2#)   3.195    1.395    1.395  
assign (resid   1 and name   HA)   (resid   2 and name  HD#)   2.375    0.575    0.575  
assign (resid   1 and name  HB#)   (resid   1 and name HD2#)   2.515    0.715    0.715  
assign (resid   1 and name  HB#)   (resid   3 and name   HN)   3.005    1.205    1.205  
assign (resid   2 and name  HG#)   (resid   3 and name   HN)   2.955    1.155    1.155  
assign (resid   2 and name  HD#)   (resid   3 and name   HN)   2.910    1.110    1.110  
assign (resid   3 and name   HN)   (resid   3 and name  HG#)   3.205    1.405    1.405  
assign (resid   3 and name   HA)   (resid   3 and name  HG#)   2.715    0.915    0.915  
assign (resid   3 and name  HG#)   (resid   4 and name   HN)   3.265    1.465    1.465  
assign (resid   4 and name   HN)   (resid   4 and name  HD#)   3.140    1.340    1.340  
assign (resid   4 and name   HA)   (resid   4 and name  HD#)   2.560    0.760    0.760  
assign (resid   4 and name  HD#)   (resid  22 and name   HN)   3.485    1.685    1.685  
assign (resid   4 and name  HD#)   (resid  22 and name   HA)   3.095    1.295    1.295  
assign (resid   4 and name  HD#)   (resid  25 and name  HB#)   3.310    1.510    1.510  
assign (resid   5 and name   HN)   (resid   5 and name  HB#)   2.560    0.760    0.760  
assign (resid   5 and name   HN)   (resid   5 and name  HG#)   2.700    0.900    0.900  
assign (resid   6 and name   HN)   (resid   6 and name  HB#)   2.470    0.670    0.670  
assign (resid   6 and name   HN)   (resid   6 and name  HG#)   2.915    1.115    1.115  
assign (resid   6 and name   HA)   (resid   6 and name  HG#)   2.725    0.925    0.925  
assign (resid   7 and name   HN)   (resid   7 and name  HB#)   2.410    0.610    0.610  
assign (resid   7 and name   HN)   (resid   7 and name  HG#)   3.250    1.450    1.450  
assign (resid   7 and name  HB#)   (resid   8 and name   HN)   2.600    0.800    0.800  
assign (resid   8 and name   HN)   (resid   8 and name  HB#)   2.440    0.640    0.640  
assign (resid   8 and name  HB#)   (resid   9 and name   HN)   2.640    0.840    0.840  
assign (resid   9 and name   HN)   (resid   9 and name  HB#)   2.460    0.660    0.660  
assign (resid   9 and name   HN)   (resid   9 and name  HG#)   3.175    1.375    1.375  
assign (resid   9 and name  HB#)   (resid  10 and name   HN)   2.860    1.060    1.060  
assign (resid  10 and name   HN)   (resid  10 and name  HB#)   2.560    0.760    0.760  
assign (resid  10 and name   HN)   (resid  10 and name  HG#)   2.860    1.060    1.060  
assign (resid  10 and name   HA)   (resid  10 and name  HG#)   2.720    0.920    0.920  
assign (resid  10 and name  HB#)   (resid  11 and name   HN)   2.865    1.065    1.065  
assign (resid  11 and name   HN)   (resid  11 and name  HD#)   3.125    1.325    1.325  
assign (resid  11 and name   HN)   (resid  12 and name  HB#)   3.330    1.530    1.530  
assign (resid  11 and name   HA)   (resid  11 and name  HD#)   2.670    0.870    0.870  
assign (resid  11 and name  HD#)   (resid  12 and name   HN)   3.400    1.600    1.600  
assign (resid  11 and name  HD#)   (resid  14 and name   HN)   3.290    1.490    1.490  
assign (resid  11 and name  HD#)   (resid  17 and name   HN)   3.415    1.615    1.615  
assign (resid  11 and name  HD#)   (resid  18 and name   HN)   3.125    1.325    1.325  
assign (resid  12 and name   HN)   (resid  12 and name  HB#)   2.480    0.680    0.680  
assign (resid  14 and name   HN)   (resid  14 and name  HG#)   3.045    1.245    1.245  
assign (resid  14 and name   HA)   (resid  15 and name  HG#)   3.300    1.500    1.500  
assign (resid  14 and name   HA)   (resid  15 and name  HD#)   2.330    0.530    0.530  
assign (resid  14 and name   HA)   (resid  16 and name  HB#)   3.320    1.520    1.520  
assign (resid  14 and name  HB2)   (resid  14 and name  HD#)   2.735    0.935    0.935  
assign (resid  14 and name  HB2)   (resid  15 and name  HD#)   2.840    1.040    1.040  
assign (resid  14 and name  HB1)   (resid  15 and name  HD#)   2.820    1.020    1.020  
assign (resid  15 and name  HB#)   (resid  16 and name   HN)   2.880    1.080    1.080  
assign (resid  15 and name  HD#)   (resid  16 and name   HN)   2.875    1.075    1.075  
assign (resid  16 and name   HN)   (resid  16 and name  HB#)   2.500    0.700    0.700  
assign (resid  16 and name   HN)   (resid  16 and name  HG#)   3.185    1.385    1.385  
assign (resid  16 and name  HB#)   (resid  17 and name   HN)   2.900    1.100    1.100  
assign (resid  18 and name   HN)   (resid  18 and name  HB#)   2.445    0.645    0.645  
assign (resid  18 and name   HN)   (resid  18 and name  HG#)   3.120    1.320    1.320  
assign (resid  18 and name   HA)   (resid  18 and name  HG#)   2.735    0.935    0.935  
assign (resid  18 and name  HB#)   (resid  19 and name   HN)   3.000    1.200    1.200  
assign (resid  18 and name  HB#)   (resid  21 and name   HN)   3.570    1.770    1.770  
assign (resid  18 and name  HG#)   (resid  21 and name   HN)   3.570    1.770    1.770  
assign (resid  19 and name   HN)   (resid  19 and name  HB#)   2.415    0.615    0.615  
assign (resid  19 and name   HN)   (resid  19 and name  HG#)   2.985    1.185    1.185  
assign (resid  19 and name   HN)   (resid  19 and name  HD#)   3.285    1.485    1.485  
assign (resid  19 and name   HN)   (resid  21 and name  HB#)   3.400    1.600    1.600  
assign (resid  19 and name   HA)   (resid  19 and name  HG#)   2.765    0.965    0.965  
assign (resid  19 and name  HB#)   (resid  19 and name  HD#)   2.565    0.765    0.765  
assign (resid  19 and name  HB#)   (resid  20 and name   HN)   2.535    0.735    0.735  
assign (resid  20 and name   HN)   (resid  20 and name  HB#)   2.615    0.815    0.815  
assign (resid  20 and name   HN)   (resid  20 and name  HG#)   3.015    1.215    1.215  
assign (resid  20 and name   HN)   (resid  21 and name  HB#)   3.445    1.645    1.645  
assign (resid  20 and name  HB#)   (resid  21 and name   HN)   2.800    1.000    1.000  
assign (resid  21 and name   HN)   (resid  21 and name  HB#)   2.560    0.760    0.760  
assign (resid  21 and name  HB#)   (resid  22 and name   HN)   2.730    0.930    0.930  
assign (resid  22 and name   HN)   (resid  22 and name  HG#)   2.745    0.945    0.945  
assign (resid  22 and name  HB#)   (resid  22 and name  HD#)   2.710    0.910    0.910  
assign (resid  23 and name   HN)   (resid  23 and name  HB#)   2.465    0.665    0.665  
assign (resid  23 and name   HN)   (resid  23 and name  HG#)   3.120    1.320    1.320  
assign (resid  23 and name   HA)   (resid  23 and name  HG#)   2.730    0.930    0.930  
assign (resid  23 and name  HB#)   (resid  24 and name   HN)   2.475    0.675    0.675  
assign (resid  24 and name   HN)   (resid  24 and name  HG#)   2.715    0.915    0.915  
assign (resid  24 and name   HA)   (resid  24 and name  HG#)   2.770    0.970    0.970  
assign (resid  24 and name  HB#)   (resid  25 and name   HN)   2.965    1.165    1.165  
assign (resid  24 and name  HG#)   (resid  25 and name   HN)   3.195    1.395    1.395  
assign (resid  25 and name   HN)   (resid  25 and name  HB#)   2.490    0.690    0.690  
assign (resid  26 and name   HN)   (resid  26 and name  HB#)   2.655    0.855    0.855  
!dihedral restraints
assign (resid 2     and name N    ) (resid 2     and name CA   ) (resid 2     and name C    ) (resid 3     and name N    )    1.0  -30.0   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  -75.0   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  -20.0   40.0 2
assign (resid 3     and name C    ) (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    )    1.0  -70.0   30.0 2
assign (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    ) (resid 5     and name N    )    1.0  -40.0   30.0 2
assign (resid 4     and name C    ) (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name C    )    1.0  -65.0   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  -40.0   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  -70.0   30.0 2
assign (resid 6     and name N    ) (resid 6     and name CA   ) (resid 6     and name C    ) (resid 7     and name N    )    1.0  -40.0   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   30.0 2
assign (resid 7     and name N    ) (resid 7     and name CA   ) (resid 7     and name C    ) (resid 8     and name N    )    1.0  -40.0   30.0 2
assign (resid 7     and name C    ) (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    )    1.0  -70.0   30.0 2
assign (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    ) (resid 9     and name N    )    1.0  -35.0   30.0 2
assign (resid 8     and name C    ) (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name C    )    1.0  -65.0   30.0 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   30.0 2
assign (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    ) (resid 11    and name N    )    1.0  -20.0   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 22    and name C    ) (resid 23    and name N    ) (resid 23    and name CA   ) (resid 23    and name C    )    1.0  100.0   80.0 2
assign (resid 23    and name C    ) (resid 24    and name N    ) (resid 24    and name CA   ) (resid 24    and name C    )    1.0  100.0   80.0 2
assign (resid 24    and name C    ) (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    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 -120.0   90.0 2
assign (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name CB   ) (resid 5     and name CG   )    1.0  -60.0   30.0 2
assign (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name CB   ) (resid 8     and name SG   )    1.0  -60.0   30.0 2
assign (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name CB   ) (resid 11    and name CG   )    1.0 -120.0   90.0 2
assign (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name CB   ) (resid 14    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 10 and name HN)(resid 6 and name O) 0 0 2
assign (resid 10 and name N)(resid 6 and name O) 0 0 3
assign (resid 11 and name HN)(resid 7 and name O) 0 0 2
assign (resid 11 and name N)(resid 7 and name O) 0 0 3
assign (resid 12 and name HN)(resid 8 and name O) 0 0 2
assign (resid 12 and name N)(resid 8 and name O) 0 0 3
assign (resid 20 and name HN)(resid 16 and name O) 0 0 2
assign (resid 20 and name N)(resid 16 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 23 and name HN)(resid 19 and name O) 0 0 2
assign (resid 23 and name N)(resid 19 and name O) 0 0 3
assign (resid 25 and name HN)(resid 21 and name O) 0 0 2
assign (resid 25 and name N)(resid 21 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  -1.456   8.673   0.592
    2    HA   ASN   1           HA       ASN   1  -3.947   9.491  -0.369
    3    HB2  ASN   1          2HB       ASN   1  -1.965   9.072  -1.845
    4    HB3  ASN   1          1HB       ASN   1  -2.179   7.350  -1.584
    5   HD21  ASN   1          1HD2      ASN   1  -3.415  10.150  -3.194
    6   HD22  ASN   1          2HD2      ASN   1  -4.527   9.313  -4.211
    7    HA   PRO   2           HA       PRO   2  -6.372   6.301   1.529
    8    HB2  PRO   2          2HB       PRO   2  -8.743   6.891   0.314
    9    HB3  PRO   2          1HB       PRO   2  -8.109   7.750   1.718
   10    HG2  PRO   2          2HG       PRO   2  -8.034   8.511  -1.168
   11    HG3  PRO   2          1HG       PRO   2  -8.303   9.537   0.253
   12    HD2  PRO   2          2HD       PRO   2  -5.940   9.438  -1.041
   13    HD3  PRO   2          1HD       PRO   2  -6.048   9.702   0.712
   14    H    GLU   3           H        GLU   3  -6.408   6.714  -1.980
   15    HA   GLU   3           HA       GLU   3  -7.644   4.151  -2.336
   16    HB2  GLU   3          2HB       GLU   3  -6.551   6.136  -4.311
   17    HB3  GLU   3          1HB       GLU   3  -7.273   4.598  -4.771
   18    HG2  GLU   3          2HG       GLU   3  -8.650   6.798  -3.245
   19    HG3  GLU   3          1HG       GLU   3  -8.884   6.416  -4.951
   20    H    LEU   4           H        LEU   4  -4.446   5.445  -2.390
   21    HA   LEU   4           HA       LEU   4  -3.150   3.151  -3.415
   22    HB2  LEU   4          2HB       LEU   4  -2.077   5.365  -3.229
   23    HB3  LEU   4          1HB       LEU   4  -2.181   5.258  -1.486
   24    HG   LEU   4           HG       LEU   4  -0.595   3.386  -1.502
   25   HD11  LEU   4          1HD1      LEU   4  -1.077   2.445  -3.685
   26   HD12  LEU   4          2HD1      LEU   4   0.635   2.851  -3.556
   27   HD13  LEU   4          3HD1      LEU   4  -0.455   3.898  -4.464
   28   HD21  LEU   4          1HD2      LEU   4   0.354   5.837  -2.978
   29   HD22  LEU   4          2HD2      LEU   4   1.373   4.688  -2.108
   30   HD23  LEU   4          3HD2      LEU   4   0.202   5.669  -1.229
   31    H    GLN   5           H        GLN   5  -3.894   4.295  -0.151
   32    HA   GLN   5           HA       GLN   5  -2.960   2.076   1.296
   33    HB2  GLN   5          2HB       GLN   5  -5.205   3.999   1.896
   34    HB3  GLN   5          1HB       GLN   5  -4.562   2.844   3.053
   35    HG2  GLN   5          2HG       GLN   5  -2.429   3.929   3.039
   36    HG3  GLN   5          1HG       GLN   5  -2.934   4.990   1.726
   37   HE21  GLN   5          1HE2      GLN   5  -1.996   5.594   4.403
   38   HE22  GLN   5          2HE2      GLN   5  -3.216   6.554   5.149
   39    H    ARG   6           H        ARG   6  -5.974   2.710  -0.330
   40    HA   ARG   6           HA       ARG   6  -7.541   0.562   0.532
   41    HB2  ARG   6          2HB       ARG   6  -8.412   2.409  -0.800
   42    HB3  ARG   6          1HB       ARG   6  -7.430   1.906  -2.162
   43    HG2  ARG   6          2HG       ARG   6  -8.697  -0.227  -2.224
   44    HG3  ARG   6          1HG       ARG   6  -9.735   0.432  -0.953
   45    HD2  ARG   6          2HD       ARG   6 -10.409   2.251  -2.387
   46    HD3  ARG   6          1HD       ARG   6  -9.288   1.714  -3.633
   47    HE   ARG   6           HE       ARG   6 -11.197  -0.261  -2.850
   48   HH11  ARG   6          1HH1      ARG   6 -10.702   2.566  -4.920
   49   HH12  ARG   6          2HH1      ARG   6 -11.723   1.999  -6.171
   50   HH21  ARG   6          1HH2      ARG   6 -12.625  -1.007  -4.540
   51   HH22  ARG   6          2HH2      ARG   6 -12.852  -0.074  -5.951
   52    H    LYS   7           H        LYS   7  -5.246   0.823  -2.145
   53    HA   LYS   7           HA       LYS   7  -5.567  -1.750  -3.211
   54    HB2  LYS   7          2HB       LYS   7  -4.340   0.083  -4.358
   55    HB3  LYS   7          1HB       LYS   7  -3.061  -0.046  -3.160
   56    HG2  LYS   7          2HG       LYS   7  -2.638  -2.359  -3.900
   57    HG3  LYS   7          1HG       LYS   7  -3.869  -2.162  -5.145
   58    HD2  LYS   7          2HD       LYS   7  -2.561  -0.275  -6.078
   59    HD3  LYS   7          1HD       LYS   7  -1.304  -0.594  -4.880
   60    HE2  LYS   7          2HE       LYS   7  -1.002  -2.837  -5.780
   61    HE3  LYS   7          1HE       LYS   7  -2.285  -2.551  -6.949
   62    HZ1  LYS   7          1HZ       LYS   7   0.420  -1.327  -6.855
   63    HZ2  LYS   7          2HZ       LYS   7  -0.841  -0.620  -7.711
   64    HZ3  LYS   7          3HZ       LYS   7  -0.321  -2.153  -8.132
   65    H    CYS   8           H        CYS   8  -3.389  -0.454  -0.770
   66    HA   CYS   8           HA       CYS   8  -1.968  -2.766  -0.160
   67    HB2  CYS   8          2HB       CYS   8  -2.764  -0.506   1.647
   68    HB3  CYS   8          1HB       CYS   8  -1.446  -1.634   1.935
   69    H    LYS   9           H        LYS   9  -4.942  -1.459   1.263
   70    HA   LYS   9           HA       LYS   9  -5.241  -3.474   3.184
   71    HB2  LYS   9          2HB       LYS   9  -7.265  -1.634   1.945
   72    HB3  LYS   9          1HB       LYS   9  -7.623  -2.729   3.275
   73    HG2  LYS   9          2HG       LYS   9  -5.966  -1.597   4.655
   74    HG3  LYS   9          1HG       LYS   9  -5.587  -0.505   3.321
   75    HD2  LYS   9          2HD       LYS   9  -7.095   0.566   4.921
   76    HD3  LYS   9          1HD       LYS   9  -7.888   0.333   3.364
   77    HE2  LYS   9          2HE       LYS   9  -9.023  -1.660   4.236
   78    HE3  LYS   9          1HE       LYS   9  -8.208  -1.447   5.785
   79    HZ1  LYS   9          1HZ       LYS   9 -10.115   0.465   4.555
   80    HZ2  LYS   9          2HZ       LYS   9  -9.376   0.638   6.060
   81    HZ3  LYS   9          3HZ       LYS   9 -10.465  -0.614   5.795
   82    H    GLU  10           H        GLU  10  -6.191  -3.330  -0.163
   83    HA   GLU  10           HA       GLU  10  -7.796  -5.686   0.077
   84    HB2  GLU  10          2HB       GLU  10  -8.390  -3.892  -1.489
   85    HB3  GLU  10          1HB       GLU  10  -6.900  -4.174  -2.374
   86    HG2  GLU  10          2HG       GLU  10  -7.629  -6.249  -3.146
   87    HG3  GLU  10          1HG       GLU  10  -8.966  -6.303  -1.998
   88    H    LEU  11           H        LEU  11  -4.535  -4.898  -0.920
   89    HA   LEU  11           HA       LEU  11  -3.912  -7.510  -1.893
   90    HB2  LEU  11          2HB       LEU  11  -2.092  -5.331  -0.858
   91    HB3  LEU  11          1HB       LEU  11  -1.537  -6.805  -1.609
   92    HG   LEU  11           HG       LEU  11  -3.133  -4.628  -2.959
   93   HD11  LEU  11          1HD1      LEU  11  -0.855  -3.952  -2.466
   94   HD12  LEU  11          2HD1      LEU  11  -1.064  -4.223  -4.197
   95   HD13  LEU  11          3HD1      LEU  11  -0.243  -5.429  -3.210
   96   HD21  LEU  11          1HD2      LEU  11  -3.643  -6.811  -3.911
   97   HD22  LEU  11          2HD2      LEU  11  -1.923  -7.161  -4.077
   98   HD23  LEU  11          3HD2      LEU  11  -2.658  -5.870  -5.029
   99    H    DAS  12           H        DAS  12  -3.562  -5.847   1.183
  100    HA   DAS  12           HA       DAS  12  -3.077  -8.429   2.464
  101    HB2  DAS  12          1HB       DAS  12  -5.140  -7.153   3.166
  102    HB3  DAS  12          2HB       DAS  12  -4.077  -5.868   3.732
  103    H    THR  13           H        THR  13  -1.056  -8.664   3.165
  104    HA   THR  13           HA       THR  13   0.545  -6.259   3.597
  105    HB   THR  13           HB       THR  13   2.154  -7.980   4.671
  106    HG1  THR  13          1HG       THR  13  -0.119  -9.517   5.189
  107   HG21  THR  13          1HG2      THR  13  -0.529  -7.469   5.960
  108   HG22  THR  13          2HG2      THR  13   0.840  -6.360   5.949
  109   HG23  THR  13          3HG2      THR  13   0.962  -7.896   6.804
  110    H    ARG  14           H        ARG  14  -0.273  -8.174   1.317
  111    HA   ARG  14           HA       ARG  14   2.152  -9.036   0.028
  112    HB2  ARG  14          2HB       ARG  14  -0.715  -8.765  -0.863
  113    HB3  ARG  14          1HB       ARG  14   0.536  -9.462  -1.868
  114    HG2  ARG  14          2HG       ARG  14   0.746 -11.338  -0.464
  115    HG3  ARG  14          1HG       ARG  14  -0.162 -10.556   0.835
  116    HD2  ARG  14          2HD       ARG  14  -1.472 -12.256  -0.452
  117    HD3  ARG  14          1HD       ARG  14  -2.189 -10.647  -0.428
  118    HE   ARG  14           HE       ARG  14  -0.619 -11.705  -2.675
  119   HH11  ARG  14          1HH1      ARG  14  -3.376  -9.820  -1.482
  120   HH12  ARG  14          2HH1      ARG  14  -4.002  -9.483  -3.039
  121   HH21  ARG  14          1HH2      ARG  14  -1.450 -11.202  -4.774
  122   HH22  ARG  14          2HH2      ARG  14  -2.855 -10.267  -4.974
  123    HA   DPR  15           HA       DPR  15   1.915  -5.654  -3.178
  124    HB2  DPR  15          1HB       DPR  15   4.595  -6.570  -3.916
  125    HB3  DPR  15          2HB       DPR  15   3.157  -6.453  -4.932
  126    HG2  DPR  15          1HG       DPR  15   4.205  -8.833  -4.213
  127    HG3  DPR  15          2HG       DPR  15   2.459  -8.601  -4.410
  128    HD2  DPR  15          1HD       DPR  15   4.086  -8.629  -1.892
  129    HD3  DPR  15          2HD       DPR  15   2.541  -9.434  -2.238
  130    H    DGL  16           H        DGL  16   4.032  -6.700  -0.796
  131    HA   DGL  16           HA       DGL  16   5.923  -4.648  -0.640
  132    HB2  DGL  16          1HB       DGL  16   4.729  -6.494   1.401
  133    HB3  DGL  16          2HB       DGL  16   6.085  -5.465   1.772
  134    HG2  DGL  16          1HG       DGL  16   5.959  -7.644  -0.314
  135    HG3  DGL  16          2HG       DGL  16   6.821  -7.717   1.223
  136    H    DAL  17           H        DAL  17   2.633  -4.944   0.456
  137    HA   DAL  17           HA       DAL  17   2.484  -2.798   2.240
  138    HB1  DAL  17          1HB       DAL  17   0.764  -4.532   2.028
  139    HB2  DAL  17          2HB       DAL  17   0.341  -3.910   0.431
  140    HB3  DAL  17          3HB       DAL  17   0.085  -2.913   1.864
  141    H    DGL  18           H        DGL  18   2.230  -3.001  -1.255
  142    HA   DGL  18           HA       DGL  18   1.248  -0.479  -1.925
  143    HB2  DGL  18          1HB       DGL  18   1.484  -2.214  -3.587
  144    HB3  DGL  18          2HB       DGL  18   3.215  -2.294  -3.333
  145    HG2  DGL  18          1HG       DGL  18   3.380   0.037  -4.208
  146    HG3  DGL  18          2HG       DGL  18   1.674  -0.073  -4.638
  147    H    DAR  19           H        DAR  19   4.568  -1.578  -1.531
  148    HA   DAR  19           HA       DAR  19   5.650   1.005  -2.004
  149    HB2  DAR  19          1HB       DAR  19   6.905  -1.545  -1.097
  150    HB3  DAR  19          2HB       DAR  19   7.805  -0.045  -0.963
  151    HG2  DAR  19          1HG       DAR  19   8.454  -1.050  -3.005
  152    HG3  DAR  19          2HG       DAR  19   7.415   0.304  -3.424
  153    HD2  DAR  19          1HD       DAR  19   6.784  -1.481  -4.830
  154    HD3  DAR  19          2HD       DAR  19   5.514  -1.323  -3.617
  155    HE   DAR  19           HE       DAR  19   7.182  -3.151  -2.556
  156   HH11  DAR  19          1HH2      DAR  19   7.248  -5.489  -2.969
  157   HH12  DAR  19          2HH2      DAR  19   6.540  -6.073  -4.400
  158   HH21  DAR  19          1HH1      DAR  19   5.285  -2.959  -5.550
  159   HH22  DAR  19          2HH1      DAR  19   5.414  -4.628  -5.889
  160    H    DLY  20           H        DLY  20   4.837  -0.772   0.893
  161    HA   DLY  20           HA       DLY  20   5.907   1.035   2.748
  162    HB2  DLY  20          1HB       DLY  20   5.052  -1.173   3.403
  163    HB3  DLY  20          2HB       DLY  20   3.427  -0.689   2.954
  164    HG2  DLY  20          1HG       DLY  20   3.398   0.965   4.742
  165    HG3  DLY  20          2HG       DLY  20   5.045   0.521   5.186
  166    HD2  DLY  20          1HD       DLY  20   4.356  -1.695   5.788
  167    HD3  DLY  20          2HD       DLY  20   2.732  -1.412   5.174
  168    HE2  DLY  20          1HE       DLY  20   3.995   0.037   7.503
  169    HE3  DLY  20          2HE       DLY  20   2.831  -1.278   7.634
  170    HZ1  DLY  20          1HZ       DLY  20   1.227   0.136   6.412
  171    HZ2  DLY  20          2HZ       DLY  20   2.335   1.417   6.478
  172    HZ3  DLY  20          3HZ       DLY  20   1.699   0.785   7.891
  173    H    DCY  21           H        DCY  21   2.673   0.908   1.275
  174    HA   DCY  21           HA       DCY  21   1.656   3.234   2.450
  175    HB2  DCY  21          1HB       DCY  21   1.012   1.933  -0.171
  176    HB3  DCY  21          2HB       DCY  21   0.096   3.292   0.489
  177    H    DAR  22           H        DAR  22   3.484   2.793  -0.535
  178    HA   DAR  22           HA       DAR  22   3.251   5.495  -1.336
  179    HB2  DAR  22          1HB       DAR  22   5.282   3.402  -2.072
  180    HB3  DAR  22          2HB       DAR  22   5.236   5.000  -2.801
  181    HG2  DAR  22          1HG       DAR  22   2.964   4.538  -3.619
  182    HG3  DAR  22          2HG       DAR  22   3.067   2.917  -2.927
  183    HD2  DAR  22          1HD       DAR  22   4.975   2.422  -4.330
  184    HD3  DAR  22          2HD       DAR  22   4.906   4.042  -5.026
  185    HE   DAR  22           HE       DAR  22   2.431   2.928  -5.437
  186   HH11  DAR  22          1HH1      DAR  22   5.763   2.308  -6.450
  187   HH12  DAR  22          2HH1      DAR  22   5.334   1.460  -7.857
  188   HH21  DAR  22          1HH2      DAR  22   1.833   1.777  -7.403
  189   HH22  DAR  22          2HH2      DAR  22   3.062   1.174  -8.417
  190    H    DGL  23           H        DGL  23   5.682   3.778   0.530
  191    HA   DGL  23           HA       DGL  23   7.528   5.839   0.822
  192    HB2  DGL  23          1HB       DGL  23   8.035   3.538   1.376
  193    HB3  DGL  23          2HB       DGL  23   6.812   3.527   2.629
  194    HG2  DGL  23          1HG       DGL  23   8.088   5.073   3.961
  195    HG3  DGL  23          2HG       DGL  23   9.305   5.197   2.689
  196    H    DGL  24           H        DGL  24   4.769   4.943   2.850
  197    HA   DGL  24           HA       DGL  24   5.186   7.078   4.702
  198    HB2  DGL  24          1HB       DGL  24   2.757   5.333   4.287
  199    HB3  DGL  24          2HB       DGL  24   3.066   6.357   5.684
  200    HG2  DGL  24          1HG       DGL  24   5.053   5.034   6.198
  201    HG3  DGL  24          2HG       DGL  24   4.715   3.989   4.822
  202    H    SER  25           H        SER  25   2.734   6.497   2.197
  203    HA   SER  25           HA       SER  25   2.174   9.366   2.155
  204    HB2  SER  25          2HB       SER  25   1.595   7.175   0.140
  205    HB3  SER  25          1HB       SER  25   1.097   8.851  -0.053
  206    HG   SER  25           HG       SER  25   3.755   7.810   0.033
  207    H    ASP  26           H        ASP  26  -0.116   9.967   2.088
  208    HA   ASP  26           HA       ASP  26  -1.686   8.027   3.614
  209    HB2  ASP  26          2HB       ASP  26  -2.919   9.927   4.560
  210    HB3  ASP  26          1HB       ASP  26  -1.199  10.034   4.902
  Start of MODEL    2
    1    H    ASN   1           H        ASN   1  -1.566   8.724   0.381
    2    HA   ASN   1           HA       ASN   1  -4.048   9.883  -0.478
    3    HB2  ASN   1          2HB       ASN   1  -2.351   7.663  -1.646
    4    HB3  ASN   1          1HB       ASN   1  -3.766   8.318  -2.448
    5   HD21  ASN   1          1HD2      ASN   1  -3.101  11.104  -1.638
    6   HD22  ASN   1          2HD2      ASN   1  -1.773  11.545  -2.627
    7    HA   PRO   2           HA       PRO   2  -6.410   6.897   1.988
    8    HB2  PRO   2          2HB       PRO   2  -8.647   8.070   0.424
    9    HB3  PRO   2          1HB       PRO   2  -8.481   7.871   2.170
   10    HG2  PRO   2          2HG       PRO   2  -8.209  10.267   1.060
   11    HG3  PRO   2          1HG       PRO   2  -7.161   9.766   2.397
   12    HD2  PRO   2          2HD       PRO   2  -6.560   9.930  -0.522
   13    HD3  PRO   2          1HD       PRO   2  -5.538  10.322   0.874
   14    H    GLU   3           H        GLU   3  -7.101   7.411  -1.453
   15    HA   GLU   3           HA       GLU   3  -8.458   4.962  -1.848
   16    HB2  GLU   3          2HB       GLU   3  -8.658   6.883  -3.396
   17    HB3  GLU   3          1HB       GLU   3  -6.976   6.679  -3.857
   18    HG2  GLU   3          2HG       GLU   3  -8.408   5.784  -5.554
   19    HG3  GLU   3          1HG       GLU   3  -7.508   4.487  -4.784
   20    H    LEU   4           H        LEU   4  -5.116   5.947  -2.208
   21    HA   LEU   4           HA       LEU   4  -4.127   3.526  -3.258
   22    HB2  LEU   4          2HB       LEU   4  -2.888   5.637  -3.389
   23    HB3  LEU   4          1HB       LEU   4  -2.733   5.649  -1.645
   24    HG   LEU   4           HG       LEU   4  -1.365   3.608  -1.768
   25   HD11  LEU   4          1HD1      LEU   4  -1.515   4.041  -4.744
   26   HD12  LEU   4          2HD1      LEU   4  -2.189   2.683  -3.840
   27   HD13  LEU   4          3HD1      LEU   4  -0.441   2.903  -3.925
   28   HD21  LEU   4          1HD2      LEU   4  -0.374   5.912  -3.421
   29   HD22  LEU   4          2HD2      LEU   4   0.641   4.693  -2.646
   30   HD23  LEU   4          3HD2      LEU   4  -0.325   5.798  -1.664
   31    H    GLN   5           H        GLN   5  -4.469   4.761   0.035
   32    HA   GLN   5           HA       GLN   5  -3.221   2.540   1.234
   33    HB2  GLN   5          2HB       GLN   5  -5.147   4.525   2.441
   34    HB3  GLN   5          1HB       GLN   5  -4.273   3.309   3.364
   35    HG2  GLN   5          2HG       GLN   5  -2.144   4.308   2.558
   36    HG3  GLN   5          1HG       GLN   5  -3.085   5.588   1.795
   37   HE21  GLN   5          1HE2      GLN   5  -2.003   4.227   4.760
   38   HE22  GLN   5          2HE2      GLN   5  -2.434   5.535   5.791
   39    H    ARG   6           H        ARG   6  -6.480   3.023   0.132
   40    HA   ARG   6           HA       ARG   6  -7.531   0.717   1.428
   41    HB2  ARG   6          2HB       ARG   6  -8.466   1.931  -1.196
   42    HB3  ARG   6          1HB       ARG   6  -9.335   0.716  -0.274
   43    HG2  ARG   6          2HG       ARG   6  -9.323   2.438   1.623
   44    HG3  ARG   6          1HG       ARG   6  -8.883   3.599   0.373
   45    HD2  ARG   6          2HD       ARG   6 -11.343   1.849   0.400
   46    HD3  ARG   6          1HD       ARG   6 -11.289   3.565   0.758
   47    HE   ARG   6           HE       ARG   6 -10.293   3.301  -1.824
   48   HH11  ARG   6          1HH1      ARG   6 -13.343   2.471  -0.195
   49   HH12  ARG   6          2HH1      ARG   6 -14.287   2.751  -1.578
   50   HH21  ARG   6          1HH2      ARG   6 -11.570   3.659  -3.657
   51   HH22  ARG   6          2HH2      ARG   6 -13.269   3.419  -3.625
   52    H    LYS   7           H        LYS   7  -5.975   1.268  -1.655
   53    HA   LYS   7           HA       LYS   7  -6.027  -1.328  -2.660
   54    HB2  LYS   7          2HB       LYS   7  -5.349   0.276  -4.199
   55    HB3  LYS   7          1HB       LYS   7  -4.219   1.027  -3.082
   56    HG2  LYS   7          2HG       LYS   7  -2.705  -0.879  -3.353
   57    HG3  LYS   7          1HG       LYS   7  -3.859  -1.630  -4.456
   58    HD2  LYS   7          2HD       LYS   7  -3.497  -0.034  -6.114
   59    HD3  LYS   7          1HD       LYS   7  -2.804   1.127  -4.986
   60    HE2  LYS   7          2HE       LYS   7  -1.083   0.147  -6.413
   61    HE3  LYS   7          1HE       LYS   7  -0.832  -0.275  -4.727
   62    HZ1  LYS   7          1HZ       LYS   7  -0.446  -2.189  -6.011
   63    HZ2  LYS   7          2HZ       LYS   7  -1.863  -1.993  -6.899
   64    HZ3  LYS   7          3HZ       LYS   7  -1.952  -2.463  -5.287
   65    H    CYS   8           H        CYS   8  -3.693   0.216  -0.467
   66    HA   CYS   8           HA       CYS   8  -1.822  -1.812  -0.241
   67    HB2  CYS   8          2HB       CYS   8  -2.843  -0.133   2.063
   68    HB3  CYS   8          1HB       CYS   8  -1.272  -0.914   1.952
   69    H    LYS   9           H        LYS   9  -4.784  -1.378   1.704
   70    HA   LYS   9           HA       LYS   9  -4.333  -3.847   3.089
   71    HB2  LYS   9          2HB       LYS   9  -5.488  -1.784   4.060
   72    HB3  LYS   9          1HB       LYS   9  -6.897  -2.257   3.125
   73    HG2  LYS   9          2HG       LYS   9  -7.204  -3.075   5.349
   74    HG3  LYS   9          1HG       LYS   9  -6.849  -4.464   4.318
   75    HD2  LYS   9          2HD       LYS   9  -4.489  -4.373   5.050
   76    HD3  LYS   9          1HD       LYS   9  -4.887  -3.025   6.112
   77    HE2  LYS   9          2HE       LYS   9  -4.842  -4.989   7.444
   78    HE3  LYS   9          1HE       LYS   9  -6.535  -4.548   7.244
   79    HZ1  LYS   9          1HZ       LYS   9  -5.068  -6.656   5.762
   80    HZ2  LYS   9          2HZ       LYS   9  -6.693  -6.266   5.484
   81    HZ3  LYS   9          3HZ       LYS   9  -6.212  -6.914   6.954
   82    H    GLU  10           H        GLU  10  -5.852  -2.978   0.159
   83    HA   GLU  10           HA       GLU  10  -7.591  -5.252   0.007
   84    HB2  GLU  10          2HB       GLU  10  -7.905  -3.114  -1.262
   85    HB3  GLU  10          1HB       GLU  10  -6.489  -3.534  -2.206
   86    HG2  GLU  10          2HG       GLU  10  -7.594  -5.517  -3.021
   87    HG3  GLU  10          1HG       GLU  10  -9.016  -5.126  -2.051
   88    H    LEU  11           H        LEU  11  -4.389  -4.380  -1.104
   89    HA   LEU  11           HA       LEU  11  -3.835  -6.750  -2.542
   90    HB2  LEU  11          2HB       LEU  11  -2.706  -4.568  -2.856
   91    HB3  LEU  11          1HB       LEU  11  -1.982  -4.733  -1.274
   92    HG   LEU  11           HG       LEU  11  -0.727  -6.673  -2.052
   93   HD11  LEU  11          1HD1      LEU  11  -2.247  -7.471  -3.795
   94   HD12  LEU  11          2HD1      LEU  11  -0.641  -7.179  -4.459
   95   HD13  LEU  11          3HD1      LEU  11  -1.936  -6.016  -4.742
   96   HD21  LEU  11          1HD2      LEU  11   0.263  -4.474  -2.157
   97   HD22  LEU  11          2HD2      LEU  11  -0.429  -4.222  -3.761
   98   HD23  LEU  11          3HD2      LEU  11   0.796  -5.467  -3.511
   99    H    DAS  12           H        DAS  12  -3.356  -5.671   0.742
  100    HA   DAS  12           HA       DAS  12  -2.960  -8.464   1.522
  101    HB2  DAS  12          1HB       DAS  12  -4.973  -7.553   2.432
  102    HB3  DAS  12          2HB       DAS  12  -4.122  -6.143   3.039
  103    H    THR  13           H        THR  13  -0.994  -8.985   2.113
  104    HA   THR  13           HA       THR  13   0.709  -6.907   3.271
  105    HB   THR  13           HB       THR  13   2.013  -8.941   4.148
  106    HG1  THR  13          1HG       THR  13   1.287 -10.777   3.525
  107   HG21  THR  13          1HG2      THR  13   0.499  -9.242   6.068
  108   HG22  THR  13          2HG2      THR  13  -0.814  -8.505   5.149
  109   HG23  THR  13          3HG2      THR  13   0.589  -7.542   5.605
  110    H    ARG  14           H        ARG  14   0.073  -8.409   0.497
  111    HA   ARG  14           HA       ARG  14   2.535  -9.374  -0.468
  112    HB2  ARG  14          2HB       ARG  14   0.062  -8.397  -1.867
  113    HB3  ARG  14          1HB       ARG  14   1.470  -8.959  -2.755
  114    HG2  ARG  14          2HG       ARG  14   1.243 -11.140  -1.814
  115    HG3  ARG  14          1HG       ARG  14  -0.046 -10.599  -0.741
  116    HD2  ARG  14          2HD       ARG  14  -0.939 -11.778  -2.696
  117    HD3  ARG  14          1HD       ARG  14  -1.451 -10.091  -2.673
  118    HE   ARG  14           HE       ARG  14   0.913 -10.767  -4.222
  119   HH11  ARG  14          1HH1      ARG  14  -2.527  -9.964  -4.272
  120   HH12  ARG  14          2HH1      ARG  14  -2.566  -9.572  -5.924
  121   HH21  ARG  14          1HH2      ARG  14   0.860 -10.266  -6.487
  122   HH22  ARG  14          2HH2      ARG  14  -0.575  -9.781  -7.243
  123    HA   DPR  15           HA       DPR  15   4.199  -5.848  -2.887
  124    HB2  DPR  15          1HB       DPR  15   6.702  -7.186  -2.001
  125    HB3  DPR  15          2HB       DPR  15   6.236  -6.639  -3.614
  126    HG2  DPR  15          1HG       DPR  15   6.231  -9.230  -3.028
  127    HG3  DPR  15          2HG       DPR  15   4.933  -8.528  -4.009
  128    HD2  DPR  15          1HD       DPR  15   4.921  -9.249  -1.094
  129    HD3  DPR  15          2HD       DPR  15   3.687  -9.549  -2.335
  130    H    DGL  16           H        DGL  16   4.763  -6.976   0.354
  131    HA   DGL  16           HA       DGL  16   6.398  -4.880   1.298
  132    HB2  DGL  16          1HB       DGL  16   5.749  -7.133   2.441
  133    HB3  DGL  16          2HB       DGL  16   4.307  -6.294   2.968
  134    HG2  DGL  16          1HG       DGL  16   7.129  -5.517   3.691
  135    HG3  DGL  16          2HG       DGL  16   6.016  -6.394   4.723
  136    H    DAL  17           H        DAL  17   2.914  -5.401   1.297
  137    HA   DAL  17           HA       DAL  17   2.144  -2.917   2.388
  138    HB1  DAL  17          1HB       DAL  17   0.642  -4.845   2.290
  139    HB2  DAL  17          2HB       DAL  17   0.605  -4.720   0.533
  140    HB3  DAL  17          3HB       DAL  17  -0.075  -3.429   1.522
  141    H    DGL  18           H        DGL  18   2.508  -4.064  -0.907
  142    HA   DGL  18           HA       DGL  18   1.611  -1.899  -2.382
  143    HB2  DGL  18          1HB       DGL  18   2.375  -4.090  -3.300
  144    HB3  DGL  18          2HB       DGL  18   4.031  -3.616  -2.978
  145    HG2  DGL  18          1HG       DGL  18   3.551  -3.330  -5.304
  146    HG3  DGL  18          2HG       DGL  18   3.804  -1.758  -4.553
  147    H    DAR  19           H        DAR  19   4.887  -2.496  -1.223
  148    HA   DAR  19           HA       DAR  19   5.902   0.012  -2.107
  149    HB2  DAR  19          1HB       DAR  19   7.024  -1.910  -0.068
  150    HB3  DAR  19          2HB       DAR  19   7.899  -0.556  -0.771
  151    HG2  DAR  19          1HG       DAR  19   6.849  -2.950  -2.269
  152    HG3  DAR  19          2HG       DAR  19   8.529  -2.662  -1.818
  153    HD2  DAR  19          1HD       DAR  19   6.884  -0.918  -3.651
  154    HD3  DAR  19          2HD       DAR  19   8.110  -2.080  -4.150
  155    HE   DAR  19           HE       DAR  19   9.566  -0.621  -2.577
  156   HH11  DAR  19          1HH2      DAR  19  10.688   1.388  -3.053
  157   HH12  DAR  19          2HH2      DAR  19   9.979   2.480  -4.160
  158   HH21  DAR  19          1HH1      DAR  19   7.093   0.579  -4.824
  159   HH22  DAR  19          2HH1      DAR  19   7.933   2.008  -5.177
  160    H    DLY  20           H        DLY  20   4.515  -1.141   0.885
  161    HA   DLY  20           HA       DLY  20   5.304   1.076   2.420
  162    HB2  DLY  20          1HB       DLY  20   4.783  -1.089   3.418
  163    HB3  DLY  20          2HB       DLY  20   3.101  -0.905   2.953
  164    HG2  DLY  20          1HG       DLY  20   2.720   0.776   4.514
  165    HG3  DLY  20          2HG       DLY  20   4.443   1.088   4.734
  166    HD2  DLY  20          1HD       DLY  20   4.709  -1.113   5.744
  167    HD3  DLY  20          2HD       DLY  20   2.989  -1.421   5.524
  168    HE2  DLY  20          1HE       DLY  20   3.650  -0.696   7.831
  169    HE3  DLY  20          2HE       DLY  20   2.399   0.290   7.077
  170    HZ1  DLY  20          1HZ       DLY  20   4.352   1.439   8.256
  171    HZ2  DLY  20          2HZ       DLY  20   3.715   2.013   6.836
  172    HZ3  DLY  20          3HZ       DLY  20   5.187   1.192   6.783
  173    H    DCY  21           H        DCY  21   2.618   0.520   0.305
  174    HA   DCY  21           HA       DCY  21   0.946   2.619   0.977
  175    HB2  DCY  21          1HB       DCY  21   1.754   1.583  -1.737
  176    HB3  DCY  21          2HB       DCY  21   0.410   2.690  -1.500
  177    H    DAR  22           H        DAR  22   3.724   2.643  -1.251
  178    HA   DAR  22           HA       DAR  22   3.687   5.501  -1.546
  179    HB2  DAR  22          1HB       DAR  22   5.555   3.349  -2.502
  180    HB3  DAR  22          2HB       DAR  22   5.929   5.051  -2.724
  181    HG2  DAR  22          1HG       DAR  22   3.414   3.750  -3.731
  182    HG3  DAR  22          2HG       DAR  22   4.879   3.948  -4.698
  183    HD2  DAR  22          1HD       DAR  22   3.284   6.183  -3.425
  184    HD3  DAR  22          2HD       DAR  22   3.262   5.740  -5.131
  185    HE   DAR  22           HE       DAR  22   5.800   6.192  -4.893
  186   HH11  DAR  22          1HH1      DAR  22   3.208   8.101  -3.402
  187   HH12  DAR  22          2HH1      DAR  22   4.043   9.573  -3.453
  188   HH21  DAR  22          1HH2      DAR  22   6.988   8.288  -4.950
  189   HH22  DAR  22          2HH2      DAR  22   6.231   9.655  -4.295
  190    H    DGL  23           H        DGL  23   5.119   3.336   0.625
  191    HA   DGL  23           HA       DGL  23   7.313   4.789   1.573
  192    HB2  DGL  23          1HB       DGL  23   6.821   2.460   2.160
  193    HB3  DGL  23          2HB       DGL  23   5.399   2.986   3.051
  194    HG2  DGL  23          1HG       DGL  23   6.836   4.189   4.620
  195    HG3  DGL  23          2HG       DGL  23   8.250   3.560   3.775
  196    H    DGL  24           H        DGL  24   3.917   4.785   2.641
  197    HA   DGL  24           HA       DGL  24   4.559   7.067   4.348
  198    HB2  DGL  24          1HB       DGL  24   2.207   5.205   4.438
  199    HB3  DGL  24          2HB       DGL  24   2.455   6.575   5.515
  200    HG2  DGL  24          1HG       DGL  24   4.499   5.585   6.332
  201    HG3  DGL  24          2HG       DGL  24   4.293   4.224   5.235
  202    H    SER  25           H        SER  25   2.741   6.324   1.473
  203    HA   SER  25           HA       SER  25   2.162   9.055   1.169
  204    HB2  SER  25          2HB       SER  25   1.125   6.671  -0.376
  205    HB3  SER  25          1HB       SER  25   1.032   8.356  -0.905
  206    HG   SER  25           HG       SER  25   3.393   8.338  -0.676
  207    H    ASP  26           H        ASP  26   0.389  10.165   1.570
  208    HA   ASP  26           HA       ASP  26  -1.511   9.014   3.438
  209    HB2  ASP  26          2HB       ASP  26  -2.224  11.315   3.857
  210    HB3  ASP  26          1HB       ASP  26  -0.477  11.162   3.978
  Start of MODEL    3
    1    H    ASN   1           H        ASN   1  -1.756   8.825   1.027
    2    HA   ASN   1           HA       ASN   1  -4.166  10.013   0.141
    3    HB2  ASN   1          2HB       ASN   1  -2.215   8.229  -1.302
    4    HB3  ASN   1          1HB       ASN   1  -3.512   9.121  -2.088
    5   HD21  ASN   1          1HD2      ASN   1  -3.094  11.506  -0.363
    6   HD22  ASN   1          2HD2      ASN   1  -1.643  12.220  -0.938
    7    HA   PRO   2           HA       PRO   2  -7.119   6.839   1.095
    8    HB2  PRO   2          2HB       PRO   2  -8.212   7.902  -1.469
    9    HB3  PRO   2          1HB       PRO   2  -9.059   7.540   0.041
   10    HG2  PRO   2          2HG       PRO   2  -8.442  10.034  -0.566
   11    HG3  PRO   2          1HG       PRO   2  -8.258   9.440   1.094
   12    HD2  PRO   2          2HD       PRO   2  -6.186  10.059  -0.935
   13    HD3  PRO   2          1HD       PRO   2  -6.112  10.145   0.833
   14    H    GLU   3           H        GLU   3  -6.327   7.172  -2.387
   15    HA   GLU   3           HA       GLU   3  -7.118   4.584  -3.094
   16    HB2  GLU   3          2HB       GLU   3  -5.134   6.416  -4.438
   17    HB3  GLU   3          1HB       GLU   3  -5.712   4.914  -5.141
   18    HG2  GLU   3          2HG       GLU   3  -7.403   7.304  -4.435
   19    HG3  GLU   3          1HG       GLU   3  -6.915   6.815  -6.056
   20    H    LEU   4           H        LEU   4  -4.009   5.783  -2.015
   21    HA   LEU   4           HA       LEU   4  -2.633   3.358  -2.522
   22    HB2  LEU   4          2HB       LEU   4  -1.994   5.803  -0.905
   23    HB3  LEU   4          1HB       LEU   4  -0.979   4.390  -0.793
   24    HG   LEU   4           HG       LEU   4   0.012   6.000  -2.287
   25   HD11  LEU   4          1HD1      LEU   4  -1.049   3.656  -3.834
   26   HD12  LEU   4          2HD1      LEU   4   0.376   3.677  -2.796
   27   HD13  LEU   4          3HD1      LEU   4   0.342   4.650  -4.263
   28   HD21  LEU   4          1HD2      LEU   4  -2.506   5.800  -3.944
   29   HD22  LEU   4          2HD2      LEU   4  -1.034   6.648  -4.413
   30   HD23  LEU   4          3HD2      LEU   4  -1.974   7.216  -3.036
   31    H    GLN   5           H        GLN   5  -3.939   4.822   0.416
   32    HA   GLN   5           HA       GLN   5  -3.218   2.648   2.056
   33    HB2  GLN   5          2HB       GLN   5  -5.150   4.905   2.488
   34    HB3  GLN   5          1HB       GLN   5  -4.860   3.670   3.709
   35    HG2  GLN   5          2HG       GLN   5  -2.773   5.483   2.512
   36    HG3  GLN   5          1HG       GLN   5  -3.496   5.649   4.113
   37   HE21  GLN   5          1HE2      GLN   5  -0.707   5.191   3.292
   38   HE22  GLN   5          2HE2      GLN   5  -0.212   3.743   4.129
   39    H    ARG   6           H        ARG   6  -6.067   3.213   0.163
   40    HA   ARG   6           HA       ARG   6  -7.486   1.016   1.259
   41    HB2  ARG   6          2HB       ARG   6  -7.842   2.787  -1.084
   42    HB3  ARG   6          1HB       ARG   6  -8.637   1.221  -1.137
   43    HG2  ARG   6          2HG       ARG   6  -8.956   3.211   1.098
   44    HG3  ARG   6          1HG       ARG   6 -10.074   3.048  -0.258
   45    HD2  ARG   6          2HD       ARG   6  -9.425   0.958   1.836
   46    HD3  ARG   6          1HD       ARG   6 -10.957   1.788   1.591
   47    HE   ARG   6           HE       ARG   6 -10.598   0.633  -0.788
   48   HH11  ARG   6          1HH1      ARG   6 -10.543  -0.742   2.485
   49   HH12  ARG   6          2HH1      ARG   6 -10.883  -2.324   1.969
   50   HH21  ARG   6          1HH2      ARG   6 -11.059  -1.507  -1.476
   51   HH22  ARG   6          2HH2      ARG   6 -11.207  -2.780  -0.350
   52    H    LYS   7           H        LYS   7  -5.218   1.357  -1.403
   53    HA   LYS   7           HA       LYS   7  -5.710  -1.334  -2.122
   54    HB2  LYS   7          2HB       LYS   7  -3.621   0.579  -3.132
   55    HB3  LYS   7          1HB       LYS   7  -3.838  -1.064  -3.750
   56    HG2  LYS   7          2HG       LYS   7  -6.203  -0.527  -4.197
   57    HG3  LYS   7          1HG       LYS   7  -5.872   1.135  -3.744
   58    HD2  LYS   7          2HD       LYS   7  -4.309   1.323  -5.585
   59    HD3  LYS   7          1HD       LYS   7  -4.607  -0.369  -6.022
   60    HE2  LYS   7          2HE       LYS   7  -6.627   1.865  -5.987
   61    HE3  LYS   7          1HE       LYS   7  -5.946   1.085  -7.411
   62    HZ1  LYS   7          1HZ       LYS   7  -8.164   0.219  -6.852
   63    HZ2  LYS   7          2HZ       LYS   7  -7.606  -0.335  -5.360
   64    HZ3  LYS   7          3HZ       LYS   7  -6.994  -0.979  -6.775
   65    H    CYS   8           H        CYS   8  -3.652   0.193   0.100
   66    HA   CYS   8           HA       CYS   8  -1.929  -1.953   0.622
   67    HB2  CYS   8          2HB       CYS   8  -3.221  -0.066   2.613
   68    HB3  CYS   8          1HB       CYS   8  -1.868  -1.129   2.963
   69    H    LYS   9           H        LYS   9  -5.287  -1.375   1.374
   70    HA   LYS   9           HA       LYS   9  -5.571  -3.656   3.105
   71    HB2  LYS   9          2HB       LYS   9  -7.676  -1.978   1.719
   72    HB3  LYS   9          1HB       LYS   9  -7.991  -3.181   2.952
   73    HG2  LYS   9          2HG       LYS   9  -6.391  -0.658   3.357
   74    HG3  LYS   9          1HG       LYS   9  -8.082  -0.867   3.799
   75    HD2  LYS   9          2HD       LYS   9  -5.777  -2.482   4.914
   76    HD3  LYS   9          1HD       LYS   9  -6.529  -1.113   5.719
   77    HE2  LYS   9          2HE       LYS   9  -7.891  -3.722   5.001
   78    HE3  LYS   9          1HE       LYS   9  -7.373  -3.228   6.605
   79    HZ1  LYS   9          1HZ       LYS   9  -9.486  -1.900   4.975
   80    HZ2  LYS   9          2HZ       LYS   9  -8.956  -1.376   6.492
   81    HZ3  LYS   9          3HZ       LYS   9  -9.717  -2.860   6.333
   82    H    GLU  10           H        GLU  10  -6.166  -2.880  -0.273
   83    HA   GLU  10           HA       GLU  10  -7.448  -5.312  -0.938
   84    HB2  GLU  10          2HB       GLU  10  -5.927  -3.391  -2.716
   85    HB3  GLU  10          1HB       GLU  10  -6.882  -4.736  -3.310
   86    HG2  GLU  10          2HG       GLU  10  -8.882  -3.718  -2.221
   87    HG3  GLU  10          1HG       GLU  10  -7.887  -2.323  -1.812
   88    H    LEU  11           H        LEU  11  -4.070  -4.310  -1.081
   89    HA   LEU  11           HA       LEU  11  -3.222  -6.868  -2.086
   90    HB2  LEU  11          2HB       LEU  11  -1.741  -4.459  -1.123
   91    HB3  LEU  11          1HB       LEU  11  -0.923  -5.903  -1.711
   92    HG   LEU  11           HG       LEU  11  -2.746  -4.088  -3.303
   93   HD11  LEU  11          1HD1      LEU  11   0.235  -4.511  -3.432
   94   HD12  LEU  11          2HD1      LEU  11  -0.587  -3.076  -2.822
   95   HD13  LEU  11          3HD1      LEU  11  -0.712  -3.505  -4.527
   96   HD21  LEU  11          1HD2      LEU  11  -1.193  -6.540  -4.143
   97   HD22  LEU  11          2HD2      LEU  11  -2.024  -5.439  -5.237
   98   HD23  LEU  11          3HD2      LEU  11  -2.951  -6.386  -4.080
   99    H    DAS  12           H        DAS  12  -3.365  -5.298   1.063
  100    HA   DAS  12           HA       DAS  12  -2.890  -7.893   2.195
  101    HB2  DAS  12          1HB       DAS  12  -4.770  -6.622   3.098
  102    HB3  DAS  12          2HB       DAS  12  -3.687  -5.306   3.536
  103    H    THR  13           H        THR  13  -1.068  -8.503   3.149
  104    HA   THR  13           HA       THR  13   0.945  -6.469   3.654
  105    HB   THR  13           HB       THR  13   2.022  -8.472   4.903
  106    HG1  THR  13          1HG       THR  13  -0.110  -9.709   5.613
  107   HG21  THR  13          1HG2      THR  13   0.980  -6.553   6.047
  108   HG22  THR  13          2HG2      THR  13   0.637  -8.058   6.899
  109   HG23  THR  13          3HG2      THR  13  -0.598  -7.320   5.878
  110    H    ARG  14           H        ARG  14  -0.054  -8.323   1.273
  111    HA   ARG  14           HA       ARG  14   2.327  -9.727   0.487
  112    HB2  ARG  14          2HB       ARG  14  -0.305  -9.247  -0.912
  113    HB3  ARG  14          1HB       ARG  14   0.979 -10.271  -1.535
  114    HG2  ARG  14          2HG       ARG  14   0.740 -11.787   0.313
  115    HG3  ARG  14          1HG       ARG  14  -0.428 -10.714   1.091
  116    HD2  ARG  14          2HD       ARG  14  -0.807 -12.042  -1.592
  117    HD3  ARG  14          1HD       ARG  14  -1.494 -12.612  -0.075
  118    HE   ARG  14           HE       ARG  14  -2.655 -10.424   0.039
  119   HH11  ARG  14          1HH1      ARG  14  -1.649 -11.599  -3.144
  120   HH12  ARG  14          2HH1      ARG  14  -2.915 -10.837  -3.972
  121   HH21  ARG  14          1HH2      ARG  14  -4.372  -9.400  -1.074
  122   HH22  ARG  14          2HH2      ARG  14  -4.525  -9.567  -2.771
  123    HA   DPR  15           HA       DPR  15   3.234  -7.011  -3.126
  124    HB2  DPR  15          1HB       DPR  15   5.988  -7.892  -2.659
  125    HB3  DPR  15          2HB       DPR  15   5.000  -8.061  -4.109
  126    HG2  DPR  15          1HG       DPR  15   5.667 -10.165  -2.548
  127    HG3  DPR  15          2HG       DPR  15   4.141 -10.092  -3.442
  128    HD2  DPR  15          1HD       DPR  15   4.660  -9.605  -0.546
  129    HD3  DPR  15          2HD       DPR  15   3.290 -10.416  -1.333
  130    H    DGL  16           H        DGL  16   4.565  -7.254   0.025
  131    HA   DGL  16           HA       DGL  16   6.279  -5.012   0.026
  132    HB2  DGL  16          1HB       DGL  16   6.353  -6.809   1.719
  133    HB3  DGL  16          2HB       DGL  16   4.803  -6.277   2.341
  134    HG2  DGL  16          1HG       DGL  16   5.764  -4.167   3.028
  135    HG3  DGL  16          2HG       DGL  16   7.318  -4.629   2.334
  136    H    DAL  17           H        DAL  17   2.857  -5.371   0.299
  137    HA   DAL  17           HA       DAL  17   2.176  -3.015   1.621
  138    HB1  DAL  17          1HB       DAL  17   0.618  -4.455  -0.511
  139    HB2  DAL  17          2HB       DAL  17  -0.026  -3.281   0.636
  140    HB3  DAL  17          3HB       DAL  17   0.593  -4.830   1.212
  141    H    DGL  18           H        DGL  18   2.852  -3.653  -1.777
  142    HA   DGL  18           HA       DGL  18   1.928  -1.272  -2.899
  143    HB2  DGL  18          1HB       DGL  18   2.661  -3.201  -4.226
  144    HB3  DGL  18          2HB       DGL  18   4.321  -2.915  -3.732
  145    HG2  DGL  18          1HG       DGL  18   4.084  -2.037  -5.933
  146    HG3  DGL  18          2HG       DGL  18   4.167  -0.686  -4.785
  147    H    DAR  19           H        DAR  19   5.108  -2.033  -1.577
  148    HA   DAR  19           HA       DAR  19   6.281   0.507  -2.072
  149    HB2  DAR  19          1HB       DAR  19   7.670  -1.446  -1.662
  150    HB3  DAR  19          2HB       DAR  19   6.994  -1.639  -0.054
  151    HG2  DAR  19          1HG       DAR  19   9.190  -0.701   0.129
  152    HG3  DAR  19          2HG       DAR  19   8.012   0.527   0.588
  153    HD2  DAR  19          1HD       DAR  19   8.210   1.586  -1.573
  154    HD3  DAR  19          2HD       DAR  19   9.313   0.320  -2.114
  155    HE   DAR  19           HE       DAR  19  10.008   1.953   0.218
  156   HH11  DAR  19          1HH2      DAR  19  12.158   2.929   0.137
  157   HH12  DAR  19          2HH2      DAR  19  13.071   2.867  -1.295
  158   HH21  DAR  19          1HH1      DAR  19  10.647   1.047  -3.152
  159   HH22  DAR  19          2HH1      DAR  19  12.201   1.745  -3.190
  160    H    DLY  20           H        DLY  20   4.860  -1.028   0.738
  161    HA   DLY  20           HA       DLY  20   5.184   0.956   2.624
  162    HB2  DLY  20          1HB       DLY  20   4.491  -1.300   3.163
  163    HB3  DLY  20          2HB       DLY  20   2.978  -1.073   2.305
  164    HG2  DLY  20          1HG       DLY  20   2.262   0.568   3.935
  165    HG3  DLY  20          2HG       DLY  20   3.794   0.395   4.796
  166    HD2  DLY  20          1HD       DLY  20   3.315  -1.936   5.230
  167    HD3  DLY  20          2HD       DLY  20   1.815  -1.824   4.311
  168    HE2  DLY  20          1HE       DLY  20   2.429  -0.243   6.795
  169    HE3  DLY  20          2HE       DLY  20   1.480  -1.722   6.758
  170    HZ1  DLY  20          1HZ       DLY  20  -0.105  -0.563   5.255
  171    HZ2  DLY  20          2HZ       DLY  20   0.766   0.867   5.441
  172    HZ3  DLY  20          3HZ       DLY  20   0.023   0.152   6.750
  173    H    DCY  21           H        DCY  21   2.424   0.445   0.435
  174    HA   DCY  21           HA       DCY  21   0.765   2.470   1.344
  175    HB2  DCY  21          1HB       DCY  21   1.155   1.321  -1.409
  176    HB3  DCY  21          2HB       DCY  21  -0.199   2.375  -0.994
  177    H    DAR  22           H        DAR  22   3.190   2.545  -1.214
  178    HA   DAR  22           HA       DAR  22   2.731   5.228  -1.947
  179    HB2  DAR  22          1HB       DAR  22   5.156   3.494  -2.436
  180    HB3  DAR  22          2HB       DAR  22   4.807   5.010  -3.252
  181    HG2  DAR  22          1HG       DAR  22   2.778   4.018  -4.208
  182    HG3  DAR  22          2HG       DAR  22   3.161   2.497  -3.406
  183    HD2  DAR  22          1HD       DAR  22   5.263   2.365  -4.658
  184    HD3  DAR  22          2HD       DAR  22   4.853   3.882  -5.466
  185    HE   DAR  22           HE       DAR  22   3.049   1.590  -5.660
  186   HH11  DAR  22          1HH1      DAR  22   5.373   3.734  -7.298
  187   HH12  DAR  22          2HH1      DAR  22   4.779   3.387  -8.858
  188   HH21  DAR  22          1HH2      DAR  22   2.267   1.145  -7.790
  189   HH22  DAR  22          2HH2      DAR  22   2.982   1.880  -9.155
  190    H    DGL  23           H        DGL  23   5.045   3.625   0.127
  191    HA   DGL  23           HA       DGL  23   6.714   5.826   0.622
  192    HB2  DGL  23          1HB       DGL  23   7.335   3.443   0.771
  193    HB3  DGL  23          2HB       DGL  23   6.316   3.278   2.182
  194    HG2  DGL  23          1HG       DGL  23   7.737   4.533   3.522
  195    HG3  DGL  23          2HG       DGL  23   8.615   5.184   2.136
  196    H    DGL  24           H        DGL  24   4.014   4.407   2.485
  197    HA   DGL  24           HA       DGL  24   4.220   6.224   4.640
  198    HB2  DGL  24          1HB       DGL  24   1.770   4.776   3.627
  199    HB3  DGL  24          2HB       DGL  24   1.857   5.653   5.140
  200    HG2  DGL  24          1HG       DGL  24   3.580   4.105   5.922
  201    HG3  DGL  24          2HG       DGL  24   3.381   3.173   4.434
  202    H    SER  25           H        SER  25   2.044   6.170   1.839
  203    HA   SER  25           HA       SER  25   1.753   9.030   2.266
  204    HB2  SER  25          2HB       SER  25   0.645   9.046  -0.012
  205    HB3  SER  25          1HB       SER  25   2.339   8.578  -0.029
  206    HG   SER  25           HG       SER  25   1.167   6.308   0.154
  207    H    ASP  26           H        ASP  26  -0.214   9.957   2.664
  208    HA   ASP  26           HA       ASP  26  -2.081   8.121   3.943
  209    HB2  ASP  26          2HB       ASP  26  -1.840  11.132   4.019
  210    HB3  ASP  26          1HB       ASP  26  -3.159  10.256   4.782
  Start of MODEL    4
    1    H    ASN   1           H        ASN   1  -1.700   8.909   0.292
    2    HA   ASN   1           HA       ASN   1  -4.247   9.934  -0.644
    3    HB2  ASN   1          2HB       ASN   1  -2.258   9.820  -2.160
    4    HB3  ASN   1          1HB       ASN   1  -2.252   8.073  -1.969
    5   HD21  ASN   1          1HD2      ASN   1  -2.471   9.623  -4.392
    6   HD22  ASN   1          2HD2      ASN   1  -3.954   9.159  -5.141
    7    HA   PRO   2           HA       PRO   2  -6.348   6.476   1.318
    8    HB2  PRO   2          2HB       PRO   2  -8.414   7.217  -0.685
    9    HB3  PRO   2          1HB       PRO   2  -8.560   6.969   1.061
   10    HG2  PRO   2          2HG       PRO   2  -8.567   9.418   0.043
   11    HG3  PRO   2          1HG       PRO   2  -7.733   9.061   1.566
   12    HD2  PRO   2          2HD       PRO   2  -6.594   9.526  -1.152
   13    HD3  PRO   2          1HD       PRO   2  -5.960   9.980   0.444
   14    H    GLU   3           H        GLU   3  -6.385   6.862  -2.213
   15    HA   GLU   3           HA       GLU   3  -7.195   4.258  -2.875
   16    HB2  GLU   3          2HB       GLU   3  -7.242   6.050  -4.505
   17    HB3  GLU   3          1HB       GLU   3  -5.501   6.246  -4.399
   18    HG2  GLU   3          2HG       GLU   3  -6.170   5.122  -6.455
   19    HG3  GLU   3          1HG       GLU   3  -5.182   4.076  -5.438
   20    H    LEU   4           H        LEU   4  -4.002   5.655  -2.399
   21    HA   LEU   4           HA       LEU   4  -2.583   3.310  -3.123
   22    HB2  LEU   4          2HB       LEU   4  -1.744   5.721  -1.532
   23    HB3  LEU   4          1HB       LEU   4  -0.641   4.501  -2.118
   24    HG   LEU   4           HG       LEU   4  -2.300   6.376  -3.811
   25   HD11  LEU   4          1HD1      LEU   4  -0.157   7.326  -4.466
   26   HD12  LEU   4          2HD1      LEU   4   0.672   6.250  -3.343
   27   HD13  LEU   4          3HD1      LEU   4  -0.424   7.480  -2.733
   28   HD21  LEU   4          1HD2      LEU   4  -1.045   5.452  -5.713
   29   HD22  LEU   4          2HD2      LEU   4  -2.073   4.247  -4.945
   30   HD23  LEU   4          3HD2      LEU   4  -0.332   4.243  -4.645
   31    H    GLN   5           H        GLN   5  -3.632   4.697  -0.080
   32    HA   GLN   5           HA       GLN   5  -2.281   2.829   1.596
   33    HB2  GLN   5          2HB       GLN   5  -4.673   4.552   2.191
   34    HB3  GLN   5          1HB       GLN   5  -3.666   3.752   3.386
   35    HG2  GLN   5          2HG       GLN   5  -1.763   5.114   2.706
   36    HG3  GLN   5          1HG       GLN   5  -2.760   5.896   1.476
   37   HE21  GLN   5          1HE2      GLN   5  -2.005   5.672   4.796
   38   HE22  GLN   5          2HE2      GLN   5  -3.016   6.974   5.332
   39    H    ARG   6           H        ARG   6  -5.708   3.100   0.617
   40    HA   ARG   6           HA       ARG   6  -6.556   0.797   2.039
   41    HB2  ARG   6          2HB       ARG   6  -7.820   2.372  -0.173
   42    HB3  ARG   6          1HB       ARG   6  -8.587   0.963   0.533
   43    HG2  ARG   6          2HG       ARG   6  -8.582   2.089   2.722
   44    HG3  ARG   6          1HG       ARG   6  -7.861   3.515   1.963
   45    HD2  ARG   6          2HD       ARG   6 -10.352   3.647   2.213
   46    HD3  ARG   6          1HD       ARG   6  -9.775   3.811   0.553
   47    HE   ARG   6           HE       ARG   6 -10.364   1.122   1.230
   48   HH11  ARG   6          1HH1      ARG   6 -12.069   4.109   0.397
   49   HH12  ARG   6          2HH1      ARG   6 -13.261   3.337  -0.534
   50   HH21  ARG   6          1HH2      ARG   6 -11.953   0.062  -0.103
   51   HH22  ARG   6          2HH2      ARG   6 -13.196   0.977  -0.832
   52    H    LYS   7           H        LYS   7  -5.185   1.269  -1.075
   53    HA   LYS   7           HA       LYS   7  -6.033  -0.925  -2.501
   54    HB2  LYS   7          2HB       LYS   7  -4.614   0.907  -3.332
   55    HB3  LYS   7          1HB       LYS   7  -3.257   0.244  -2.438
   56    HG2  LYS   7          2HG       LYS   7  -3.364  -1.786  -3.793
   57    HG3  LYS   7          1HG       LYS   7  -4.720  -1.112  -4.693
   58    HD2  LYS   7          2HD       LYS   7  -1.940   0.048  -4.542
   59    HD3  LYS   7          1HD       LYS   7  -2.614  -0.827  -5.910
   60    HE2  LYS   7          2HE       LYS   7  -3.595   1.831  -4.825
   61    HE3  LYS   7          1HE       LYS   7  -2.667   1.584  -6.291
   62    HZ1  LYS   7          1HZ       LYS   7  -4.564   0.280  -7.184
   63    HZ2  LYS   7          2HZ       LYS   7  -4.924   1.878  -6.831
   64    HZ3  LYS   7          3HZ       LYS   7  -5.471   0.693  -5.809
   65    H    CYS   8           H        CYS   8  -3.219  -0.681  -0.346
   66    HA   CYS   8           HA       CYS   8  -2.370  -3.347  -0.576
   67    HB2  CYS   8          2HB       CYS   8  -2.085  -1.641   1.863
   68    HB3  CYS   8          1HB       CYS   8  -1.019  -2.918   1.284
   69    H    LYS   9           H        LYS   9  -4.576  -1.731   1.611
   70    HA   LYS   9           HA       LYS   9  -4.846  -3.812   3.464
   71    HB2  LYS   9          2HB       LYS   9  -6.694  -1.528   2.785
   72    HB3  LYS   9          1HB       LYS   9  -6.888  -2.585   4.178
   73    HG2  LYS   9          2HG       LYS   9  -4.760  -1.852   5.076
   74    HG3  LYS   9          1HG       LYS   9  -4.483  -0.856   3.650
   75    HD2  LYS   9          2HD       LYS   9  -6.362   0.551   4.200
   76    HD3  LYS   9          1HD       LYS   9  -6.809  -0.518   5.529
   77    HE2  LYS   9          2HE       LYS   9  -4.207   1.002   5.371
   78    HE3  LYS   9          1HE       LYS   9  -5.631   1.557   6.247
   79    HZ1  LYS   9          1HZ       LYS   9  -4.135  -0.952   6.812
   80    HZ2  LYS   9          2HZ       LYS   9  -5.506  -0.452   7.603
   81    HZ3  LYS   9          3HZ       LYS   9  -4.099   0.449   7.748
   82    H    GLU  10           H        GLU  10  -6.609  -3.052   0.527
   83    HA   GLU  10           HA       GLU  10  -8.317  -5.346   0.950
   84    HB2  GLU  10          2HB       GLU  10  -8.262  -3.238  -1.198
   85    HB3  GLU  10          1HB       GLU  10  -9.361  -4.615  -1.236
   86    HG2  GLU  10          2HG       GLU  10 -10.312  -3.945   0.890
   87    HG3  GLU  10          1HG       GLU  10  -9.187  -2.600   0.981
   88    H    LEU  11           H        LEU  11  -5.379  -4.699  -0.578
   89    HA   LEU  11           HA       LEU  11  -5.518  -6.877  -2.447
   90    HB2  LEU  11          2HB       LEU  11  -4.157  -4.850  -2.882
   91    HB3  LEU  11          1HB       LEU  11  -3.172  -5.214  -1.493
   92    HG   LEU  11           HG       LEU  11  -2.109  -5.656  -3.707
   93   HD11  LEU  11          1HD1      LEU  11  -1.157  -7.850  -3.150
   94   HD12  LEU  11          2HD1      LEU  11  -2.344  -8.003  -1.855
   95   HD13  LEU  11          3HD1      LEU  11  -1.146  -6.710  -1.809
   96   HD21  LEU  11          1HD2      LEU  11  -4.036  -6.490  -4.918
   97   HD22  LEU  11          2HD2      LEU  11  -4.107  -7.906  -3.869
   98   HD23  LEU  11          3HD2      LEU  11  -2.730  -7.675  -4.946
   99    H    DAS  12           H        DAS  12  -3.670  -6.274   0.570
  100    HA   DAS  12           HA       DAS  12  -3.051  -9.106   0.693
  101    HB2  DAS  12          1HB       DAS  12  -5.162  -8.867   1.937
  102    HB3  DAS  12          2HB       DAS  12  -4.434  -7.608   2.925
  103    H    THR  13           H        THR  13  -1.147  -9.536   1.752
  104    HA   THR  13           HA       THR  13   0.333  -7.219   2.753
  105    HB   THR  13           HB       THR  13   1.593  -9.042   4.104
  106    HG1  THR  13          1HG       THR  13  -0.670 -10.541   4.265
  107   HG21  THR  13          1HG2      THR  13   0.098  -7.396   5.143
  108   HG22  THR  13          2HG2      THR  13  -0.081  -8.976   5.909
  109   HG23  THR  13          3HG2      THR  13  -1.290  -8.412   4.759
  110    H    ARG  14           H        ARG  14   0.271  -7.830   0.101
  111    HA   ARG  14           HA       ARG  14   2.880  -9.078  -0.448
  112    HB2  ARG  14          2HB       ARG  14   0.476  -8.696  -2.246
  113    HB3  ARG  14          1HB       ARG  14   1.989  -9.397  -2.776
  114    HG2  ARG  14          2HG       ARG  14   0.231 -10.573  -0.622
  115    HG3  ARG  14          1HG       ARG  14   0.165 -11.042  -2.315
  116    HD2  ARG  14          2HD       ARG  14   1.471 -12.673  -1.111
  117    HD3  ARG  14          1HD       ARG  14   2.549 -11.757  -2.150
  118    HE   ARG  14           HE       ARG  14   2.547 -10.589   0.411
  119   HH11  ARG  14          1HH1      ARG  14   3.618 -13.621  -1.105
  120   HH12  ARG  14          2HH1      ARG  14   4.902 -13.853  -0.024
  121   HH21  ARG  14          1HH2      ARG  14   4.358 -10.906   1.861
  122   HH22  ARG  14          2HH2      ARG  14   5.326 -12.282   1.690
  123    HA   DPR  15           HA       DPR  15   3.536  -5.305  -3.122
  124    HB2  DPR  15          1HB       DPR  15   6.333  -6.124  -3.192
  125    HB3  DPR  15          2HB       DPR  15   5.217  -5.897  -4.540
  126    HG2  DPR  15          1HG       DPR  15   6.135  -8.332  -3.802
  127    HG3  DPR  15          2HG       DPR  15   4.527  -8.088  -4.506
  128    HD2  DPR  15          1HD       DPR  15   5.304  -8.439  -1.642
  129    HD3  DPR  15          2HD       DPR  15   3.960  -9.178  -2.531
  130    H    DGL  16           H        DGL  16   5.118  -6.645  -0.374
  131    HA   DGL  16           HA       DGL  16   6.790  -4.541   0.437
  132    HB2  DGL  16          1HB       DGL  16   6.629  -6.910   1.354
  133    HB3  DGL  16          2HB       DGL  16   5.212  -6.376   2.237
  134    HG2  DGL  16          1HG       DGL  16   7.137  -6.388   3.676
  135    HG3  DGL  16          2HG       DGL  16   6.566  -4.735   3.426
  136    H    DAL  17           H        DAL  17   3.390  -5.270   1.018
  137    HA   DAL  17           HA       DAL  17   2.881  -3.102   2.757
  138    HB1  DAL  17          1HB       DAL  17   1.446  -5.107   2.638
  139    HB2  DAL  17          2HB       DAL  17   0.925  -4.624   1.021
  140    HB3  DAL  17          3HB       DAL  17   0.535  -3.618   2.420
  141    H    DGL  18           H        DGL  18   2.350  -3.645  -0.673
  142    HA   DGL  18           HA       DGL  18   1.230  -1.312  -1.585
  143    HB2  DGL  18          1HB       DGL  18   1.648  -3.238  -2.989
  144    HB3  DGL  18          2HB       DGL  18   3.378  -3.070  -2.780
  145    HG2  DGL  18          1HG       DGL  18   2.807  -2.344  -4.972
  146    HG3  DGL  18          2HG       DGL  18   3.314  -0.967  -3.991
  147    H    DAR  19           H        DAR  19   4.649  -2.021  -1.247
  148    HA   DAR  19           HA       DAR  19   5.694   0.459  -1.996
  149    HB2  DAR  19          1HB       DAR  19   6.768  -1.737  -0.254
  150    HB3  DAR  19          2HB       DAR  19   7.712  -0.324  -0.695
  151    HG2  DAR  19          1HG       DAR  19   7.673  -0.916  -3.004
  152    HG3  DAR  19          2HG       DAR  19   6.460  -2.161  -2.709
  153    HD2  DAR  19          1HD       DAR  19   8.826  -2.985  -2.999
  154    HD3  DAR  19          2HD       DAR  19   7.983  -3.530  -1.551
  155    HE   DAR  19           HE       DAR  19   9.666  -1.171  -1.328
  156   HH11  DAR  19          1HH2      DAR  19  11.225  -1.256   0.393
  157   HH12  DAR  19          2HH2      DAR  19  11.589  -2.739   1.169
  158   HH21  DAR  19          1HH1      DAR  19   9.380  -4.658  -0.855
  159   HH22  DAR  19          2HH1      DAR  19  10.441  -4.740   0.463
  160    H    DLY  20           H        DLY  20   4.981  -0.850   1.227
  161    HA   DLY  20           HA       DLY  20   5.906   1.377   2.661
  162    HB2  DLY  20          1HB       DLY  20   5.448  -0.989   3.500
  163    HB3  DLY  20          2HB       DLY  20   3.757  -0.552   3.569
  164    HG2  DLY  20          1HG       DLY  20   5.856   0.945   5.117
  165    HG3  DLY  20          2HG       DLY  20   5.042  -0.478   5.752
  166    HD2  DLY  20          1HD       DLY  20   2.877   0.649   5.524
  167    HD3  DLY  20          2HD       DLY  20   3.708   2.088   4.936
  168    HE2  DLY  20          1HE       DLY  20   4.870   2.350   7.024
  169    HE3  DLY  20          2HE       DLY  20   4.244   0.818   7.619
  170    HZ1  DLY  20          1HZ       DLY  20   3.058   2.836   8.479
  171    HZ2  DLY  20          2HZ       DLY  20   2.100   1.685   7.773
  172    HZ3  DLY  20          3HZ       DLY  20   2.432   3.074   6.924
  173    H    DCY  21           H        DCY  21   2.721   0.628   1.302
  174    HA   DCY  21           HA       DCY  21   1.271   2.760   2.434
  175    HB2  DCY  21          1HB       DCY  21   0.909   1.374  -0.205
  176    HB3  DCY  21          2HB       DCY  21  -0.267   2.475   0.504
  177    H    DAR  22           H        DAR  22   3.031   2.525  -0.623
  178    HA   DAR  22           HA       DAR  22   2.394   5.223  -1.273
  179    HB2  DAR  22          1HB       DAR  22   4.221   3.219  -2.557
  180    HB3  DAR  22          2HB       DAR  22   4.084   4.880  -3.124
  181    HG2  DAR  22          1HG       DAR  22   1.684   4.548  -3.495
  182    HG3  DAR  22          2HG       DAR  22   1.830   2.884  -2.935
  183    HD2  DAR  22          1HD       DAR  22   3.386   3.974  -5.261
  184    HD3  DAR  22          2HD       DAR  22   1.810   3.209  -5.426
  185    HE   DAR  22           HE       DAR  22   2.715   1.220  -4.556
  186   HH11  DAR  22          1HH1      DAR  22   5.101   3.643  -5.604
  187   HH12  DAR  22          2HH1      DAR  22   6.357   2.519  -5.866
  188   HH21  DAR  22          1HH2      DAR  22   4.495  -0.353  -5.018
  189   HH22  DAR  22          2HH2      DAR  22   6.005   0.214  -5.554
  190    H    DGL  23           H        DGL  23   4.843   3.710   0.532
  191    HA   DGL  23           HA       DGL  23   6.733   5.823   0.446
  192    HB2  DGL  23          1HB       DGL  23   7.331   3.538   1.141
  193    HB3  DGL  23          2HB       DGL  23   6.280   3.690   2.540
  194    HG2  DGL  23          1HG       DGL  23   7.690   5.510   3.387
  195    HG3  DGL  23          2HG       DGL  23   8.769   5.290   2.010
  196    H    DGL  24           H        DGL  24   4.167   4.896   2.750
  197    HA   DGL  24           HA       DGL  24   4.608   7.175   4.395
  198    HB2  DGL  24          1HB       DGL  24   2.486   6.612   5.538
  199    HB3  DGL  24          2HB       DGL  24   3.544   5.223   5.400
  200    HG2  DGL  24          1HG       DGL  24   2.224   4.282   3.653
  201    HG3  DGL  24          2HG       DGL  24   1.232   5.732   3.548
  202    H    SER  25           H        SER  25   2.295   6.464   1.839
  203    HA   SER  25           HA       SER  25   2.018   9.244   1.251
  204    HB2  SER  25          2HB       SER  25   2.047   7.512  -0.527
  205    HB3  SER  25          1HB       SER  25   0.576   6.816   0.141
  206    HG   SER  25           HG       SER  25   0.967   9.164  -1.299
  207    H    ASP  26           H        ASP  26  -0.176  10.210   1.130
  208    HA   ASP  26           HA       ASP  26  -1.908   9.217   3.287
  209    HB2  ASP  26          2HB       ASP  26  -1.386  12.099   2.479
  210    HB3  ASP  26          1HB       ASP  26  -2.611  11.603   3.639
  Start of MODEL    5
    1    H    ASN   1           H        ASN   1  -1.561   8.910   0.642
    2    HA   ASN   1           HA       ASN   1  -4.145   9.736   0.019
    3    HB2  ASN   1          2HB       ASN   1  -2.466   7.682  -1.432
    4    HB3  ASN   1          1HB       ASN   1  -3.885   8.473  -2.102
    5   HD21  ASN   1          1HD2      ASN   1  -1.163   8.501  -3.094
    6   HD22  ASN   1          2HD2      ASN   1  -0.678  10.153  -3.084
    7    HA   PRO   2           HA       PRO   2  -6.643   6.535   2.038
    8    HB2  PRO   2          2HB       PRO   2  -8.632   7.820   0.220
    9    HB3  PRO   2          1HB       PRO   2  -8.779   7.420   1.936
   10    HG2  PRO   2          2HG       PRO   2  -8.372   9.925   1.204
   11    HG3  PRO   2          1HG       PRO   2  -7.513   9.258   2.604
   12    HD2  PRO   2          2HD       PRO   2  -6.505   9.813  -0.149
   13    HD3  PRO   2          1HD       PRO   2  -5.689   9.991   1.416
   14    H    GLU   3           H        GLU   3  -6.743   7.230  -1.412
   15    HA   GLU   3           HA       GLU   3  -7.994   4.823  -2.203
   16    HB2  GLU   3          2HB       GLU   3  -7.950   6.859  -3.568
   17    HB3  GLU   3          1HB       GLU   3  -6.215   6.695  -3.745
   18    HG2  GLU   3          2HG       GLU   3  -6.466   4.724  -5.047
   19    HG3  GLU   3          1HG       GLU   3  -8.207   4.694  -4.745
   20    H    LEU   4           H        LEU   4  -4.676   5.705  -1.629
   21    HA   LEU   4           HA       LEU   4  -3.670   3.276  -2.798
   22    HB2  LEU   4          2HB       LEU   4  -2.382   5.403  -2.815
   23    HB3  LEU   4          1HB       LEU   4  -2.231   5.284  -1.073
   24    HG   LEU   4           HG       LEU   4  -0.979   3.171  -1.357
   25   HD11  LEU   4          1HD1      LEU   4  -0.093   2.596  -3.562
   26   HD12  LEU   4          2HD1      LEU   4  -1.108   3.840  -4.290
   27   HD13  LEU   4          3HD1      LEU   4  -1.848   2.449  -3.501
   28   HD21  LEU   4          1HD2      LEU   4   0.161   5.269  -1.072
   29   HD22  LEU   4          2HD2      LEU   4   0.119   5.553  -2.817
   30   HD23  LEU   4          3HD2      LEU   4   1.061   4.210  -2.155
   31    H    GLN   5           H        GLN   5  -4.452   4.518   0.371
   32    HA   GLN   5           HA       GLN   5  -3.491   2.397   1.936
   33    HB2  GLN   5          2HB       GLN   5  -5.904   4.179   2.290
   34    HB3  GLN   5          1HB       GLN   5  -5.407   3.003   3.494
   35    HG2  GLN   5          2HG       GLN   5  -3.289   4.154   3.772
   36    HG3  GLN   5          1HG       GLN   5  -3.738   5.307   2.515
   37   HE21  GLN   5          1HE2      GLN   5  -5.132   6.949   3.005
   38   HE22  GLN   5          2HE2      GLN   5  -5.712   7.264   4.594
   39    H    ARG   6           H        ARG   6  -6.540   2.873   0.293
   40    HA   ARG   6           HA       ARG   6  -7.798   0.438   0.871
   41    HB2  ARG   6          2HB       ARG   6  -7.968   2.201  -1.550
   42    HB3  ARG   6          1HB       ARG   6  -9.007   0.813  -1.291
   43    HG2  ARG   6          2HG       ARG   6  -9.911   1.834   0.705
   44    HG3  ARG   6          1HG       ARG   6  -8.824   3.216   0.505
   45    HD2  ARG   6          2HD       ARG   6 -11.098   3.656  -0.356
   46    HD3  ARG   6          1HD       ARG   6  -9.849   3.765  -1.598
   47    HE   ARG   6           HE       ARG   6 -11.074   1.185  -1.373
   48   HH11  ARG   6          1HH1      ARG   6 -11.249   4.331  -2.975
   49   HH12  ARG   6          2HH1      ARG   6 -12.182   3.764  -4.279
   50   HH21  ARG   6          1HH2      ARG   6 -12.257   0.401  -3.137
   51   HH22  ARG   6          2HH2      ARG   6 -12.774   1.425  -4.396
   52    H    LYS   7           H        LYS   7  -5.592   1.339  -1.712
   53    HA   LYS   7           HA       LYS   7  -5.617  -0.920  -3.314
   54    HB2  LYS   7          2HB       LYS   7  -4.440   1.160  -3.890
   55    HB3  LYS   7          1HB       LYS   7  -3.291   0.879  -2.600
   56    HG2  LYS   7          2HG       LYS   7  -2.270   0.352  -4.711
   57    HG3  LYS   7          1HG       LYS   7  -2.497  -1.137  -3.796
   58    HD2  LYS   7          2HD       LYS   7  -4.480  -1.656  -5.099
   59    HD3  LYS   7          1HD       LYS   7  -4.325  -0.132  -5.972
   60    HE2  LYS   7          2HE       LYS   7  -3.460  -1.972  -7.312
   61    HE3  LYS   7          1HE       LYS   7  -2.169  -0.863  -6.867
   62    HZ1  LYS   7          1HZ       LYS   7  -2.723  -3.415  -5.440
   63    HZ2  LYS   7          2HZ       LYS   7  -1.336  -2.406  -5.270
   64    HZ3  LYS   7          3HZ       LYS   7  -1.601  -3.225  -6.679
   65    H    CYS   8           H        CYS   8  -3.436  -0.227  -0.586
   66    HA   CYS   8           HA       CYS   8  -2.202  -2.765  -0.591
   67    HB2  CYS   8          2HB       CYS   8  -2.463  -0.794   1.659
   68    HB3  CYS   8          1HB       CYS   8  -1.315  -2.127   1.568
   69    H    LYS   9           H        LYS   9  -4.999  -1.464   1.056
   70    HA   LYS   9           HA       LYS   9  -5.258  -3.505   2.961
   71    HB2  LYS   9          2HB       LYS   9  -6.343  -1.229   3.025
   72    HB3  LYS   9          1HB       LYS   9  -7.462  -1.799   1.805
   73    HG2  LYS   9          2HG       LYS   9  -8.514  -1.919   3.956
   74    HG3  LYS   9          1HG       LYS   9  -8.232  -3.550   3.355
   75    HD2  LYS   9          2HD       LYS   9  -7.670  -3.449   5.711
   76    HD3  LYS   9          1HD       LYS   9  -6.208  -3.700   4.772
   77    HE2  LYS   9          2HE       LYS   9  -5.612  -1.361   5.003
   78    HE3  LYS   9          1HE       LYS   9  -7.137  -1.028   5.824
   79    HZ1  LYS   9          1HZ       LYS   9  -6.413  -2.523   7.613
   80    HZ2  LYS   9          2HZ       LYS   9  -5.346  -1.247   7.420
   81    HZ3  LYS   9          3HZ       LYS   9  -4.940  -2.762   6.833
   82    H    GLU  10           H        GLU  10  -6.570  -3.118  -0.309
   83    HA   GLU  10           HA       GLU  10  -7.917  -5.646  -0.091
   84    HB2  GLU  10          2HB       GLU  10  -8.584  -5.312  -2.453
   85    HB3  GLU  10          1HB       GLU  10  -9.022  -3.969  -1.414
   86    HG2  GLU  10          2HG       GLU  10  -7.181  -2.670  -2.266
   87    HG3  GLU  10          1HG       GLU  10  -6.653  -4.026  -3.259
   88    H    LEU  11           H        LEU  11  -4.869  -4.526  -1.187
   89    HA   LEU  11           HA       LEU  11  -4.176  -6.787  -2.740
   90    HB2  LEU  11          2HB       LEU  11  -3.018  -4.649  -2.941
   91    HB3  LEU  11          1HB       LEU  11  -2.450  -4.802  -1.292
   92    HG   LEU  11           HG       LEU  11  -1.104  -6.756  -1.950
   93   HD11  LEU  11          1HD1      LEU  11  -0.729  -7.209  -4.330
   94   HD12  LEU  11          2HD1      LEU  11  -2.016  -6.074  -4.743
   95   HD13  LEU  11          3HD1      LEU  11  -2.388  -7.545  -3.843
   96   HD21  LEU  11          1HD2      LEU  11  -0.625  -4.248  -3.540
   97   HD22  LEU  11          2HD2      LEU  11   0.575  -5.495  -3.197
   98   HD23  LEU  11          3HD2      LEU  11  -0.118  -4.552  -1.878
   99    H    DAS  12           H        DAS  12  -3.628  -5.932   0.687
  100    HA   DAS  12           HA       DAS  12  -2.888  -8.725   1.117
  101    HB2  DAS  12          1HB       DAS  12  -3.781  -8.651   3.256
  102    HB3  DAS  12          2HB       DAS  12  -4.888  -7.564   2.439
  103    H    THR  13           H        THR  13  -1.150  -9.024   2.653
  104    HA   THR  13           HA       THR  13   0.502  -6.714   3.197
  105    HB   THR  13           HB       THR  13   0.952  -9.615   3.952
  106    HG1  THR  13          1HG       THR  13  -0.974  -7.821   4.702
  107   HG21  THR  13          1HG2      THR  13   1.819  -7.013   5.249
  108   HG22  THR  13          2HG2      THR  13   2.868  -8.061   4.298
  109   HG23  THR  13          3HG2      THR  13   2.206  -8.634   5.828
  110    H    ARG  14           H        ARG  14   0.030  -8.306   0.592
  111    HA   ARG  14           HA       ARG  14   2.567  -9.324  -0.217
  112    HB2  ARG  14          2HB       ARG  14   0.172  -8.530  -1.895
  113    HB3  ARG  14          1HB       ARG  14   1.540  -9.481  -2.451
  114    HG2  ARG  14          2HG       ARG  14   0.934 -11.242  -0.805
  115    HG3  ARG  14          1HG       ARG  14  -0.476 -10.286  -0.360
  116    HD2  ARG  14          2HD       ARG  14  -1.069 -12.045  -1.932
  117    HD3  ARG  14          1HD       ARG  14  -1.306 -10.451  -2.652
  118    HE   ARG  14           HE       ARG  14   1.239 -11.244  -3.344
  119   HH11  ARG  14          1HH1      ARG  14  -2.030 -12.501  -3.945
  120   HH12  ARG  14          2HH1      ARG  14  -1.647 -13.157  -5.455
  121   HH21  ARG  14          1HH2      ARG  14   1.758 -12.093  -5.417
  122   HH22  ARG  14          2HH2      ARG  14   0.578 -12.891  -6.345
  123    HA   DPR  15           HA       DPR  15   3.715  -5.703  -2.803
  124    HB2  DPR  15          1HB       DPR  15   6.383  -6.219  -2.884
  125    HB3  DPR  15          2HB       DPR  15   5.225  -6.996  -3.968
  126    HG2  DPR  15          1HG       DPR  15   6.520  -8.059  -1.491
  127    HG3  DPR  15          2HG       DPR  15   6.165  -8.891  -3.012
  128    HD2  DPR  15          1HD       DPR  15   4.644  -9.123  -0.749
  129    HD3  DPR  15          2HD       DPR  15   4.010  -9.362  -2.387
  130    H    DGL  16           H        DGL  16   4.681  -6.782   0.269
  131    HA   DGL  16           HA       DGL  16   6.452  -4.753   1.100
  132    HB2  DGL  16          1HB       DGL  16   6.230  -6.890   2.277
  133    HB3  DGL  16          2HB       DGL  16   4.586  -6.477   2.734
  134    HG2  DGL  16          1HG       DGL  16   5.439  -4.578   4.026
  135    HG3  DGL  16          2HG       DGL  16   7.084  -5.053   3.617
  136    H    DAL  17           H        DAL  17   2.960  -5.161   1.532
  137    HA   DAL  17           HA       DAL  17   2.606  -2.781   3.018
  138    HB1  DAL  17          1HB       DAL  17   0.227  -3.103   2.659
  139    HB2  DAL  17          2HB       DAL  17   1.003  -4.620   3.108
  140    HB3  DAL  17          3HB       DAL  17   0.561  -4.319   1.425
  141    H    DGL  18           H        DGL  18   2.187  -3.606  -0.365
  142    HA   DGL  18           HA       DGL  18   1.242  -1.263  -1.483
  143    HB2  DGL  18          1HB       DGL  18   1.667  -3.378  -2.698
  144    HB3  DGL  18          2HB       DGL  18   3.391  -3.113  -2.549
  145    HG2  DGL  18          1HG       DGL  18   2.865  -2.513  -4.743
  146    HG3  DGL  18          2HG       DGL  18   3.065  -0.996  -3.869
  147    H    DAR  19           H        DAR  19   4.603  -2.209  -0.973
  148    HA   DAR  19           HA       DAR  19   5.745   0.207  -1.828
  149    HB2  DAR  19          1HB       DAR  19   7.118  -1.788  -1.757
  150    HB3  DAR  19          2HB       DAR  19   6.913  -1.920  -0.015
  151    HG2  DAR  19          1HG       DAR  19   9.115  -1.029  -0.540
  152    HG3  DAR  19          2HG       DAR  19   8.144   0.199   0.273
  153    HD2  DAR  19          1HD       DAR  19   7.555   1.086  -2.022
  154    HD3  DAR  19          2HD       DAR  19   8.794   0.006  -2.653
  155    HE   DAR  19           HE       DAR  19   9.635   1.756  -0.547
  156   HH11  DAR  19          1HH2      DAR  19  11.050   3.550  -1.069
  157   HH12  DAR  19          2HH2      DAR  19  11.509   3.822  -2.695
  158   HH21  DAR  19          1HH1      DAR  19   9.537   1.187  -4.024
  159   HH22  DAR  19          2HH1      DAR  19  10.595   2.453  -4.430
  160    H    DLY  20           H        DLY  20   4.829  -0.949   1.360
  161    HA   DLY  20           HA       DLY  20   5.852   1.092   2.961
  162    HB2  DLY  20          1HB       DLY  20   4.786  -0.968   3.827
  163    HB3  DLY  20          2HB       DLY  20   3.237  -0.390   3.249
  164    HG2  DLY  20          1HG       DLY  20   3.433   1.545   4.810
  165    HG3  DLY  20          2HG       DLY  20   4.907   0.817   5.454
  166    HD2  DLY  20          1HD       DLY  20   3.117   0.199   6.911
  167    HD3  DLY  20          2HD       DLY  20   3.565  -1.230   5.986
  168    HE2  DLY  20          1HE       DLY  20   1.185  -1.142   6.051
  169    HE3  DLY  20          2HE       DLY  20   1.668  -0.726   4.417
  170    HZ1  DLY  20          1HZ       DLY  20   1.385   1.693   5.094
  171    HZ2  DLY  20          2HZ       DLY  20   0.731   1.114   6.539
  172    HZ3  DLY  20          3HZ       DLY  20  -0.017   0.750   5.092
  173    H    DCY  21           H        DCY  21   2.698   0.809   1.384
  174    HA   DCY  21           HA       DCY  21   1.622   3.249   2.202
  175    HB2  DCY  21          1HB       DCY  21   1.145   1.635  -0.265
  176    HB3  DCY  21          2HB       DCY  21   0.089   2.938   0.304
  177    H    DAR  22           H        DAR  22   3.316   2.340  -0.792
  178    HA   DAR  22           HA       DAR  22   3.007   4.905  -1.951
  179    HB2  DAR  22          1HB       DAR  22   4.911   2.688  -2.680
  180    HB3  DAR  22          2HB       DAR  22   4.569   4.097  -3.670
  181    HG2  DAR  22          1HG       DAR  22   2.179   3.376  -3.739
  182    HG3  DAR  22          2HG       DAR  22   2.658   1.892  -2.914
  183    HD2  DAR  22          1HD       DAR  22   2.546   1.480  -5.275
  184    HD3  DAR  22          2HD       DAR  22   4.231   1.424  -4.754
  185    HE   DAR  22           HE       DAR  22   3.474   4.012  -5.596
  186   HH11  DAR  22          1HH1      DAR  22   4.439   0.855  -6.875
  187   HH12  DAR  22          2HH1      DAR  22   4.991   1.482  -8.362
  188   HH21  DAR  22          1HH2      DAR  22   4.242   4.844  -7.658
  189   HH22  DAR  22          2HH2      DAR  22   4.876   3.769  -8.822
  190    H    DGL  23           H        DGL  23   5.294   3.602   0.222
  191    HA   DGL  23           HA       DGL  23   7.323   5.574  -0.263
  192    HB2  DGL  23          1HB       DGL  23   7.723   3.263   0.667
  193    HB3  DGL  23          2HB       DGL  23   6.920   3.770   2.139
  194    HG2  DGL  23          1HG       DGL  23   9.221   3.884   2.565
  195    HG3  DGL  23          2HG       DGL  23   8.663   5.545   2.382
  196    H    DGL  24           H        DGL  24   4.652   5.086   2.022
  197    HA   DGL  24           HA       DGL  24   5.394   7.437   3.529
  198    HB2  DGL  24          1HB       DGL  24   3.611   6.865   5.058
  199    HB3  DGL  24          2HB       DGL  24   4.616   5.459   4.748
  200    HG2  DGL  24          1HG       DGL  24   2.956   4.522   3.288
  201    HG3  DGL  24          2HG       DGL  24   1.960   5.970   3.421
  202    H    SER  25           H        SER  25   2.835   6.550   1.250
  203    HA   SER  25           HA       SER  25   2.070   9.340   1.079
  204    HB2  SER  25          2HB       SER  25   1.021   6.922  -0.393
  205    HB3  SER  25          1HB       SER  25   0.719   8.608  -0.814
  206    HG   SER  25           HG       SER  25   3.256   8.496  -0.727
  207    H    ASP  26           H        ASP  26   0.155  10.138   1.834
  208    HA   ASP  26           HA       ASP  26  -1.275   8.495   3.776
  209    HB2  ASP  26          2HB       ASP  26  -2.213  10.552   4.613
  210    HB3  ASP  26          1HB       ASP  26  -0.505  10.816   4.320
  Start of MODEL    6
    1    H    ASN   1           H        ASN   1  -1.697   9.764  -0.009
    2    HA   ASN   1           HA       ASN   1  -4.288  10.202  -0.965
    3    HB2  ASN   1          2HB       ASN   1  -2.222   8.173  -1.866
    4    HB3  ASN   1          1HB       ASN   1  -3.707   8.521  -2.733
    5   HD21  ASN   1          1HD2      ASN   1  -0.894   8.785  -3.534
    6   HD22  ASN   1          2HD2      ASN   1  -0.692  10.429  -3.996
    7    HA   PRO   2           HA       PRO   2  -6.246   7.059   1.625
    8    HB2  PRO   2          2HB       PRO   2  -8.587   7.731  -0.069
    9    HB3  PRO   2          1HB       PRO   2  -8.437   7.732   1.692
   10    HG2  PRO   2          2HG       PRO   2  -8.518  10.022   0.352
   11    HG3  PRO   2          1HG       PRO   2  -7.432   9.821   1.737
   12    HD2  PRO   2          2HD       PRO   2  -6.808   9.745  -1.186
   13    HD3  PRO   2          1HD       PRO   2  -5.908  10.494   0.155
   14    H    GLU   3           H        GLU   3  -6.666   7.234  -1.847
   15    HA   GLU   3           HA       GLU   3  -7.674   4.619  -2.255
   16    HB2  GLU   3          2HB       GLU   3  -6.138   6.404  -4.156
   17    HB3  GLU   3          1HB       GLU   3  -6.917   4.907  -4.624
   18    HG2  GLU   3          2HG       GLU   3  -8.261   6.801  -5.282
   19    HG3  GLU   3          1HG       GLU   3  -9.096   5.871  -4.042
   20    H    LEU   4           H        LEU   4  -4.446   5.950  -2.133
   21    HA   LEU   4           HA       LEU   4  -3.203   3.535  -2.994
   22    HB2  LEU   4          2HB       LEU   4  -2.273   5.883  -3.327
   23    HB3  LEU   4          1HB       LEU   4  -1.946   5.898  -1.619
   24    HG   LEU   4           HG       LEU   4  -0.295   4.149  -1.830
   25   HD11  LEU   4          1HD1      LEU   4  -1.031   4.111  -4.763
   26   HD12  LEU   4          2HD1      LEU   4  -1.334   2.816  -3.600
   27   HD13  LEU   4          3HD1      LEU   4   0.317   3.242  -4.033
   28   HD21  LEU   4          1HD2      LEU   4   0.031   6.253  -3.960
   29   HD22  LEU   4          2HD2      LEU   4   1.332   5.317  -3.225
   30   HD23  LEU   4          3HD2      LEU   4   0.396   6.446  -2.247
   31    H    GLN   5           H        GLN   5  -3.967   5.085   0.041
   32    HA   GLN   5           HA       GLN   5  -2.566   3.307   1.751
   33    HB2  GLN   5          2HB       GLN   5  -5.117   4.823   2.280
   34    HB3  GLN   5          1HB       GLN   5  -4.116   4.062   3.500
   35    HG2  GLN   5          2HG       GLN   5  -2.310   5.608   2.989
   36    HG3  GLN   5          1HG       GLN   5  -3.305   6.355   1.733
   37   HE21  GLN   5          1HE2      GLN   5  -2.200   7.548   4.102
   38   HE22  GLN   5          2HE2      GLN   5  -3.546   8.114   5.042
   39    H    ARG   6           H        ARG   6  -5.965   3.399   0.679
   40    HA   ARG   6           HA       ARG   6  -6.808   1.062   1.939
   41    HB2  ARG   6          2HB       ARG   6  -7.779   2.380  -0.571
   42    HB3  ARG   6          1HB       ARG   6  -8.533   0.940   0.082
   43    HG2  ARG   6          2HG       ARG   6  -8.810   2.316   2.236
   44    HG3  ARG   6          1HG       ARG   6  -8.475   3.716   1.203
   45    HD2  ARG   6          2HD       ARG   6 -10.901   3.212   1.394
   46    HD3  ARG   6          1HD       ARG   6 -10.302   3.113  -0.269
   47    HE   ARG   6           HE       ARG   6 -10.127   0.648   1.111
   48   HH11  ARG   6          1HH1      ARG   6 -12.491   2.629  -0.596
   49   HH12  ARG   6          2HH1      ARG   6 -13.358   1.290  -1.221
   50   HH21  ARG   6          1HH2      ARG   6 -11.293  -1.179   0.234
   51   HH22  ARG   6          2HH2      ARG   6 -12.694  -0.900  -0.694
   52    H    LYS   7           H        LYS   7  -5.138   1.549  -1.038
   53    HA   LYS   7           HA       LYS   7  -5.482  -0.823  -2.395
   54    HB2  LYS   7          2HB       LYS   7  -4.255   1.287  -3.088
   55    HB3  LYS   7          1HB       LYS   7  -2.884   0.678  -2.187
   56    HG2  LYS   7          2HG       LYS   7  -2.818  -1.290  -3.658
   57    HG3  LYS   7          1HG       LYS   7  -4.164  -0.618  -4.585
   58    HD2  LYS   7          2HD       LYS   7  -2.740   1.453  -4.895
   59    HD3  LYS   7          1HD       LYS   7  -1.397   0.516  -4.248
   60    HE2  LYS   7          2HE       LYS   7  -3.017  -0.139  -6.702
   61    HE3  LYS   7          1HE       LYS   7  -1.387   0.524  -6.678
   62    HZ1  LYS   7          1HZ       LYS   7  -2.156  -2.130  -5.594
   63    HZ2  LYS   7          2HZ       LYS   7  -0.562  -1.524  -5.767
   64    HZ3  LYS   7          3HZ       LYS   7  -1.508  -1.830  -7.106
   65    H    CYS   8           H        CYS   8  -3.357  -0.077   0.320
   66    HA   CYS   8           HA       CYS   8  -1.721  -2.345   0.314
   67    HB2  CYS   8          2HB       CYS   8  -2.727  -0.883   2.747
   68    HB3  CYS   8          1HB       CYS   8  -1.253  -1.830   2.609
   69    H    LYS   9           H        LYS   9  -4.843  -1.726   1.833
   70    HA   LYS   9           HA       LYS   9  -4.858  -4.257   3.219
   71    HB2  LYS   9          2HB       LYS   9  -7.062  -2.228   2.884
   72    HB3  LYS   9          1HB       LYS   9  -7.061  -3.570   4.015
   73    HG2  LYS   9          2HG       LYS   9  -5.153  -1.237   4.047
   74    HG3  LYS   9          1HG       LYS   9  -6.550  -1.433   5.099
   75    HD2  LYS   9          2HD       LYS   9  -4.154  -3.288   5.007
   76    HD3  LYS   9          1HD       LYS   9  -4.414  -2.022   6.200
   77    HE2  LYS   9          2HE       LYS   9  -6.204  -4.417   5.768
   78    HE3  LYS   9          1HE       LYS   9  -5.016  -4.236   7.053
   79    HZ1  LYS   9          1HZ       LYS   9  -7.228  -3.704   7.845
   80    HZ2  LYS   9          2HZ       LYS   9  -7.422  -2.531   6.668
   81    HZ3  LYS   9          3HZ       LYS   9  -6.272  -2.320   7.875
   82    H    GLU  10           H        GLU  10  -6.181  -2.876   0.325
   83    HA   GLU  10           HA       GLU  10  -7.938  -5.042  -0.228
   84    HB2  GLU  10          2HB       GLU  10  -6.727  -3.031  -2.131
   85    HB3  GLU  10          1HB       GLU  10  -8.091  -4.077  -2.482
   86    HG2  GLU  10          2HG       GLU  10  -7.996  -1.800  -0.515
   87    HG3  GLU  10          1HG       GLU  10  -8.881  -1.862  -2.034
   88    H    LEU  11           H        LEU  11  -4.574  -4.391  -0.737
   89    HA   LEU  11           HA       LEU  11  -4.090  -6.567  -2.563
   90    HB2  LEU  11          2HB       LEU  11  -2.764  -4.340  -2.226
   91    HB3  LEU  11          1HB       LEU  11  -2.055  -5.148  -0.854
   92    HG   LEU  11           HG       LEU  11  -1.780  -6.000  -3.740
   93   HD11  LEU  11          1HD1      LEU  11   0.157  -4.682  -1.861
   94   HD12  LEU  11          2HD1      LEU  11  -0.599  -3.958  -3.279
   95   HD13  LEU  11          3HD1      LEU  11   0.544  -5.287  -3.469
   96   HD21  LEU  11          1HD2      LEU  11  -1.647  -7.926  -2.226
   97   HD22  LEU  11          2HD2      LEU  11  -0.420  -7.092  -1.271
   98   HD23  LEU  11          3HD2      LEU  11  -0.076  -7.561  -2.936
   99    H    DAS  12           H        DAS  12  -2.964  -5.868   0.754
  100    HA   DAS  12           HA       DAS  12  -2.869  -8.742   1.302
  101    HB2  DAS  12          1HB       DAS  12  -4.902  -7.870   2.280
  102    HB3  DAS  12          2HB       DAS  12  -4.018  -6.559   3.048
  103    H    THR  13           H        THR  13  -0.897  -9.304   2.070
  104    HA   THR  13           HA       THR  13   0.749  -7.211   3.295
  105    HB   THR  13           HB       THR  13   1.987  -9.283   4.192
  106    HG1  THR  13          1HG       THR  13   0.561 -11.122   4.314
  107   HG21  THR  13          1HG2      THR  13   0.392  -9.524   6.058
  108   HG22  THR  13          2HG2      THR  13  -0.850  -8.725   5.092
  109   HG23  THR  13          3HG2      THR  13   0.582  -7.832   5.601
  110    H    ARG  14           H        ARG  14   0.385  -8.924   0.478
  111    HA   ARG  14           HA       ARG  14   3.124  -9.607  -0.055
  112    HB2  ARG  14          2HB       ARG  14   0.690  -9.555  -1.839
  113    HB3  ARG  14          1HB       ARG  14   2.248 -10.196  -2.330
  114    HG2  ARG  14          2HG       ARG  14   0.571 -11.251  -0.052
  115    HG3  ARG  14          1HG       ARG  14   0.675 -11.974  -1.656
  116    HD2  ARG  14          2HD       ARG  14   2.959 -11.616   0.286
  117    HD3  ARG  14          1HD       ARG  14   2.103 -13.122  -0.025
  118    HE   ARG  14           HE       ARG  14   2.885 -12.540  -2.450
  119   HH11  ARG  14          1HH1      ARG  14   4.777 -12.333   0.567
  120   HH12  ARG  14          2HH1      ARG  14   6.259 -12.709  -0.161
  121   HH21  ARG  14          1HH2      ARG  14   4.955 -13.063  -3.453
  122   HH22  ARG  14          2HH2      ARG  14   6.360 -13.123  -2.494
  123    HA   DPR  15           HA       DPR  15   3.744  -6.167  -3.127
  124    HB2  DPR  15          1HB       DPR  15   6.581  -6.888  -2.920
  125    HB3  DPR  15          2HB       DPR  15   5.558  -6.824  -4.357
  126    HG2  DPR  15          1HG       DPR  15   6.453  -9.163  -3.347
  127    HG3  DPR  15          2HG       DPR  15   4.866  -9.019  -4.122
  128    HD2  DPR  15          1HD       DPR  15   5.543  -9.044  -1.199
  129    HD3  DPR  15          2HD       DPR  15   4.262  -9.916  -2.060
  130    H    DGL  16           H        DGL  16   5.030  -7.060  -0.108
  131    HA   DGL  16           HA       DGL  16   6.548  -4.784   0.550
  132    HB2  DGL  16          1HB       DGL  16   6.601  -6.944   1.786
  133    HB3  DGL  16          2HB       DGL  16   4.981  -6.619   2.380
  134    HG2  DGL  16          1HG       DGL  16   5.790  -4.668   3.578
  135    HG3  DGL  16          2HG       DGL  16   7.418  -4.958   2.966
  136    H    DAL  17           H        DAL  17   3.129  -5.571   0.781
  137    HA   DAL  17           HA       DAL  17   2.286  -3.325   2.253
  138    HB1  DAL  17          1HB       DAL  17   0.761  -4.949   0.221
  139    HB2  DAL  17          2HB       DAL  17   0.054  -3.837   1.392
  140    HB3  DAL  17          3HB       DAL  17   0.876  -5.296   1.944
  141    H    DGL  18           H        DGL  18   2.509  -3.974  -1.191
  142    HA   DGL  18           HA       DGL  18   1.468  -1.669  -2.338
  143    HB2  DGL  18          1HB       DGL  18   2.205  -3.671  -3.587
  144    HB3  DGL  18          2HB       DGL  18   3.876  -3.280  -3.231
  145    HG2  DGL  18          1HG       DGL  18   3.442  -2.639  -5.472
  146    HG3  DGL  18          2HG       DGL  18   3.602  -1.171  -4.512
  147    H    DAR  19           H        DAR  19   4.771  -2.321  -1.312
  148    HA   DAR  19           HA       DAR  19   5.778   0.238  -1.974
  149    HB2  DAR  19          1HB       DAR  19   6.862  -1.841  -0.081
  150    HB3  DAR  19          2HB       DAR  19   7.733  -0.396  -0.578
  151    HG2  DAR  19          1HG       DAR  19   7.656  -1.133  -2.888
  152    HG3  DAR  19          2HG       DAR  19   6.769  -2.580  -2.409
  153    HD2  DAR  19          1HD       DAR  19   9.087  -3.102  -2.717
  154    HD3  DAR  19          2HD       DAR  19   8.666  -3.257  -1.015
  155    HE   DAR  19           HE       DAR  19   9.617  -0.766  -1.137
  156   HH11  DAR  19          1HH2      DAR  19  11.872  -0.154  -0.839
  157   HH12  DAR  19          2HH2      DAR  19  13.100  -1.242  -1.264
  158   HH21  DAR  19          1HH1      DAR  19  10.944  -3.829  -2.363
  159   HH22  DAR  19          2HH1      DAR  19  12.566  -3.374  -2.152
  160    H    DLY  20           H        DLY  20   4.597  -1.168   1.039
  161    HA   DLY  20           HA       DLY  20   5.178   1.024   2.682
  162    HB2  DLY  20          1HB       DLY  20   4.633  -1.229   3.532
  163    HB3  DLY  20          2HB       DLY  20   2.975  -1.026   2.998
  164    HG2  DLY  20          1HG       DLY  20   2.609   0.732   4.606
  165    HG3  DLY  20          2HG       DLY  20   4.309   0.699   5.073
  166    HD2  DLY  20          1HD       DLY  20   4.067  -1.581   5.892
  167    HD3  DLY  20          2HD       DLY  20   2.382  -1.607   5.377
  168    HE2  DLY  20          1HE       DLY  20   3.495   0.319   7.409
  169    HE3  DLY  20          2HE       DLY  20   2.712  -1.201   7.823
  170    HZ1  DLY  20          1HZ       DLY  20   0.690  -0.421   6.769
  171    HZ2  DLY  20          2HZ       DLY  20   1.409   1.037   6.344
  172    HZ3  DLY  20          3HZ       DLY  20   1.175   0.666   7.963
  173    H    DCY  21           H        DCY  21   2.357   0.329   0.670
  174    HA   DCY  21           HA       DCY  21   0.627   2.381   1.395
  175    HB2  DCY  21          1HB       DCY  21   1.209   1.361  -1.404
  176    HB3  DCY  21          2HB       DCY  21  -0.226   2.258  -0.923
  177    H    DAR  22           H        DAR  22   3.270   2.378  -0.900
  178    HA   DAR  22           HA       DAR  22   2.853   5.118  -1.670
  179    HB2  DAR  22          1HB       DAR  22   5.058   3.196  -2.427
  180    HB3  DAR  22          2HB       DAR  22   4.658   4.705  -3.245
  181    HG2  DAR  22          1HG       DAR  22   2.473   3.797  -3.846
  182    HG3  DAR  22          2HG       DAR  22   2.847   2.305  -2.999
  183    HD2  DAR  22          1HD       DAR  22   4.725   1.935  -4.534
  184    HD3  DAR  22          2HD       DAR  22   4.231   3.374  -5.431
  185    HE   DAR  22           HE       DAR  22   2.445   1.058  -5.028
  186   HH11  DAR  22          1HH1      DAR  22   3.910   3.422  -7.235
  187   HH12  DAR  22          2HH1      DAR  22   2.992   2.883  -8.571
  188   HH21  DAR  22          1HH2      DAR  22   1.316   0.355  -6.781
  189   HH22  DAR  22          2HH2      DAR  22   1.501   1.065  -8.341
  190    H    DGL  23           H        DGL  23   4.672   3.427   0.647
  191    HA   DGL  23           HA       DGL  23   6.649   5.467   1.026
  192    HB2  DGL  23          1HB       DGL  23   6.865   2.984   1.612
  193    HB3  DGL  23          2HB       DGL  23   5.827   3.323   2.987
  194    HG2  DGL  23          1HG       DGL  23   8.109   3.320   3.705
  195    HG3  DGL  23          2HG       DGL  23   7.475   4.965   3.790
  196    H    DGL  24           H        DGL  24   3.686   4.385   2.700
  197    HA   DGL  24           HA       DGL  24   3.700   6.378   4.670
  198    HB2  DGL  24          1HB       DGL  24   1.425   4.744   3.567
  199    HB3  DGL  24          2HB       DGL  24   1.244   5.854   4.912
  200    HG2  DGL  24          1HG       DGL  24   2.861   4.574   6.204
  201    HG3  DGL  24          2HG       DGL  24   3.050   3.457   4.852
  202    H    SER  25           H        SER  25   1.544   6.171   1.825
  203    HA   SER  25           HA       SER  25   1.880   8.985   1.380
  204    HB2  SER  25          2HB       SER  25   0.255   8.598  -0.475
  205    HB3  SER  25          1HB       SER  25   1.659   7.530  -0.530
  206    HG   SER  25           HG       SER  25   0.430   5.849   0.135
  207    H    ASP  26           H        ASP  26  -0.071  10.414   1.101
  208    HA   ASP  26           HA       ASP  26  -1.909  10.089   3.354
  209    HB2  ASP  26          2HB       ASP  26  -0.725  12.281   3.049
  210    HB3  ASP  26          1HB       ASP  26  -1.511  12.462   1.491
  Start of MODEL    7
    1    H    ASN   1           H        ASN   1  -1.327   8.261   0.644
    2    HA   ASN   1           HA       ASN   1  -3.339   9.406  -0.873
    3    HB2  ASN   1          2HB       ASN   1  -1.490   7.110  -1.492
    4    HB3  ASN   1          1HB       ASN   1  -2.529   7.854  -2.695
    5   HD21  ASN   1          1HD2      ASN   1  -0.703   8.443  -3.907
    6   HD22  ASN   1          2HD2      ASN   1   0.323   9.733  -3.416
    7    HA   PRO   2           HA       PRO   2  -6.935   6.964  -0.098
    8    HB2  PRO   2          2HB       PRO   2  -8.068   7.339  -2.643
    9    HB3  PRO   2          1HB       PRO   2  -8.306   8.370  -1.231
   10    HG2  PRO   2          2HG       PRO   2  -6.469   8.706  -3.542
   11    HG3  PRO   2          1HG       PRO   2  -7.341   9.933  -2.608
   12    HD2  PRO   2          2HD       PRO   2  -4.728   9.524  -2.304
   13    HD3  PRO   2          1HD       PRO   2  -5.757   9.947  -0.917
   14    H    GLU   3           H        GLU   3  -5.576   6.485  -3.390
   15    HA   GLU   3           HA       GLU   3  -6.685   3.941  -3.803
   16    HB2  GLU   3          2HB       GLU   3  -4.163   5.130  -4.961
   17    HB3  GLU   3          1HB       GLU   3  -4.941   3.674  -5.546
   18    HG2  GLU   3          2HG       GLU   3  -6.120   6.442  -5.560
   19    HG3  GLU   3          1HG       GLU   3  -5.473   5.572  -6.952
   20    H    LEU   4           H        LEU   4  -3.569   4.943  -2.558
   21    HA   LEU   4           HA       LEU   4  -2.438   2.401  -2.352
   22    HB2  LEU   4          2HB       LEU   4  -1.803   5.018  -1.048
   23    HB3  LEU   4          1HB       LEU   4  -0.975   3.567  -0.550
   24    HG   LEU   4           HG       LEU   4   0.392   4.826  -2.099
   25   HD11  LEU   4          1HD1      LEU   4   0.602   2.426  -2.140
   26   HD12  LEU   4          2HD1      LEU   4   0.887   3.114  -3.735
   27   HD13  LEU   4          3HD1      LEU   4  -0.643   2.314  -3.386
   28   HD21  LEU   4          1HD2      LEU   4  -1.339   6.008  -3.357
   29   HD22  LEU   4          2HD2      LEU   4  -1.847   4.491  -4.101
   30   HD23  LEU   4          3HD2      LEU   4  -0.249   5.153  -4.448
   31    H    GLN   5           H        GLN   5  -3.939   4.391   0.187
   32    HA   GLN   5           HA       GLN   5  -3.502   2.585   2.274
   33    HB2  GLN   5          2HB       GLN   5  -5.769   4.562   2.057
   34    HB3  GLN   5          1HB       GLN   5  -5.224   3.780   3.533
   35    HG2  GLN   5          2HG       GLN   5  -3.692   5.744   1.848
   36    HG3  GLN   5          1HG       GLN   5  -4.380   6.023   3.442
   37   HE21  GLN   5          1HE2      GLN   5  -3.494   3.397   4.478
   38   HE22  GLN   5          2HE2      GLN   5  -1.797   3.535   4.678
   39    H    ARG   6           H        ARG   6  -6.027   2.608  -0.090
   40    HA   ARG   6           HA       ARG   6  -7.536   0.599   1.330
   41    HB2  ARG   6          2HB       ARG   6  -7.859   1.781  -1.410
   42    HB3  ARG   6          1HB       ARG   6  -8.917   0.548  -0.746
   43    HG2  ARG   6          2HG       ARG   6  -9.563   2.055   1.051
   44    HG3  ARG   6          1HG       ARG   6  -8.482   3.294   0.400
   45    HD2  ARG   6          2HD       ARG   6 -10.778   3.677  -0.308
   46    HD3  ARG   6          1HD       ARG   6  -9.725   3.302  -1.672
   47    HE   ARG   6           HE       ARG   6 -11.321   1.185  -0.452
   48   HH11  ARG   6          1HH1      ARG   6 -10.583   3.200  -3.261
   49   HH12  ARG   6          2HH1      ARG   6 -11.611   2.374  -4.334
   50   HH21  ARG   6          1HH2      ARG   6 -12.723   0.033  -1.897
   51   HH22  ARG   6          2HH2      ARG   6 -12.852   0.489  -3.532
   52    H    LYS   7           H        LYS   7  -5.456   0.771  -1.536
   53    HA   LYS   7           HA       LYS   7  -5.980  -1.904  -2.209
   54    HB2  LYS   7          2HB       LYS   7  -5.335  -0.176  -3.868
   55    HB3  LYS   7          1HB       LYS   7  -3.716  -0.163  -3.191
   56    HG2  LYS   7          2HG       LYS   7  -3.162  -2.196  -4.123
   57    HG3  LYS   7          1HG       LYS   7  -4.840  -2.742  -4.190
   58    HD2  LYS   7          2HD       LYS   7  -4.045  -2.281  -6.435
   59    HD3  LYS   7          1HD       LYS   7  -5.282  -1.117  -5.989
   60    HE2  LYS   7          2HE       LYS   7  -3.610   0.130  -7.074
   61    HE3  LYS   7          1HE       LYS   7  -3.375   0.443  -5.359
   62    HZ1  LYS   7          1HZ       LYS   7  -1.284   0.048  -6.428
   63    HZ2  LYS   7          2HZ       LYS   7  -1.815  -1.392  -7.070
   64    HZ3  LYS   7          3HZ       LYS   7  -1.536  -1.292  -5.433
   65    H    CYS   8           H        CYS   8  -3.624  -0.433  -0.123
   66    HA   CYS   8           HA       CYS   8  -1.853  -2.581   0.163
   67    HB2  CYS   8          2HB       CYS   8  -2.811  -0.646   2.291
   68    HB3  CYS   8          1HB       CYS   8  -1.386  -1.674   2.415
   69    H    LYS   9           H        LYS   9  -4.873  -1.861   1.871
   70    HA   LYS   9           HA       LYS   9  -4.726  -4.264   3.412
   71    HB2  LYS   9          2HB       LYS   9  -6.955  -2.251   3.080
   72    HB3  LYS   9          1HB       LYS   9  -6.935  -3.551   4.269
   73    HG2  LYS   9          2HG       LYS   9  -4.952  -2.584   5.309
   74    HG3  LYS   9          1HG       LYS   9  -4.937  -1.304   4.101
   75    HD2  LYS   9          2HD       LYS   9  -7.103  -0.516   4.903
   76    HD3  LYS   9          1HD       LYS   9  -7.140  -1.815   6.097
   77    HE2  LYS   9          2HE       LYS   9  -5.098  -0.916   7.129
   78    HE3  LYS   9          1HE       LYS   9  -5.075   0.370   5.928
   79    HZ1  LYS   9          1HZ       LYS   9  -7.240  -0.038   7.922
   80    HZ2  LYS   9          2HZ       LYS   9  -7.149   1.196   6.798
   81    HZ3  LYS   9          3HZ       LYS   9  -6.013   1.112   8.028
   82    H    GLU  10           H        GLU  10  -6.004  -3.341   0.373
   83    HA   GLU  10           HA       GLU  10  -7.879  -5.442   0.052
   84    HB2  GLU  10          2HB       GLU  10  -7.793  -3.247  -1.200
   85    HB3  GLU  10          1HB       GLU  10  -6.385  -3.878  -2.039
   86    HG2  GLU  10          2HG       GLU  10  -8.333  -4.080  -3.409
   87    HG3  GLU  10          1HG       GLU  10  -7.734  -5.675  -2.945
   88    H    LEU  11           H        LEU  11  -4.441  -4.977  -0.624
   89    HA   LEU  11           HA       LEU  11  -4.231  -7.602  -1.875
   90    HB2  LEU  11          2HB       LEU  11  -2.157  -5.472  -1.415
   91    HB3  LEU  11          1HB       LEU  11  -1.868  -6.978  -2.260
   92    HG   LEU  11           HG       LEU  11  -3.678  -4.736  -3.150
   93   HD11  LEU  11          1HD1      LEU  11  -2.068  -4.508  -4.971
   94   HD12  LEU  11          2HD1      LEU  11  -1.066  -5.759  -4.233
   95   HD13  LEU  11          3HD1      LEU  11  -1.328  -4.230  -3.396
   96   HD21  LEU  11          1HD2      LEU  11  -3.946  -6.034  -5.216
   97   HD22  LEU  11          2HD2      LEU  11  -4.613  -6.881  -3.823
   98   HD23  LEU  11          3HD2      LEU  11  -3.051  -7.365  -4.487
   99    H    DAS  12           H        DAS  12  -3.843  -6.197   1.188
  100    HA   DAS  12           HA       DAS  12  -2.949  -8.781   2.141
  101    HB2  DAS  12          1HB       DAS  12  -4.900  -7.821   3.257
  102    HB3  DAS  12          2HB       DAS  12  -3.971  -6.386   3.675
  103    H    THR  13           H        THR  13  -0.889  -9.032   2.143
  104    HA   THR  13           HA       THR  13   0.796  -6.808   3.046
  105    HB   THR  13           HB       THR  13   0.840  -8.876   4.483
  106    HG1  THR  13          1HG       THR  13   2.648  -7.578   4.485
  107   HG21  THR  13          1HG2      THR  13   2.006 -10.880   3.668
  108   HG22  THR  13          2HG2      THR  13   2.122 -10.156   2.065
  109   HG23  THR  13          3HG2      THR  13   0.545 -10.569   2.728
  110    H    ARG  14           H        ARG  14  -0.274  -8.226   0.330
  111    HA   ARG  14           HA       ARG  14   2.205  -8.667  -1.034
  112    HB2  ARG  14          2HB       ARG  14  -0.665  -8.799  -1.993
  113    HB3  ARG  14          1HB       ARG  14   0.699  -8.994  -3.080
  114    HG2  ARG  14          2HG       ARG  14  -0.067 -11.174  -2.515
  115    HG3  ARG  14          1HG       ARG  14   1.450 -10.914  -1.658
  116    HD2  ARG  14          2HD       ARG  14   0.137 -10.294   0.349
  117    HD3  ARG  14          1HD       ARG  14  -1.330 -10.726  -0.513
  118    HE   ARG  14           HE       ARG  14   0.833 -12.653  -0.051
  119   HH11  ARG  14          1HH1      ARG  14  -2.620 -11.856   0.017
  120   HH12  ARG  14          2HH1      ARG  14  -3.083 -13.269   0.831
  121   HH21  ARG  14          1HH2      ARG  14   0.189 -14.633   1.069
  122   HH22  ARG  14          2HH2      ARG  14  -1.441 -14.886   1.451
  123    HA   DPR  15           HA       DPR  15   1.931  -4.819  -3.507
  124    HB2  DPR  15          1HB       DPR  15   4.617  -5.423  -4.405
  125    HB3  DPR  15          2HB       DPR  15   3.153  -5.307  -5.381
  126    HG2  DPR  15          1HG       DPR  15   4.501  -7.641  -4.964
  127    HG3  DPR  15          2HG       DPR  15   2.759  -7.571  -5.275
  128    HD2  DPR  15          1HD       DPR  15   4.206  -7.856  -2.673
  129    HD3  DPR  15          2HD       DPR  15   2.758  -8.706  -3.253
  130    H    DGL  16           H        DGL  16   3.851  -6.253  -1.182
  131    HA   DGL  16           HA       DGL  16   5.755  -4.190  -0.690
  132    HB2  DGL  16          1HB       DGL  16   6.063  -6.605  -0.123
  133    HB3  DGL  16          2HB       DGL  16   4.796  -6.451   1.077
  134    HG2  DGL  16          1HG       DGL  16   7.014  -6.425   2.070
  135    HG3  DGL  16          2HG       DGL  16   6.120  -4.939   2.373
  136    H    DAL  17           H        DAL  17   2.537  -4.991   0.280
  137    HA   DAL  17           HA       DAL  17   2.195  -3.368   2.529
  138    HB1  DAL  17          1HB       DAL  17   0.222  -4.147   0.386
  139    HB2  DAL  17          2HB       DAL  17  -0.196  -3.492   1.965
  140    HB3  DAL  17          3HB       DAL  17   0.587  -5.069   1.842
  141    H    DGL  18           H        DGL  18   1.288  -2.763  -0.848
  142    HA   DGL  18           HA       DGL  18   0.663  -0.057  -0.418
  143    HB2  DGL  18          1HB       DGL  18   0.694   0.164  -2.892
  144    HB3  DGL  18          2HB       DGL  18  -0.328  -1.131  -2.288
  145    HG2  DGL  18          1HG       DGL  18   1.279  -2.770  -2.893
  146    HG3  DGL  18          2HG       DGL  18   2.452  -1.527  -3.327
  147    H    DAR  19           H        DAR  19   3.613  -1.652  -1.160
  148    HA   DAR  19           HA       DAR  19   5.159   0.555  -1.953
  149    HB2  DAR  19          1HB       DAR  19   5.915  -1.763  -2.178
  150    HB3  DAR  19          2HB       DAR  19   5.961  -1.927  -0.430
  151    HG2  DAR  19          1HG       DAR  19   7.701  -0.207  -0.332
  152    HG3  DAR  19          2HG       DAR  19   7.694  -0.136  -2.097
  153    HD2  DAR  19          1HD       DAR  19   8.347  -2.452  -2.228
  154    HD3  DAR  19          2HD       DAR  19   8.266  -2.598  -0.471
  155    HE   DAR  19           HE       DAR  19  10.060  -0.616  -1.621
  156   HH11  DAR  19          1HH2      DAR  19  12.241  -0.753  -0.997
  157   HH12  DAR  19          2HH2      DAR  19  12.848  -2.088  -0.135
  158   HH21  DAR  19          1HH1      DAR  19   9.670  -3.729   0.051
  159   HH22  DAR  19          2HH1      DAR  19  11.307  -3.833   0.501
  160    H    DLY  20           H        DLY  20   4.493  -0.875   1.224
  161    HA   DLY  20           HA       DLY  20   6.043   0.905   2.751
  162    HB2  DLY  20          1HB       DLY  20   5.198  -1.321   3.528
  163    HB3  DLY  20          2HB       DLY  20   3.586  -0.639   3.610
  164    HG2  DLY  20          1HG       DLY  20   4.458  -0.641   5.822
  165    HG3  DLY  20          2HG       DLY  20   4.476   1.034   5.266
  166    HD2  DLY  20          1HD       DLY  20   6.873   0.758   4.662
  167    HD3  DLY  20          2HD       DLY  20   6.828  -0.857   5.363
  168    HE2  DLY  20          1HE       DLY  20   7.750   0.590   6.995
  169    HE3  DLY  20          2HE       DLY  20   6.122   0.180   7.519
  170    HZ1  DLY  20          1HZ       DLY  20   6.585   2.547   7.793
  171    HZ2  DLY  20          2HZ       DLY  20   5.366   2.380   6.649
  172    HZ3  DLY  20          3HZ       DLY  20   6.964   2.661   6.167
  173    H    DCY  21           H        DCY  21   2.662   0.910   1.735
  174    HA   DCY  21           HA       DCY  21   1.938   3.230   3.168
  175    HB2  DCY  21          1HB       DCY  21   0.749   2.245   0.578
  176    HB3  DCY  21          2HB       DCY  21   0.008   3.383   1.693
  177    H    DAR  22           H        DAR  22   3.016   2.834  -0.242
  178    HA   DAR  22           HA       DAR  22   2.844   5.621  -0.768
  179    HB2  DAR  22          1HB       DAR  22   3.907   5.195  -2.893
  180    HB3  DAR  22          2HB       DAR  22   2.716   3.949  -2.580
  181    HG2  DAR  22          1HG       DAR  22   4.551   2.462  -1.842
  182    HG3  DAR  22          2HG       DAR  22   5.698   3.691  -2.382
  183    HD2  DAR  22          1HD       DAR  22   4.703   3.575  -4.641
  184    HD3  DAR  22          2HD       DAR  22   3.641   2.285  -4.085
  185    HE   DAR  22           HE       DAR  22   6.526   1.939  -3.850
  186   HH11  DAR  22          1HH1      DAR  22   3.513   1.015  -5.504
  187   HH12  DAR  22          2HH1      DAR  22   4.184  -0.343  -6.261
  188   HH21  DAR  22          1HH2      DAR  22   7.443   0.038  -4.933
  189   HH22  DAR  22          2HH2      DAR  22   6.453  -0.916  -5.911
  190    H    DGL  23           H        DGL  23   5.214   3.746   0.777
  191    HA   DGL  23           HA       DGL  23   7.496   5.317   0.554
  192    HB2  DGL  23          1HB       DGL  23   7.439   3.155   1.676
  193    HB3  DGL  23          2HB       DGL  23   6.360   3.793   2.895
  194    HG2  DGL  23          1HG       DGL  23   8.112   5.273   3.694
  195    HG3  DGL  23          2HG       DGL  23   9.212   4.606   2.487
  196    H    DGL  24           H        DGL  24   4.697   5.672   2.632
  197    HA   DGL  24           HA       DGL  24   5.830   8.146   3.721
  198    HB2  DGL  24          1HB       DGL  24   4.168   7.688   5.615
  199    HB3  DGL  24          2HB       DGL  24   5.614   6.698   5.506
  200    HG2  DGL  24          1HG       DGL  24   4.242   4.985   4.309
  201    HG3  DGL  24          2HG       DGL  24   2.819   5.954   4.670
  202    H    SER  25           H        SER  25   3.011   6.803   2.190
  203    HA   SER  25           HA       SER  25   2.062   9.505   1.715
  204    HB2  SER  25          2HB       SER  25   1.272   6.875   0.462
  205    HB3  SER  25          1HB       SER  25   0.783   8.479  -0.078
  206    HG   SER  25           HG       SER  25   3.248   8.755  -0.112
  207    H    ASP  26           H        ASP  26  -0.382   9.656   1.601
  208    HA   ASP  26           HA       ASP  26  -1.845   7.912   3.478
  209    HB2  ASP  26          2HB       ASP  26  -3.081   9.865   4.315
  210    HB3  ASP  26          1HB       ASP  26  -1.361  10.129   4.564
  Start of MODEL    8
    1    H    ASN   1           H        ASN   1  -1.519   8.860   1.007
    2    HA   ASN   1           HA       ASN   1  -3.999   9.612   0.068
    3    HB2  ASN   1          2HB       ASN   1  -1.949   7.821  -1.217
    4    HB3  ASN   1          1HB       ASN   1  -3.353   8.459  -2.059
    5   HD21  ASN   1          1HD2      ASN   1  -3.436  10.657  -2.528
    6   HD22  ASN   1          2HD2      ASN   1  -2.039  11.650  -2.494
    7    HA   PRO   2           HA       PRO   2  -6.559   6.324   1.496
    8    HB2  PRO   2          2HB       PRO   2  -8.732   6.900  -0.125
    9    HB3  PRO   2          1HB       PRO   2  -8.391   7.657   1.432
   10    HG2  PRO   2          2HG       PRO   2  -7.815   8.645  -1.324
   11    HG3  PRO   2          1HG       PRO   2  -8.365   9.549   0.098
   12    HD2  PRO   2          2HD       PRO   2  -5.829   9.636  -0.731
   13    HD3  PRO   2          1HD       PRO   2  -6.233   9.664   0.999
   14    H    GLU   3           H        GLU   3  -6.444   6.804  -2.054
   15    HA   GLU   3           HA       GLU   3  -7.307   4.105  -2.405
   16    HB2  GLU   3          2HB       GLU   3  -6.445   6.111  -4.478
   17    HB3  GLU   3          1HB       GLU   3  -7.071   4.507  -4.827
   18    HG2  GLU   3          2HG       GLU   3  -8.536   6.747  -3.448
   19    HG3  GLU   3          1HG       GLU   3  -8.850   6.100  -5.058
   20    H    LEU   4           H        LEU   4  -4.323   5.555  -2.003
   21    HA   LEU   4           HA       LEU   4  -2.822   3.399  -3.165
   22    HB2  LEU   4          2HB       LEU   4  -2.157   5.683  -1.362
   23    HB3  LEU   4          1HB       LEU   4  -1.043   4.345  -1.396
   24    HG   LEU   4           HG       LEU   4  -0.763   4.702  -3.853
   25   HD11  LEU   4          1HD1      LEU   4  -2.377   7.196  -3.398
   26   HD12  LEU   4          2HD1      LEU   4  -2.891   5.785  -4.315
   27   HD13  LEU   4          3HD1      LEU   4  -1.527   6.753  -4.879
   28   HD21  LEU   4          1HD2      LEU   4  -0.165   7.090  -2.118
   29   HD22  LEU   4          2HD2      LEU   4   0.614   6.698  -3.651
   30   HD23  LEU   4          3HD2      LEU   4   0.813   5.632  -2.260
   31    H    GLN   5           H        GLN   5  -3.899   4.319   0.036
   32    HA   GLN   5           HA       GLN   5  -2.945   1.996   1.343
   33    HB2  GLN   5          2HB       GLN   5  -5.157   3.886   2.154
   34    HB3  GLN   5          1HB       GLN   5  -4.355   2.735   3.216
   35    HG2  GLN   5          2HG       GLN   5  -2.237   3.914   2.909
   36    HG3  GLN   5          1HG       GLN   5  -3.027   5.056   1.828
   37   HE21  GLN   5          1HE2      GLN   5  -5.459   5.115   3.528
   38   HE22  GLN   5          2HE2      GLN   5  -5.018   6.064   4.892
   39    H    ARG   6           H        ARG   6  -5.848   2.755  -0.408
   40    HA   ARG   6           HA       ARG   6  -7.576   0.703   0.312
   41    HB2  ARG   6          2HB       ARG   6  -7.971   2.671  -1.217
   42    HB3  ARG   6          1HB       ARG   6  -7.180   1.744  -2.491
   43    HG2  ARG   6          2HG       ARG   6  -9.465   1.426  -2.824
   44    HG3  ARG   6          1HG       ARG   6  -8.946  -0.041  -1.980
   45    HD2  ARG   6          2HD       ARG   6 -10.993   0.803  -1.017
   46    HD3  ARG   6          1HD       ARG   6  -9.677   0.955   0.145
   47    HE   ARG   6           HE       ARG   6 -10.005   3.318  -1.444
   48   HH11  ARG   6          1HH1      ARG   6 -11.287   1.701   1.439
   49   HH12  ARG   6          2HH1      ARG   6 -11.811   3.163   2.135
   50   HH21  ARG   6          1HH2      ARG   6 -10.702   5.197  -0.532
   51   HH22  ARG   6          2HH2      ARG   6 -11.468   5.221   1.016
   52    H    LYS   7           H        LYS   7  -5.012   0.832  -2.108
   53    HA   LYS   7           HA       LYS   7  -5.415  -1.815  -3.040
   54    HB2  LYS   7          2HB       LYS   7  -3.057   0.053  -3.347
   55    HB3  LYS   7          1HB       LYS   7  -3.154  -1.522  -4.122
   56    HG2  LYS   7          2HG       LYS   7  -5.088   0.755  -4.549
   57    HG3  LYS   7          1HG       LYS   7  -3.789   0.293  -5.653
   58    HD2  LYS   7          2HD       LYS   7  -4.811  -1.876  -6.006
   59    HD3  LYS   7          1HD       LYS   7  -6.050  -1.533  -4.810
   60    HE2  LYS   7          2HE       LYS   7  -6.807   0.354  -6.250
   61    HE3  LYS   7          1HE       LYS   7  -5.672  -0.211  -7.477
   62    HZ1  LYS   7          1HZ       LYS   7  -7.953  -1.082  -7.773
   63    HZ2  LYS   7          2HZ       LYS   7  -7.791  -1.895  -6.286
   64    HZ3  LYS   7          3HZ       LYS   7  -6.805  -2.298  -7.583
   65    H    CYS   8           H        CYS   8  -3.537  -0.428  -0.513
   66    HA   CYS   8           HA       CYS   8  -2.056  -2.764   0.091
   67    HB2  CYS   8          2HB       CYS   8  -2.879  -0.515   1.908
   68    HB3  CYS   8          1HB       CYS   8  -1.547  -1.643   2.171
   69    H    LYS   9           H        LYS   9  -5.202  -1.533   0.936
   70    HA   LYS   9           HA       LYS   9  -5.756  -3.408   2.980
   71    HB2  LYS   9          2HB       LYS   9  -6.941  -1.222   2.652
   72    HB3  LYS   9          1HB       LYS   9  -7.671  -1.882   1.204
   73    HG2  LYS   9          2HG       LYS   9  -8.844  -3.535   2.515
   74    HG3  LYS   9          1HG       LYS   9  -8.074  -2.944   3.989
   75    HD2  LYS   9          2HD       LYS   9  -9.116  -0.753   3.655
   76    HD3  LYS   9          1HD       LYS   9  -9.889  -1.346   2.185
   77    HE2  LYS   9          2HE       LYS   9 -11.444  -1.358   4.074
   78    HE3  LYS   9          1HE       LYS   9 -11.132  -2.991   3.493
   79    HZ1  LYS   9          1HZ       LYS   9  -9.787  -1.764   5.842
   80    HZ2  LYS   9          2HZ       LYS   9  -9.691  -3.384   5.373
   81    HZ3  LYS   9          3HZ       LYS   9 -11.127  -2.754   5.934
   82    H    GLU  10           H        GLU  10  -6.208  -3.316  -0.494
   83    HA   GLU  10           HA       GLU  10  -7.611  -5.789  -0.693
   84    HB2  GLU  10          2HB       GLU  10  -5.961  -4.332  -2.782
   85    HB3  GLU  10          1HB       GLU  10  -7.016  -5.697  -3.113
   86    HG2  GLU  10          2HG       GLU  10  -8.932  -4.350  -2.312
   87    HG3  GLU  10          1HG       GLU  10  -7.848  -2.975  -2.126
   88    H    LEU  11           H        LEU  11  -4.209  -4.905  -1.087
   89    HA   LEU  11           HA       LEU  11  -3.333  -7.553  -1.649
   90    HB2  LEU  11          2HB       LEU  11  -1.819  -5.100  -0.831
   91    HB3  LEU  11          1HB       LEU  11  -1.062  -6.600  -1.324
   92    HG   LEU  11           HG       LEU  11  -2.792  -4.834  -3.057
   93   HD11  LEU  11          1HD1      LEU  11   0.179  -5.326  -3.067
   94   HD12  LEU  11          2HD1      LEU  11  -0.632  -3.843  -2.563
   95   HD13  LEU  11          3HD1      LEU  11  -0.713  -4.365  -4.246
   96   HD21  LEU  11          1HD2      LEU  11  -3.013  -7.177  -3.692
   97   HD22  LEU  11          2HD2      LEU  11  -1.259  -7.351  -3.719
   98   HD23  LEU  11          3HD2      LEU  11  -2.059  -6.304  -4.890
   99    H    DAS  12           H        DAS  12  -3.578  -5.683   1.314
  100    HA   DAS  12           HA       DAS  12  -3.050  -8.105   2.790
  101    HB2  DAS  12          1HB       DAS  12  -4.928  -6.697   3.502
  102    HB3  DAS  12          2HB       DAS  12  -3.835  -5.341   3.748
  103    H    THR  13           H        THR  13  -1.008  -8.580   2.909
  104    HA   THR  13           HA       THR  13   0.942  -6.472   3.581
  105    HB   THR  13           HB       THR  13   1.378  -9.397   4.200
  106    HG1  THR  13          1HG       THR  13  -0.687  -8.713   5.029
  107   HG21  THR  13          1HG2      THR  13   2.185  -6.841   5.608
  108   HG22  THR  13          2HG2      THR  13   3.203  -7.751   4.497
  109   HG23  THR  13          3HG2      THR  13   2.709  -8.472   6.031
  110    H    ARG  14           H        ARG  14  -0.233  -8.175   1.157
  111    HA   ARG  14           HA       ARG  14   2.125  -9.380   0.000
  112    HB2  ARG  14          2HB       ARG  14  -0.674  -8.956  -1.101
  113    HB3  ARG  14          1HB       ARG  14   0.580  -9.920  -1.869
  114    HG2  ARG  14          2HG       ARG  14   0.548 -11.506  -0.045
  115    HG3  ARG  14          1HG       ARG  14  -0.581 -10.496   0.853
  116    HD2  ARG  14          2HD       ARG  14  -1.167 -11.790  -1.816
  117    HD3  ARG  14          1HD       ARG  14  -1.671 -12.431  -0.254
  118    HE   ARG  14           HE       ARG  14  -2.630  -9.877  -0.313
  119   HH11  ARG  14          1HH1      ARG  14  -3.032 -12.739  -2.306
  120   HH12  ARG  14          2HH1      ARG  14  -4.589 -12.358  -2.857
  121   HH21  ARG  14          1HH2      ARG  14  -4.870  -9.287  -1.078
  122   HH22  ARG  14          2HH2      ARG  14  -5.643 -10.338  -2.143
  123    HA   DPR  15           HA       DPR  15   2.358  -6.191  -3.381
  124    HB2  DPR  15          1HB       DPR  15   5.198  -7.002  -3.398
  125    HB3  DPR  15          2HB       DPR  15   4.054  -6.946  -4.741
  126    HG2  DPR  15          1HG       DPR  15   4.889  -9.276  -3.724
  127    HG3  DPR  15          2HG       DPR  15   3.223  -9.061  -4.288
  128    HD2  DPR  15          1HD       DPR  15   4.296  -9.006  -1.491
  129    HD3  DPR  15          2HD       DPR  15   2.836  -9.808  -2.115
  130    H    DGL  16           H        DGL  16   4.230  -6.808  -0.567
  131    HA   DGL  16           HA       DGL  16   5.840  -4.503  -0.503
  132    HB2  DGL  16          1HB       DGL  16   6.280  -6.540   0.814
  133    HB3  DGL  16          2HB       DGL  16   4.852  -6.215   1.783
  134    HG2  DGL  16          1HG       DGL  16   5.857  -4.134   2.563
  135    HG3  DGL  16          2HG       DGL  16   7.302  -4.481   1.614
  136    H    DAL  17           H        DAL  17   2.544  -5.100   0.334
  137    HA   DAL  17           HA       DAL  17   2.035  -3.086   2.194
  138    HB1  DAL  17          1HB       DAL  17  -0.299  -3.288   1.541
  139    HB2  DAL  17          2HB       DAL  17   0.454  -4.879   1.656
  140    HB3  DAL  17          3HB       DAL  17   0.174  -4.148   0.076
  141    H    DGL  18           H        DGL  18   1.732  -3.010  -1.341
  142    HA   DGL  18           HA       DGL  18   0.835  -0.373  -1.636
  143    HB2  DGL  18          1HB       DGL  18   0.811  -2.084  -3.428
  144    HB3  DGL  18          2HB       DGL  18   2.563  -2.012  -3.509
  145    HG2  DGL  18          1HG       DGL  18   2.379   0.380  -4.163
  146    HG3  DGL  18          2HG       DGL  18   0.631   0.172  -4.228
  147    H    DAR  19           H        DAR  19   4.007  -1.752  -1.499
  148    HA   DAR  19           HA       DAR  19   5.575   0.508  -2.083
  149    HB2  DAR  19          1HB       DAR  19   6.431  -1.811  -2.130
  150    HB3  DAR  19          2HB       DAR  19   6.238  -1.920  -0.393
  151    HG2  DAR  19          1HG       DAR  19   8.537  -1.586  -0.831
  152    HG3  DAR  19          2HG       DAR  19   7.902  -0.091  -0.150
  153    HD2  DAR  19          1HD       DAR  19   7.717   0.834  -2.452
  154    HD3  DAR  19          2HD       DAR  19   8.482  -0.635  -3.058
  155    HE   DAR  19           HE       DAR  19   9.927   0.702  -0.975
  156   HH11  DAR  19          1HH2      DAR  19  11.985   1.666  -1.444
  157   HH12  DAR  19          2HH2      DAR  19  12.495   1.873  -3.055
  158   HH21  DAR  19          1HH1      DAR  19   9.564   0.466  -4.522
  159   HH22  DAR  19          2HH1      DAR  19  11.077   1.166  -4.831
  160    H    DLY  20           H        DLY  20   4.467  -0.867   0.982
  161    HA   DLY  20           HA       DLY  20   5.737   0.994   2.694
  162    HB2  DLY  20          1HB       DLY  20   3.273  -0.688   3.174
  163    HB3  DLY  20          2HB       DLY  20   4.126   0.203   4.420
  164    HG2  DLY  20          1HG       DLY  20   5.285  -2.035   2.786
  165    HG3  DLY  20          2HG       DLY  20   4.681  -2.187   4.433
  166    HD2  DLY  20          1HD       DLY  20   6.377  -0.516   5.158
  167    HD3  DLY  20          2HD       DLY  20   7.007  -0.501   3.513
  168    HE2  DLY  20          1HE       DLY  20   8.356  -1.960   4.897
  169    HE3  DLY  20          2HE       DLY  20   7.504  -2.898   3.678
  170    HZ1  DLY  20          1HZ       DLY  20   6.758  -2.681   6.550
  171    HZ2  DLY  20          2HZ       DLY  20   7.410  -4.017   5.764
  172    HZ3  DLY  20          3HZ       DLY  20   5.863  -3.518   5.389
  173    H    DCY  21           H        DCY  21   2.496   0.920   1.295
  174    HA   DCY  21           HA       DCY  21   1.591   3.245   2.599
  175    HB2  DCY  21          1HB       DCY  21   0.757   2.000   0.008
  176    HB3  DCY  21          2HB       DCY  21  -0.099   3.359   0.741
  177    H    DAR  22           H        DAR  22   3.062   2.805  -0.607
  178    HA   DAR  22           HA       DAR  22   2.959   5.542  -1.292
  179    HB2  DAR  22          1HB       DAR  22   4.681   3.301  -2.344
  180    HB3  DAR  22          2HB       DAR  22   4.734   4.932  -3.000
  181    HG2  DAR  22          1HG       DAR  22   2.366   4.771  -3.592
  182    HG3  DAR  22          2HG       DAR  22   2.314   3.134  -2.939
  183    HD2  DAR  22          1HD       DAR  22   3.874   2.360  -4.591
  184    HD3  DAR  22          2HD       DAR  22   4.136   4.001  -5.174
  185    HE   DAR  22           HE       DAR  22   1.418   3.443  -5.373
  186   HH11  DAR  22          1HH1      DAR  22   4.435   2.405  -6.887
  187   HH12  DAR  22          2HH1      DAR  22   3.721   1.964  -8.365
  188   HH21  DAR  22          1HH2      DAR  22   0.421   2.884  -7.449
  189   HH22  DAR  22          2HH2      DAR  22   1.390   2.232  -8.683
  190    H    DGL  23           H        DGL  23   5.220   3.677   0.531
  191    HA   DGL  23           HA       DGL  23   7.489   5.245   0.608
  192    HB2  DGL  23          1HB       DGL  23   7.284   3.005   1.577
  193    HB3  DGL  23          2HB       DGL  23   6.168   3.602   2.782
  194    HG2  DGL  23          1HG       DGL  23   7.918   4.898   3.831
  195    HG3  DGL  23          2HG       DGL  23   9.062   4.361   2.596
  196    H    DGL  24           H        DGL  24   4.643   5.443   2.677
  197    HA   DGL  24           HA       DGL  24   5.660   7.925   3.821
  198    HB2  DGL  24          1HB       DGL  24   3.350   6.171   4.623
  199    HB3  DGL  24          2HB       DGL  24   3.821   7.646   5.457
  200    HG2  DGL  24          1HG       DGL  24   5.953   6.690   6.034
  201    HG3  DGL  24          2HG       DGL  24   5.602   5.250   5.080
  202    H    SER  25           H        SER  25   2.592   6.724   2.429
  203    HA   SER  25           HA       SER  25   1.897   9.502   1.835
  204    HB2  SER  25          2HB       SER  25   1.243   7.033   0.196
  205    HB3  SER  25          1HB       SER  25   0.807   8.695  -0.204
  206    HG   SER  25           HG       SER  25   3.454   7.698   0.064
  207    H    ASP  26           H        ASP  26  -0.188  10.064   2.385
  208    HA   ASP  26           HA       ASP  26  -1.635   8.163   4.084
  209    HB2  ASP  26          2HB       ASP  26  -1.037  10.411   4.974
  210    HB3  ASP  26          1HB       ASP  26  -1.960  11.161   3.686
  Start of MODEL    9
    1    H    ASN   1           H        ASN   1  -1.625   8.194   0.687
    2    HA   ASN   1           HA       ASN   1  -3.977   9.580  -0.275
    3    HB2  ASN   1          2HB       ASN   1  -2.351   7.423  -1.625
    4    HB3  ASN   1          1HB       ASN   1  -3.637   8.366  -2.364
    5   HD21  ASN   1          1HD2      ASN   1  -3.263  10.610  -2.742
    6   HD22  ASN   1          2HD2      ASN   1  -1.658  11.205  -2.867
    7    HA   PRO   2           HA       PRO   2  -6.703   6.432   1.401
    8    HB2  PRO   2          2HB       PRO   2  -8.498   7.605  -0.657
    9    HB3  PRO   2          1HB       PRO   2  -8.797   7.326   1.064
   10    HG2  PRO   2          2HG       PRO   2  -8.346   9.781   0.187
   11    HG3  PRO   2          1HG       PRO   2  -7.626   9.228   1.708
   12    HD2  PRO   2          2HD       PRO   2  -6.353   9.549  -0.979
   13    HD3  PRO   2          1HD       PRO   2  -5.714   9.920   0.639
   14    H    GLU   3           H        GLU   3  -6.134   7.068  -1.965
   15    HA   GLU   3           HA       GLU   3  -7.181   4.858  -3.274
   16    HB2  GLU   3          2HB       GLU   3  -6.112   6.812  -4.357
   17    HB3  GLU   3          1HB       GLU   3  -4.557   6.275  -3.751
   18    HG2  GLU   3          2HG       GLU   3  -4.863   5.787  -6.115
   19    HG3  GLU   3          1HG       GLU   3  -4.668   4.320  -5.154
   20    H    LEU   4           H        LEU   4  -3.928   5.293  -1.944
   21    HA   LEU   4           HA       LEU   4  -3.081   2.635  -2.326
   22    HB2  LEU   4          2HB       LEU   4  -2.074   4.806  -0.510
   23    HB3  LEU   4          1HB       LEU   4  -1.257   3.284  -0.772
   24    HG   LEU   4           HG       LEU   4  -1.764   5.384  -2.879
   25   HD11  LEU   4          1HD1      LEU   4   0.664   5.731  -2.754
   26   HD12  LEU   4          2HD1      LEU   4   0.740   4.599  -1.403
   27   HD13  LEU   4          3HD1      LEU   4  -0.165   6.107  -1.245
   28   HD21  LEU   4          1HD2      LEU   4  -0.242   4.028  -4.256
   29   HD22  LEU   4          2HD2      LEU   4  -1.706   3.144  -3.841
   30   HD23  LEU   4          3HD2      LEU   4  -0.198   2.800  -2.990
   31    H    GLN   5           H        GLN   5  -4.460   4.396   0.369
   32    HA   GLN   5           HA       GLN   5  -4.112   2.436   2.319
   33    HB2  GLN   5          2HB       GLN   5  -6.281   4.521   2.130
   34    HB3  GLN   5          1HB       GLN   5  -5.901   3.594   3.574
   35    HG2  GLN   5          2HG       GLN   5  -4.026   5.483   2.156
   36    HG3  GLN   5          1HG       GLN   5  -4.887   5.819   3.655
   37   HE21  GLN   5          1HE2      GLN   5  -4.159   4.898   5.558
   38   HE22  GLN   5          2HE2      GLN   5  -2.622   4.120   5.669
   39    H    ARG   6           H        ARG   6  -6.720   2.804  -0.027
   40    HA   ARG   6           HA       ARG   6  -8.143   0.537   0.998
   41    HB2  ARG   6          2HB       ARG   6  -9.457   2.092  -0.257
   42    HB3  ARG   6          1HB       ARG   6  -8.372   1.995  -1.646
   43    HG2  ARG   6          2HG       ARG   6  -8.972  -0.402  -1.882
   44    HG3  ARG   6          1HG       ARG   6 -10.141  -0.202  -0.588
   45    HD2  ARG   6          2HD       ARG   6 -11.500   1.195  -1.914
   46    HD3  ARG   6          1HD       ARG   6 -10.219   1.426  -3.112
   47    HE   ARG   6           HE       ARG   6 -10.495  -1.202  -3.148
   48   HH11  ARG   6          1HH1      ARG   6 -13.011   1.302  -3.394
   49   HH12  ARG   6          2HH1      ARG   6 -14.012   0.365  -4.404
   50   HH21  ARG   6          1HH2      ARG   6 -11.894  -2.453  -4.475
   51   HH22  ARG   6          2HH2      ARG   6 -13.366  -1.798  -5.048
   52    H    LYS   7           H        LYS   7  -5.951   1.083  -1.730
   53    HA   LYS   7           HA       LYS   7  -6.187  -1.512  -2.749
   54    HB2  LYS   7          2HB       LYS   7  -3.991   0.513  -3.137
   55    HB3  LYS   7          1HB       LYS   7  -4.102  -0.999  -4.030
   56    HG2  LYS   7          2HG       LYS   7  -6.206   1.164  -4.031
   57    HG3  LYS   7          1HG       LYS   7  -4.995   0.917  -5.288
   58    HD2  LYS   7          2HD       LYS   7  -5.912  -1.281  -5.782
   59    HD3  LYS   7          1HD       LYS   7  -7.061  -1.129  -4.460
   60    HE2  LYS   7          2HE       LYS   7  -8.063  -0.693  -6.680
   61    HE3  LYS   7          1HE       LYS   7  -8.204   0.665  -5.570
   62    HZ1  LYS   7          1HZ       LYS   7  -6.542   1.824  -6.700
   63    HZ2  LYS   7          2HZ       LYS   7  -7.545   1.225  -7.895
   64    HZ3  LYS   7          3HZ       LYS   7  -6.050   0.486  -7.609
   65    H    CYS   8           H        CYS   8  -3.845  -0.214  -0.457
   66    HA   CYS   8           HA       CYS   8  -2.346  -2.590  -0.251
   67    HB2  CYS   8          2HB       CYS   8  -2.763  -0.358   1.744
   68    HB3  CYS   8          1HB       CYS   8  -1.546  -1.618   1.911
   69    H    LYS   9           H        LYS   9  -5.335  -1.548   1.175
   70    HA   LYS   9           HA       LYS   9  -5.480  -3.488   3.231
   71    HB2  LYS   9          2HB       LYS   9  -6.824  -1.431   3.258
   72    HB3  LYS   9          1HB       LYS   9  -7.652  -1.939   1.801
   73    HG2  LYS   9          2HG       LYS   9  -9.057  -2.252   3.739
   74    HG3  LYS   9          1HG       LYS   9  -8.645  -3.808   3.022
   75    HD2  LYS   9          2HD       LYS   9  -6.964  -4.185   4.727
   76    HD3  LYS   9          1HD       LYS   9  -7.260  -2.585   5.406
   77    HE2  LYS   9          2HE       LYS   9  -9.280  -4.820   5.251
   78    HE3  LYS   9          1HE       LYS   9  -8.370  -4.361   6.691
   79    HZ1  LYS   9          1HZ       LYS   9 -10.315  -2.639   5.239
   80    HZ2  LYS   9          2HZ       LYS   9  -9.400  -2.176   6.581
   81    HZ3  LYS   9          3HZ       LYS   9 -10.554  -3.387   6.736
   82    H    GLU  10           H        GLU  10  -6.659  -3.328  -0.094
   83    HA   GLU  10           HA       GLU  10  -7.835  -5.940  -0.003
   84    HB2  GLU  10          2HB       GLU  10  -7.126  -4.218  -2.390
   85    HB3  GLU  10          1HB       GLU  10  -8.151  -5.648  -2.430
   86    HG2  GLU  10          2HG       GLU  10  -9.754  -4.535  -0.953
   87    HG3  GLU  10          1HG       GLU  10  -8.731  -3.103  -0.927
   88    H    LEU  11           H        LEU  11  -4.765  -4.613  -0.978
   89    HA   LEU  11           HA       LEU  11  -3.754  -6.922  -2.258
   90    HB2  LEU  11          2HB       LEU  11  -2.905  -4.650  -2.681
   91    HB3  LEU  11          1HB       LEU  11  -2.321  -4.583  -1.034
   92    HG   LEU  11           HG       LEU  11  -0.636  -6.262  -1.501
   93   HD11  LEU  11          1HD1      LEU  11  -0.291  -7.109  -3.772
   94   HD12  LEU  11          2HD1      LEU  11  -1.769  -6.296  -4.295
   95   HD13  LEU  11          3HD1      LEU  11  -1.852  -7.613  -3.126
   96   HD21  LEU  11          1HD2      LEU  11   0.734  -4.973  -3.040
   97   HD22  LEU  11          2HD2      LEU  11  -0.151  -3.889  -1.961
   98   HD23  LEU  11          3HD2      LEU  11  -0.694  -4.121  -3.618
   99    H    DAS  12           H        DAS  12  -3.829  -5.879   1.085
  100    HA   DAS  12           HA       DAS  12  -2.846  -8.539   1.728
  101    HB2  DAS  12          1HB       DAS  12  -4.896  -7.932   2.869
  102    HB3  DAS  12          2HB       DAS  12  -4.139  -6.480   3.521
  103    H    THR  13           H        THR  13  -0.983  -8.957   2.658
  104    HA   THR  13           HA       THR  13   0.698  -6.648   3.275
  105    HB   THR  13           HB       THR  13   0.192  -8.165   5.235
  106    HG1  THR  13          1HG       THR  13   2.940  -8.424   4.680
  107   HG21  THR  13          1HG2      THR  13   0.095 -10.318   4.093
  108   HG22  THR  13          2HG2      THR  13   1.326 -10.363   5.355
  109   HG23  THR  13          3HG2      THR  13   1.799 -10.187   3.666
  110    H    ARG  14           H        ARG  14  -0.040  -8.227   0.859
  111    HA   ARG  14           HA       ARG  14   2.413  -9.453  -0.065
  112    HB2  ARG  14          2HB       ARG  14  -0.294  -8.954  -1.326
  113    HB3  ARG  14          1HB       ARG  14   1.032  -9.731  -2.175
  114    HG2  ARG  14          2HG       ARG  14   0.993 -11.597  -0.720
  115    HG3  ARG  14          1HG       ARG  14  -0.075 -10.771   0.414
  116    HD2  ARG  14          2HD       ARG  14  -0.826 -11.514  -2.409
  117    HD3  ARG  14          1HD       ARG  14  -1.212 -12.487  -0.987
  118    HE   ARG  14           HE       ARG  14  -2.082  -9.702  -1.061
  119   HH11  ARG  14          1HH1      ARG  14  -3.003 -13.098  -1.311
  120   HH12  ARG  14          2HH1      ARG  14  -4.645 -12.832  -0.974
  121   HH21  ARG  14          1HH2      ARG  14  -4.312  -9.312  -0.618
  122   HH22  ARG  14          2HH2      ARG  14  -5.408 -10.615  -0.587
  123    HA   DPR  15           HA       DPR  15   2.892  -6.035  -3.160
  124    HB2  DPR  15          1HB       DPR  15   5.675  -6.996  -3.303
  125    HB3  DPR  15          2HB       DPR  15   4.506  -6.775  -4.602
  126    HG2  DPR  15          1HG       DPR  15   5.249  -9.218  -3.784
  127    HG3  DPR  15          2HG       DPR  15   3.587  -8.877  -4.302
  128    HD2  DPR  15          1HD       DPR  15   4.701  -9.059  -1.523
  129    HD3  DPR  15          2HD       DPR  15   3.215  -9.780  -2.181
  130    H    DGL  16           H        DGL  16   4.471  -6.868  -0.215
  131    HA   DGL  16           HA       DGL  16   6.197  -4.710   0.233
  132    HB2  DGL  16          1HB       DGL  16   6.011  -6.579   1.853
  133    HB3  DGL  16          2HB       DGL  16   4.381  -6.066   2.255
  134    HG2  DGL  16          1HG       DGL  16   5.314  -3.916   3.060
  135    HG3  DGL  16          2HG       DGL  16   6.928  -4.541   2.765
  136    H    DAL  17           H        DAL  17   2.743  -5.038   0.568
  137    HA   DAL  17           HA       DAL  17   2.142  -2.811   2.077
  138    HB1  DAL  17          1HB       DAL  17   0.449  -4.096  -0.050
  139    HB2  DAL  17          2HB       DAL  17  -0.129  -3.021   1.220
  140    HB3  DAL  17          3HB       DAL  17   0.551  -4.595   1.638
  141    H    DGL  18           H        DGL  18   2.343  -3.053  -1.465
  142    HA   DGL  18           HA       DGL  18   1.469  -0.417  -1.881
  143    HB2  DGL  18          1HB       DGL  18   1.371  -2.069  -3.670
  144    HB3  DGL  18          2HB       DGL  18   3.126  -2.156  -3.708
  145    HG2  DGL  18          1HG       DGL  18   3.291   0.086  -4.508
  146    HG3  DGL  18          2HG       DGL  18   1.569   0.355  -4.265
  147    H    DAR  19           H        DAR  19   4.696  -1.753  -1.563
  148    HA   DAR  19           HA       DAR  19   6.123   0.672  -2.080
  149    HB2  DAR  19          1HB       DAR  19   6.937  -1.708  -0.412
  150    HB3  DAR  19          2HB       DAR  19   8.014  -0.418  -0.907
  151    HG2  DAR  19          1HG       DAR  19   7.666  -1.026  -3.247
  152    HG3  DAR  19          2HG       DAR  19   6.619  -2.354  -2.728
  153    HD2  DAR  19          1HD       DAR  19   9.507  -2.000  -1.928
  154    HD3  DAR  19          2HD       DAR  19   8.935  -3.074  -3.199
  155    HE   DAR  19           HE       DAR  19   7.745  -4.316  -1.525
  156   HH11  DAR  19          1HH2      DAR  19   8.203  -5.602   0.374
  157   HH12  DAR  19          2HH2      DAR  19   9.390  -5.108   1.477
  158   HH21  DAR  19          1HH1      DAR  19  10.310  -2.187  -0.327
  159   HH22  DAR  19          2HH1      DAR  19  10.628  -3.111   1.063
  160    H    DLY  20           H        DLY  20   4.947  -0.891   0.756
  161    HA   DLY  20           HA       DLY  20   5.966   0.683   2.813
  162    HB2  DLY  20          1HB       DLY  20   4.779  -1.584   2.730
  163    HB3  DLY  20          2HB       DLY  20   3.286  -0.681   2.708
  164    HG2  DLY  20          1HG       DLY  20   3.615   0.140   4.887
  165    HG3  DLY  20          2HG       DLY  20   5.272  -0.495   4.933
  166    HD2  DLY  20          1HD       DLY  20   4.263  -2.771   4.498
  167    HD3  DLY  20          2HD       DLY  20   2.684  -2.045   4.754
  168    HE2  DLY  20          1HE       DLY  20   3.202  -1.514   7.005
  169    HE3  DLY  20          2HE       DLY  20   4.884  -2.002   6.788
  170    HZ1  DLY  20          1HZ       DLY  20   4.088  -4.248   6.295
  171    HZ2  DLY  20          2HZ       DLY  20   2.510  -3.785   6.645
  172    HZ3  DLY  20          3HZ       DLY  20   3.677  -3.779   7.860
  173    H    DCY  21           H        DCY  21   2.891   0.830   1.041
  174    HA   DCY  21           HA       DCY  21   1.963   3.186   2.277
  175    HB2  DCY  21          1HB       DCY  21   1.181   1.843  -0.295
  176    HB3  DCY  21          2HB       DCY  21   0.307   3.203   0.426
  177    H    DAR  22           H        DAR  22   3.840   2.590  -0.672
  178    HA   DAR  22           HA       DAR  22   3.713   5.226  -1.679
  179    HB2  DAR  22          1HB       DAR  22   5.787   3.061  -2.050
  180    HB3  DAR  22          2HB       DAR  22   5.891   4.616  -2.858
  181    HG2  DAR  22          1HG       DAR  22   3.589   2.694  -3.165
  182    HG3  DAR  22          2HG       DAR  22   4.947   2.824  -4.282
  183    HD2  DAR  22          1HD       DAR  22   2.999   5.039  -3.617
  184    HD3  DAR  22          2HD       DAR  22   3.015   4.078  -5.094
  185    HE   DAR  22           HE       DAR  22   5.479   5.030  -5.093
  186   HH11  DAR  22          1HH1      DAR  22   2.394   6.740  -4.646
  187   HH12  DAR  22          2HH1      DAR  22   3.011   8.220  -5.197
  188   HH21  DAR  22          1HH2      DAR  22   6.287   7.069  -5.819
  189   HH22  DAR  22          2HH2      DAR  22   5.263   8.418  -5.891
  190    H    DGL  23           H        DGL  23   5.758   3.733   0.699
  191    HA   DGL  23           HA       DGL  23   7.592   5.871   0.990
  192    HB2  DGL  23          1HB       DGL  23   7.824   3.460   1.810
  193    HB3  DGL  23          2HB       DGL  23   6.738   3.904   3.111
  194    HG2  DGL  23          1HG       DGL  23   8.983   3.988   3.907
  195    HG3  DGL  23          2HG       DGL  23   8.329   5.624   3.837
  196    H    DGL  24           H        DGL  24   4.606   4.966   2.654
  197    HA   DGL  24           HA       DGL  24   4.685   7.124   4.520
  198    HB2  DGL  24          1HB       DGL  24   2.438   5.285   3.744
  199    HB3  DGL  24          2HB       DGL  24   2.368   6.436   5.066
  200    HG2  DGL  24          1HG       DGL  24   4.227   5.288   6.154
  201    HG3  DGL  24          2HG       DGL  24   4.244   4.112   4.836
  202    H    SER  25           H        SER  25   2.671   6.519   1.650
  203    HA   SER  25           HA       SER  25   2.243   9.365   1.393
  204    HB2  SER  25          2HB       SER  25   1.325   7.051  -0.322
  205    HB3  SER  25          1HB       SER  25   1.254   8.762  -0.769
  206    HG   SER  25           HG       SER  25   3.671   7.615   0.010
  207    H    ASP  26           H        ASP  26   0.189  10.278   1.731
  208    HA   ASP  26           HA       ASP  26  -1.520   8.683   3.496
  209    HB2  ASP  26          2HB       ASP  26  -1.621  11.648   2.900
  210    HB3  ASP  26          1HB       ASP  26  -2.476  10.805   4.181
  Start of MODEL   10
    1    H    ASN   1           H        ASN   1  -2.049   7.600   0.748
    2    HA   ASN   1           HA       ASN   1  -4.071   9.586  -0.003
    3    HB2  ASN   1          2HB       ASN   1  -2.541   7.582  -1.701
    4    HB3  ASN   1          1HB       ASN   1  -3.834   8.606  -2.298
    5   HD21  ASN   1          1HD2      ASN   1  -3.421  10.776  -2.661
    6   HD22  ASN   1          2HD2      ASN   1  -1.821  11.427  -2.652
    7    HA   PRO   2           HA       PRO   2  -7.096   6.565   1.268
    8    HB2  PRO   2          2HB       PRO   2  -8.466   7.653  -1.157
    9    HB3  PRO   2          1HB       PRO   2  -9.117   7.350   0.456
   10    HG2  PRO   2          2HG       PRO   2  -8.476   9.819  -0.275
   11    HG3  PRO   2          1HG       PRO   2  -8.128   9.242   1.364
   12    HD2  PRO   2          2HD       PRO   2  -6.274   9.727  -0.904
   13    HD3  PRO   2          1HD       PRO   2  -5.993   9.852   0.842
   14    H    GLU   3           H        GLU   3  -6.546   6.859  -2.248
   15    HA   GLU   3           HA       GLU   3  -7.457   4.311  -2.972
   16    HB2  GLU   3          2HB       GLU   3  -6.993   6.238  -4.513
   17    HB3  GLU   3          1HB       GLU   3  -5.281   5.882  -4.338
   18    HG2  GLU   3          2HG       GLU   3  -5.987   4.914  -6.370
   19    HG3  GLU   3          1HG       GLU   3  -5.757   3.594  -5.228
   20    H    LEU   4           H        LEU   4  -4.189   5.429  -2.058
   21    HA   LEU   4           HA       LEU   4  -2.933   2.955  -2.558
   22    HB2  LEU   4          2HB       LEU   4  -2.108   5.307  -0.878
   23    HB3  LEU   4          1HB       LEU   4  -1.113   3.888  -1.103
   24    HG   LEU   4           HG       LEU   4  -1.982   5.798  -3.275
   25   HD11  LEU   4          1HD1      LEU   4  -0.309   6.748  -1.787
   26   HD12  LEU   4          2HD1      LEU   4   0.396   6.372  -3.362
   27   HD13  LEU   4          3HD1      LEU   4   0.698   5.315  -1.987
   28   HD21  LEU   4          1HD2      LEU   4  -0.211   3.351  -3.384
   29   HD22  LEU   4          2HD2      LEU   4  -0.402   4.518  -4.683
   30   HD23  LEU   4          3HD2      LEU   4  -1.780   3.546  -4.175
   31    H    GLN   5           H        GLN   5  -4.377   4.400   0.297
   32    HA   GLN   5           HA       GLN   5  -3.555   2.330   2.039
   33    HB2  GLN   5          2HB       GLN   5  -5.933   4.185   2.301
   34    HB3  GLN   5          1HB       GLN   5  -5.279   3.191   3.598
   35    HG2  GLN   5          2HG       GLN   5  -3.132   4.410   3.396
   36    HG3  GLN   5          1HG       GLN   5  -3.868   5.444   2.180
   37   HE21  GLN   5          1HE2      GLN   5  -6.446   5.469   3.672
   38   HE22  GLN   5          2HE2      GLN   5  -6.177   6.536   4.998
   39    H    ARG   6           H        ARG   6  -6.383   2.773   0.022
   40    HA   ARG   6           HA       ARG   6  -7.726   0.398   0.741
   41    HB2  ARG   6          2HB       ARG   6  -8.899   2.065  -0.557
   42    HB3  ARG   6          1HB       ARG   6  -7.722   1.941  -1.858
   43    HG2  ARG   6          2HG       ARG   6  -8.407  -0.401  -2.216
   44    HG3  ARG   6          1HG       ARG   6  -9.649  -0.196  -0.987
   45    HD2  ARG   6          2HD       ARG   6 -10.781   1.421  -2.309
   46    HD3  ARG   6          1HD       ARG   6  -9.449   1.485  -3.469
   47    HE   ARG   6           HE       ARG   6 -10.032  -1.053  -3.609
   48   HH11  ARG   6          1HH1      ARG   6 -12.301   1.661  -3.554
   49   HH12  ARG   6          2HH1      ARG   6 -13.469   0.887  -4.529
   50   HH21  ARG   6          1HH2      ARG   6 -11.597  -2.091  -4.930
   51   HH22  ARG   6          2HH2      ARG   6 -13.064  -1.340  -5.318
   52    H    LYS   7           H        LYS   7  -5.265   1.101  -1.661
   53    HA   LYS   7           HA       LYS   7  -5.123  -1.324  -3.038
   54    HB2  LYS   7          2HB       LYS   7  -3.911   0.731  -3.698
   55    HB3  LYS   7          1HB       LYS   7  -2.872   0.563  -2.297
   56    HG2  LYS   7          2HG       LYS   7  -1.648  -0.175  -4.187
   57    HG3  LYS   7          1HG       LYS   7  -2.079  -1.610  -3.257
   58    HD2  LYS   7          2HD       LYS   7  -3.939  -2.042  -4.790
   59    HD3  LYS   7          1HD       LYS   7  -3.508  -0.602  -5.718
   60    HE2  LYS   7          2HE       LYS   7  -1.271  -1.615  -6.121
   61    HE3  LYS   7          1HE       LYS   7  -1.832  -3.068  -5.311
   62    HZ1  LYS   7          1HZ       LYS   7  -3.561  -3.285  -7.009
   63    HZ2  LYS   7          2HZ       LYS   7  -2.030  -3.306  -7.675
   64    HZ3  LYS   7          3HZ       LYS   7  -2.971  -1.912  -7.791
   65    H    CYS   8           H        CYS   8  -3.381  -0.253  -0.186
   66    HA   CYS   8           HA       CYS   8  -2.034  -2.679   0.234
   67    HB2  CYS   8          2HB       CYS   8  -2.616  -0.425   2.138
   68    HB3  CYS   8          1HB       CYS   8  -1.381  -1.674   2.357
   69    H    LYS   9           H        LYS   9  -5.131  -1.480   1.285
   70    HA   LYS   9           HA       LYS   9  -5.557  -3.493   3.235
   71    HB2  LYS   9          2HB       LYS   9  -6.752  -1.336   3.191
   72    HB3  LYS   9          1HB       LYS   9  -7.562  -1.824   1.711
   73    HG2  LYS   9          2HG       LYS   9  -8.639  -3.663   2.903
   74    HG3  LYS   9          1HG       LYS   9  -7.830  -3.176   4.390
   75    HD2  LYS   9          2HD       LYS   9  -9.764  -1.474   2.813
   76    HD3  LYS   9          1HD       LYS   9 -10.144  -2.384   4.276
   77    HE2  LYS   9          2HE       LYS   9  -8.518  -1.038   5.529
   78    HE3  LYS   9          1HE       LYS   9  -8.148  -0.126   4.067
   79    HZ1  LYS   9          1HZ       LYS   9 -10.813  -0.246   5.359
   80    HZ2  LYS   9          2HZ       LYS   9 -10.372   0.691   4.006
   81    HZ3  LYS   9          3HZ       LYS   9  -9.703   1.021   5.503
   82    H    GLU  10           H        GLU  10  -6.265  -3.198  -0.201
   83    HA   GLU  10           HA       GLU  10  -7.678  -5.678  -0.276
   84    HB2  GLU  10          2HB       GLU  10  -6.615  -3.976  -2.526
   85    HB3  GLU  10          1HB       GLU  10  -7.592  -5.417  -2.760
   86    HG2  GLU  10          2HG       GLU  10  -9.345  -4.296  -1.320
   87    HG3  GLU  10          1HG       GLU  10  -8.388  -2.826  -1.471
   88    H    LEU  11           H        LEU  11  -4.386  -4.715  -0.984
   89    HA   LEU  11           HA       LEU  11  -3.617  -7.328  -1.909
   90    HB2  LEU  11          2HB       LEU  11  -2.145  -4.797  -1.329
   91    HB3  LEU  11          1HB       LEU  11  -1.233  -6.284  -1.398
   92    HG   LEU  11           HG       LEU  11  -1.151  -5.009  -3.503
   93   HD11  LEU  11          1HD1      LEU  11  -1.664  -6.845  -5.014
   94   HD12  LEU  11          2HD1      LEU  11  -2.558  -7.658  -3.730
   95   HD13  LEU  11          3HD1      LEU  11  -0.820  -7.382  -3.565
   96   HD21  LEU  11          1HD2      LEU  11  -3.118  -4.900  -4.955
   97   HD22  LEU  11          2HD2      LEU  11  -3.357  -4.004  -3.457
   98   HD23  LEU  11          3HD2      LEU  11  -4.108  -5.589  -3.665
   99    H    DAS  12           H        DAS  12  -3.837  -5.790   1.155
  100    HA   DAS  12           HA       DAS  12  -3.094  -8.293   2.389
  101    HB2  DAS  12          1HB       DAS  12  -5.140  -7.212   3.153
  102    HB3  DAS  12          2HB       DAS  12  -4.259  -5.745   3.538
  103    H    THR  13           H        THR  13  -1.043  -8.548   2.496
  104    HA   THR  13           HA       THR  13   0.665  -6.283   3.254
  105    HB   THR  13           HB       THR  13   1.187  -9.207   3.938
  106    HG1  THR  13          1HG       THR  13  -0.158  -7.130   5.306
  107   HG21  THR  13          1HG2      THR  13   2.367  -6.629   5.022
  108   HG22  THR  13          2HG2      THR  13   3.184  -7.739   3.922
  109   HG23  THR  13          3HG2      THR  13   2.784  -8.256   5.560
  110    H    ARG  14           H        ARG  14  -0.253  -8.288   0.816
  111    HA   ARG  14           HA       ARG  14   2.199  -9.127  -0.350
  112    HB2  ARG  14          2HB       ARG  14  -0.557  -8.747  -1.541
  113    HB3  ARG  14          1HB       ARG  14   0.791  -9.456  -2.419
  114    HG2  ARG  14          2HG       ARG  14   0.898 -11.285  -0.843
  115    HG3  ARG  14          1HG       ARG  14  -0.367 -10.544   0.135
  116    HD2  ARG  14          2HD       ARG  14  -1.953 -10.798  -1.692
  117    HD3  ARG  14          1HD       ARG  14  -0.689 -11.484  -2.715
  118    HE   ARG  14           HE       ARG  14  -0.552 -13.165  -0.767
  119   HH11  ARG  14          1HH1      ARG  14  -3.523 -11.829  -2.151
  120   HH12  ARG  14          2HH1      ARG  14  -4.496 -13.171  -1.760
  121   HH21  ARG  14          1HH2      ARG  14  -1.895 -15.029  -0.239
  122   HH22  ARG  14          2HH2      ARG  14  -3.540 -15.026  -0.646
  123    HA   DPR  15           HA       DPR  15   2.666  -5.652  -3.345
  124    HB2  DPR  15          1HB       DPR  15   5.445  -6.529  -3.531
  125    HB3  DPR  15          2HB       DPR  15   4.234  -6.436  -4.808
  126    HG2  DPR  15          1HG       DPR  15   5.175  -8.796  -3.861
  127    HG3  DPR  15          2HG       DPR  15   3.525  -8.601  -4.475
  128    HD2  DPR  15          1HD       DPR  15   4.498  -8.642  -1.645
  129    HD3  DPR  15          2HD       DPR  15   3.073  -9.434  -2.355
  130    H    DGL  16           H        DGL  16   4.287  -6.676  -0.492
  131    HA   DGL  16           HA       DGL  16   5.993  -4.437  -0.086
  132    HB2  DGL  16          1HB       DGL  16   6.288  -6.609   1.085
  133    HB3  DGL  16          2HB       DGL  16   4.791  -6.327   1.957
  134    HG2  DGL  16          1HG       DGL  16   6.614  -5.830   3.410
  135    HG3  DGL  16          2HG       DGL  16   5.806  -4.324   2.988
  136    H    DAL  17           H        DAL  17   2.632  -5.049   0.315
  137    HA   DAL  17           HA       DAL  17   1.953  -3.049   2.161
  138    HB1  DAL  17          1HB       DAL  17   0.413  -4.844   1.468
  139    HB2  DAL  17          2HB       DAL  17   0.301  -4.109  -0.131
  140    HB3  DAL  17          3HB       DAL  17  -0.298  -3.241   1.286
  141    H    DGL  18           H        DGL  18   1.765  -2.993  -1.412
  142    HA   DGL  18           HA       DGL  18   1.135  -0.298  -1.666
  143    HB2  DGL  18          1HB       DGL  18   0.999  -1.950  -3.507
  144    HB3  DGL  18          2HB       DGL  18   2.755  -1.973  -3.588
  145    HG2  DGL  18          1HG       DGL  18   2.722   0.437  -4.139
  146    HG3  DGL  18          2HG       DGL  18   0.962   0.380  -4.163
  147    H    DAR  19           H        DAR  19   4.253  -1.893  -1.547
  148    HA   DAR  19           HA       DAR  19   5.949   0.274  -1.985
  149    HB2  DAR  19          1HB       DAR  19   6.251  -2.247  -0.399
  150    HB3  DAR  19          2HB       DAR  19   7.522  -1.036  -0.403
  151    HG2  DAR  19          1HG       DAR  19   6.439  -2.347  -2.885
  152    HG3  DAR  19          2HG       DAR  19   7.889  -2.870  -2.022
  153    HD2  DAR  19          1HD       DAR  19   7.425  -0.185  -3.343
  154    HD3  DAR  19          2HD       DAR  19   8.547  -1.449  -3.849
  155    HE   DAR  19           HE       DAR  19   9.425  -1.009  -1.422
  156   HH11  DAR  19          1HH2      DAR  19  10.762   0.696  -0.544
  157   HH12  DAR  19          2HH2      DAR  19  10.883   2.194  -1.331
  158   HH21  DAR  19          1HH1      DAR  19   8.669   1.349  -3.963
  159   HH22  DAR  19          2HH1      DAR  19   9.629   2.596  -3.296
  160    H    DLY  20           H        DLY  20   4.773  -0.976   1.134
  161    HA   DLY  20           HA       DLY  20   5.997   0.985   2.694
  162    HB2  DLY  20          1HB       DLY  20   5.005  -1.150   3.578
  163    HB3  DLY  20          2HB       DLY  20   3.413  -0.438   3.351
  164    HG2  DLY  20          1HG       DLY  20   4.015   1.368   4.906
  165    HG3  DLY  20          2HG       DLY  20   5.589   0.611   5.146
  166    HD2  DLY  20          1HD       DLY  20   4.467  -1.407   5.986
  167    HD3  DLY  20          2HD       DLY  20   2.918  -0.575   5.849
  168    HE2  DLY  20          1HE       DLY  20   5.252   0.270   7.574
  169    HE3  DLY  20          2HE       DLY  20   3.763  -0.477   8.144
  170    HZ1  DLY  20          1HZ       DLY  20   3.962   2.234   6.909
  171    HZ2  DLY  20          2HZ       DLY  20   3.710   1.854   8.508
  172    HZ3  DLY  20          3HZ       DLY  20   2.537   1.447   7.373
  173    H    DCY  21           H        DCY  21   2.766   0.852   1.240
  174    HA   DCY  21           HA       DCY  21   1.935   3.317   2.301
  175    HB2  DCY  21          1HB       DCY  21   0.979   1.843  -0.125
  176    HB3  DCY  21          2HB       DCY  21   0.173   3.260   0.557
  177    H    DAR  22           H        DAR  22   3.845   2.581  -0.550
  178    HA   DAR  22           HA       DAR  22   3.671   5.173  -1.716
  179    HB2  DAR  22          1HB       DAR  22   5.947   3.185  -1.844
  180    HB3  DAR  22          2HB       DAR  22   5.829   4.641  -2.813
  181    HG2  DAR  22          1HG       DAR  22   3.842   3.774  -3.915
  182    HG3  DAR  22          2HG       DAR  22   3.982   2.286  -2.967
  183    HD2  DAR  22          1HD       DAR  22   6.232   1.938  -3.899
  184    HD3  DAR  22          2HD       DAR  22   6.047   3.404  -4.855
  185    HE   DAR  22           HE       DAR  22   4.185   1.180  -5.206
  186   HH11  DAR  22          1HH1      DAR  22   6.693   3.316  -6.566
  187   HH12  DAR  22          2HH1      DAR  22   6.449   2.752  -8.151
  188   HH21  DAR  22          1HH2      DAR  22   3.931   0.441  -7.348
  189   HH22  DAR  22          2HH2      DAR  22   4.867   1.122  -8.631
  190    H    DGL  23           H        DGL  23   5.730   3.690   0.689
  191    HA   DGL  23           HA       DGL  23   7.316   6.019   1.071
  192    HB2  DGL  23          1HB       DGL  23   6.917   3.645   2.886
  193    HB3  DGL  23          2HB       DGL  23   8.143   4.890   3.098
  194    HG2  DGL  23          1HG       DGL  23   7.903   2.934   0.824
  195    HG3  DGL  23          2HG       DGL  23   9.145   2.972   2.075
  196    H    DGL  24           H        DGL  24   4.445   4.751   2.632
  197    HA   DGL  24           HA       DGL  24   4.168   6.629   4.711
  198    HB2  DGL  24          1HB       DGL  24   1.985   5.303   3.090
  199    HB3  DGL  24          2HB       DGL  24   1.750   6.116   4.617
  200    HG2  DGL  24          1HG       DGL  24   3.337   3.610   4.207
  201    HG3  DGL  24          2HG       DGL  24   1.711   3.716   4.875
  202    H    SER  25           H        SER  25   2.702   6.527   1.516
  203    HA   SER  25           HA       SER  25   2.283   9.396   1.583
  204    HB2  SER  25          2HB       SER  25   3.421   8.337  -0.422
  205    HB3  SER  25          1HB       SER  25   1.962   7.386  -0.685
  206    HG   SER  25           HG       SER  25   0.827   9.328  -1.006
  207    H    ASP  26           H        ASP  26   0.481   9.603   2.812
  208    HA   ASP  26           HA       ASP  26  -1.499   7.569   2.764
  209    HB2  ASP  26          2HB       ASP  26  -2.711   8.904   4.501
  210    HB3  ASP  26          1HB       ASP  26  -1.077   8.440   4.940
  Start of MODEL   11
    1    H    ASN   1           H        ASN   1  -2.334   7.679   1.687
    2    HA   ASN   1           HA       ASN   1  -4.200   9.612   0.533
    3    HB2  ASN   1          2HB       ASN   1  -2.270   9.451  -1.001
    4    HB3  ASN   1          1HB       ASN   1  -2.475   7.706  -1.064
    5   HD21  ASN   1          1HD2      ASN   1  -3.767  10.759  -2.080
    6   HD22  ASN   1          2HD2      ASN   1  -4.841  10.126  -3.274
    7    HA   PRO   2           HA       PRO   2  -7.067   6.359   1.568
    8    HB2  PRO   2          2HB       PRO   2  -8.641   7.576  -0.646
    9    HB3  PRO   2          1HB       PRO   2  -9.134   7.227   1.016
   10    HG2  PRO   2          2HG       PRO   2  -8.628   9.707   0.294
   11    HG3  PRO   2          1HG       PRO   2  -8.040   9.108   1.857
   12    HD2  PRO   2          2HD       PRO   2  -6.546   9.516  -0.701
   13    HD3  PRO   2          1HD       PRO   2  -6.070   9.884   0.973
   14    H    GLU   3           H        GLU   3  -6.404   7.006  -1.869
   15    HA   GLU   3           HA       GLU   3  -7.461   4.532  -2.754
   16    HB2  GLU   3          2HB       GLU   3  -5.649   6.513  -4.119
   17    HB3  GLU   3          1HB       GLU   3  -6.324   5.095  -4.913
   18    HG2  GLU   3          2HG       GLU   3  -8.554   5.896  -4.577
   19    HG3  GLU   3          1HG       GLU   3  -7.958   7.240  -3.606
   20    H    LEU   4           H        LEU   4  -4.190   5.673  -2.082
   21    HA   LEU   4           HA       LEU   4  -2.930   3.247  -2.771
   22    HB2  LEU   4          2HB       LEU   4  -2.091   5.588  -1.094
   23    HB3  LEU   4          1HB       LEU   4  -1.112   4.148  -1.130
   24    HG   LEU   4           HG       LEU   4  -0.852   4.431  -3.597
   25   HD11  LEU   4          1HD1      LEU   4  -2.849   5.726  -4.070
   26   HD12  LEU   4          2HD1      LEU   4  -1.392   6.538  -4.641
   27   HD13  LEU   4          3HD1      LEU   4  -2.187   7.090  -3.168
   28   HD21  LEU   4          1HD2      LEU   4   0.722   6.282  -3.467
   29   HD22  LEU   4          2HD2      LEU   4   0.853   5.214  -2.068
   30   HD23  LEU   4          3HD2      LEU   4   0.026   6.766  -1.921
   31    H    GLN   5           H        GLN   5  -4.302   4.444   0.221
   32    HA   GLN   5           HA       GLN   5  -3.459   2.291   1.804
   33    HB2  GLN   5          2HB       GLN   5  -5.623   4.332   2.115
   34    HB3  GLN   5          1HB       GLN   5  -5.425   3.031   3.283
   35    HG2  GLN   5          2HG       GLN   5  -3.259   4.965   2.513
   36    HG3  GLN   5          1HG       GLN   5  -4.294   5.128   3.936
   37   HE21  GLN   5          1HE2      GLN   5  -4.052   3.697   5.618
   38   HE22  GLN   5          2HE2      GLN   5  -2.663   2.700   5.816
   39    H    ARG   6           H        ARG   6  -6.481   2.777  -0.005
   40    HA   ARG   6           HA       ARG   6  -7.590   0.333   0.889
   41    HB2  ARG   6          2HB       ARG   6  -9.313   0.588  -0.763
   42    HB3  ARG   6          1HB       ARG   6  -8.952   2.174  -0.102
   43    HG2  ARG   6          2HG       ARG   6  -7.600   2.661  -2.077
   44    HG3  ARG   6          1HG       ARG   6  -8.026   1.085  -2.735
   45    HD2  ARG   6          2HD       ARG   6 -10.404   1.718  -2.639
   46    HD3  ARG   6          1HD       ARG   6  -9.929   3.324  -2.085
   47    HE   ARG   6           HE       ARG   6  -8.778   2.380  -4.567
   48   HH11  ARG   6          1HH1      ARG   6 -11.230   4.436  -3.029
   49   HH12  ARG   6          2HH1      ARG   6 -11.556   5.334  -4.435
   50   HH21  ARG   6          1HH2      ARG   6  -9.217   3.637  -6.481
   51   HH22  ARG   6          2HH2      ARG   6 -10.395   4.858  -6.437
   52    H    LYS   7           H        LYS   7  -5.417   1.124  -1.702
   53    HA   LYS   7           HA       LYS   7  -5.430  -1.243  -3.188
   54    HB2  LYS   7          2HB       LYS   7  -4.079   0.522  -4.033
   55    HB3  LYS   7          1HB       LYS   7  -3.266   0.747  -2.497
   56    HG2  LYS   7          2HG       LYS   7  -1.696  -0.217  -4.028
   57    HG3  LYS   7          1HG       LYS   7  -2.120  -1.441  -2.842
   58    HD2  LYS   7          2HD       LYS   7  -2.063  -2.537  -4.938
   59    HD3  LYS   7          1HD       LYS   7  -3.770  -2.329  -4.551
   60    HE2  LYS   7          2HE       LYS   7  -3.284  -1.809  -6.900
   61    HE3  LYS   7          1HE       LYS   7  -3.888  -0.397  -6.031
   62    HZ1  LYS   7          1HZ       LYS   7  -0.986  -0.911  -6.434
   63    HZ2  LYS   7          2HZ       LYS   7  -1.726   0.531  -5.959
   64    HZ3  LYS   7          3HZ       LYS   7  -1.928  -0.047  -7.530
   65    H    CYS   8           H        CYS   8  -3.634  -0.360  -0.302
   66    HA   CYS   8           HA       CYS   8  -2.430  -2.895  -0.063
   67    HB2  CYS   8          2HB       CYS   8  -2.655  -0.634   1.887
   68    HB3  CYS   8          1HB       CYS   8  -1.590  -2.032   2.065
   69    H    LYS   9           H        LYS   9  -5.363  -1.507   1.267
   70    HA   LYS   9           HA       LYS   9  -5.738  -3.692   3.074
   71    HB2  LYS   9          2HB       LYS   9  -7.692  -1.650   2.010
   72    HB3  LYS   9          1HB       LYS   9  -8.126  -2.874   3.192
   73    HG2  LYS   9          2HG       LYS   9  -6.032  -0.734   3.573
   74    HG3  LYS   9          1HG       LYS   9  -7.668  -0.713   4.239
   75    HD2  LYS   9          2HD       LYS   9  -7.161  -2.786   5.487
   76    HD3  LYS   9          1HD       LYS   9  -5.522  -2.753   4.847
   77    HE2  LYS   9          2HE       LYS   9  -6.767  -0.640   6.600
   78    HE3  LYS   9          1HE       LYS   9  -5.643  -1.880   7.133
   79    HZ1  LYS   9          1HZ       LYS   9  -3.982  -0.905   5.596
   80    HZ2  LYS   9          2HZ       LYS   9  -4.456   0.123   6.805
   81    HZ3  LYS   9          3HZ       LYS   9  -5.068   0.352   5.246
   82    H    GLU  10           H        GLU  10  -6.358  -3.212  -0.265
   83    HA   GLU  10           HA       GLU  10  -8.107  -5.461  -0.585
   84    HB2  GLU  10          2HB       GLU  10  -8.078  -3.436  -2.043
   85    HB3  GLU  10          1HB       GLU  10  -6.482  -3.906  -2.598
   86    HG2  GLU  10          2HG       GLU  10  -8.118  -4.521  -4.219
   87    HG3  GLU  10          1HG       GLU  10  -7.437  -5.977  -3.482
   88    H    LEU  11           H        LEU  11  -4.750  -4.668  -1.325
   89    HA   LEU  11           HA       LEU  11  -4.045  -7.190  -2.411
   90    HB2  LEU  11          2HB       LEU  11  -2.978  -5.034  -2.974
   91    HB3  LEU  11          1HB       LEU  11  -2.307  -4.961  -1.364
   92    HG   LEU  11           HG       LEU  11  -0.950  -6.959  -1.858
   93   HD11  LEU  11          1HD1      LEU  11  -2.420  -7.980  -3.533
   94   HD12  LEU  11          2HD1      LEU  11  -0.789  -7.765  -4.154
   95   HD13  LEU  11          3HD1      LEU  11  -2.071  -6.657  -4.645
   96   HD21  LEU  11          1HD2      LEU  11  -0.044  -4.716  -2.201
   97   HD22  LEU  11          2HD2      LEU  11  -0.664  -4.716  -3.854
   98   HD23  LEU  11          3HD2      LEU  11   0.596  -5.855  -3.383
   99    H    DAS  12           H        DAS  12  -3.594  -5.683   0.762
  100    HA   DAS  12           HA       DAS  12  -2.917  -8.303   1.865
  101    HB2  DAS  12          1HB       DAS  12  -5.045  -7.350   2.655
  102    HB3  DAS  12          2HB       DAS  12  -4.214  -5.883   3.141
  103    H    THR  13           H        THR  13  -1.109  -8.452   3.183
  104    HA   THR  13           HA       THR  13   0.558  -6.068   3.521
  105    HB   THR  13           HB       THR  13   1.985  -7.640   4.874
  106    HG1  THR  13          1HG       THR  13  -0.080  -9.518   4.981
  107   HG21  THR  13          1HG2      THR  13  -0.926  -7.524   5.692
  108   HG22  THR  13          2HG2      THR  13   0.272  -6.262   5.980
  109   HG23  THR  13          3HG2      THR  13   0.432  -7.828   6.776
  110    H    ARG  14           H        ARG  14  -0.099  -8.051   1.207
  111    HA   ARG  14           HA       ARG  14   2.337  -9.332   0.507
  112    HB2  ARG  14          2HB       ARG  14  -0.035  -8.733  -1.270
  113    HB3  ARG  14          1HB       ARG  14   1.218  -9.917  -1.564
  114    HG2  ARG  14          2HG       ARG  14  -0.867 -10.029   0.622
  115    HG3  ARG  14          1HG       ARG  14  -0.863 -10.974  -0.859
  116    HD2  ARG  14          2HD       ARG  14  -0.081 -12.437   0.815
  117    HD3  ARG  14          1HD       ARG  14   1.364 -11.923  -0.051
  118    HE   ARG  14           HE       ARG  14   0.547 -10.653   2.468
  119   HH11  ARG  14          1HH1      ARG  14   2.999 -12.466   0.606
  120   HH12  ARG  14          2HH1      ARG  14   4.216 -12.215   1.744
  121   HH21  ARG  14          1HH2      ARG  14   2.233 -10.368   4.035
  122   HH22  ARG  14          2HH2      ARG  14   3.783 -11.033   3.745
  123    HA   DPR  15           HA       DPR  15   3.550  -6.426  -2.856
  124    HB2  DPR  15          1HB       DPR  15   6.250  -7.416  -2.279
  125    HB3  DPR  15          2HB       DPR  15   5.351  -7.464  -3.798
  126    HG2  DPR  15          1HG       DPR  15   5.836  -9.702  -2.390
  127    HG3  DPR  15          2HG       DPR  15   4.317  -9.457  -3.275
  128    HD2  DPR  15          1HD       DPR  15   4.852  -9.111  -0.345
  129    HD3  DPR  15          2HD       DPR  15   3.503  -9.937  -1.158
  130    H    DGL  16           H        DGL  16   4.565  -6.792   0.395
  131    HA   DGL  16           HA       DGL  16   6.379  -4.589   0.487
  132    HB2  DGL  16          1HB       DGL  16   6.152  -6.569   2.132
  133    HB3  DGL  16          2HB       DGL  16   4.823  -5.660   2.834
  134    HG2  DGL  16          1HG       DGL  16   6.720  -5.173   4.139
  135    HG3  DGL  16          2HG       DGL  16   6.438  -3.752   3.135
  136    H    DAL  17           H        DAL  17   2.972  -5.040   0.685
  137    HA   DAL  17           HA       DAL  17   2.161  -2.720   2.031
  138    HB1  DAL  17          1HB       DAL  17   0.689  -4.620   1.632
  139    HB2  DAL  17          2HB       DAL  17   0.703  -4.265  -0.093
  140    HB3  DAL  17          3HB       DAL  17  -0.019  -3.119   1.033
  141    H    DGL  18           H        DGL  18   2.285  -3.359  -1.478
  142    HA   DGL  18           HA       DGL  18   1.482  -0.888  -2.445
  143    HB2  DGL  18          1HB       DGL  18   1.805  -2.880  -3.846
  144    HB3  DGL  18          2HB       DGL  18   3.539  -2.788  -3.599
  145    HG2  DGL  18          1HG       DGL  18   3.174  -1.922  -5.755
  146    HG3  DGL  18          2HG       DGL  18   3.468  -0.550  -4.678
  147    H    DAR  19           H        DAR  19   4.664  -1.979  -1.529
  148    HA   DAR  19           HA       DAR  19   6.125   0.363  -2.167
  149    HB2  DAR  19          1HB       DAR  19   7.394  -1.608  -1.772
  150    HB3  DAR  19          2HB       DAR  19   6.623  -1.875  -0.212
  151    HG2  DAR  19          1HG       DAR  19   7.695   0.317   0.516
  152    HG3  DAR  19          2HG       DAR  19   8.666   0.207  -0.953
  153    HD2  DAR  19          1HD       DAR  19   9.706  -1.755  -0.260
  154    HD3  DAR  19          2HD       DAR  19   8.498  -2.050   0.992
  155    HE   DAR  19           HE       DAR  19   9.954   0.399   1.359
  156   HH11  DAR  19          1HH2      DAR  19  11.464   0.522   3.070
  157   HH12  DAR  19          2HH2      DAR  19  11.914  -0.890   3.941
  158   HH21  DAR  19          1HH1      DAR  19   9.776  -3.050   2.116
  159   HH22  DAR  19          2HH1      DAR  19  10.944  -2.955   3.364
  160    H    DLY  20           H        DLY  20   4.962  -0.855   0.957
  161    HA   DLY  20           HA       DLY  20   5.749   1.258   2.542
  162    HB2  DLY  20          1HB       DLY  20   5.074  -0.928   3.394
  163    HB3  DLY  20          2HB       DLY  20   3.418  -0.626   2.904
  164    HG2  DLY  20          1HG       DLY  20   3.236   1.178   4.526
  165    HG3  DLY  20          2HG       DLY  20   4.914   0.916   5.013
  166    HD2  DLY  20          1HD       DLY  20   4.387  -1.325   5.752
  167    HD3  DLY  20          2HD       DLY  20   2.731  -1.163   5.174
  168    HE2  DLY  20          1HE       DLY  20   2.366   0.662   6.781
  169    HE3  DLY  20          2HE       DLY  20   4.010   0.446   7.380
  170    HZ1  DLY  20          1HZ       DLY  20   2.337  -0.696   8.757
  171    HZ2  DLY  20          2HZ       DLY  20   3.452  -1.766   8.102
  172    HZ3  DLY  20          3HZ       DLY  20   1.918  -1.657   7.439
  173    H    DCY  21           H        DCY  21   2.754   0.852   0.719
  174    HA   DCY  21           HA       DCY  21   1.528   3.085   1.912
  175    HB2  DCY  21          1HB       DCY  21   0.914   1.480  -0.515
  176    HB3  DCY  21          2HB       DCY  21  -0.077   2.877  -0.054
  177    H    DAR  22           H        DAR  22   3.557   2.812  -0.963
  178    HA   DAR  22           HA       DAR  22   3.022   5.607  -1.578
  179    HB2  DAR  22          1HB       DAR  22   4.527   5.344  -3.480
  180    HB3  DAR  22          2HB       DAR  22   3.348   4.046  -3.463
  181    HG2  DAR  22          1HG       DAR  22   5.042   2.574  -2.437
  182    HG3  DAR  22          2HG       DAR  22   6.219   3.874  -2.605
  183    HD2  DAR  22          1HD       DAR  22   5.915   3.863  -5.015
  184    HD3  DAR  22          2HD       DAR  22   4.696   2.597  -4.854
  185    HE   DAR  22           HE       DAR  22   7.461   2.226  -3.963
  186   HH11  DAR  22          1HH1      DAR  22   4.728   1.179  -5.964
  187   HH12  DAR  22          2HH1      DAR  22   5.432  -0.330  -6.356
  188   HH21  DAR  22          1HH2      DAR  22   8.425   0.153  -4.576
  189   HH22  DAR  22          2HH2      DAR  22   7.540  -0.924  -5.549
  190    H    DGL  23           H        DGL  23   5.253   3.718   0.155
  191    HA   DGL  23           HA       DGL  23   7.359   5.613   0.297
  192    HB2  DGL  23          1HB       DGL  23   7.506   3.111   0.725
  193    HB3  DGL  23          2HB       DGL  23   6.698   3.401   2.253
  194    HG2  DGL  23          1HG       DGL  23   8.538   4.769   3.015
  195    HG3  DGL  23          2HG       DGL  23   9.356   4.557   1.469
  196    H    DGL  24           H        DGL  24   4.685   4.701   2.427
  197    HA   DGL  24           HA       DGL  24   5.217   6.782   4.296
  198    HB2  DGL  24          1HB       DGL  24   2.890   4.909   3.961
  199    HB3  DGL  24          2HB       DGL  24   3.036   6.061   5.283
  200    HG2  DGL  24          1HG       DGL  24   5.017   3.884   4.679
  201    HG3  DGL  24          2HG       DGL  24   3.738   3.764   5.884
  202    H    SER  25           H        SER  25   2.577   6.289   1.886
  203    HA   SER  25           HA       SER  25   2.276   9.197   1.918
  204    HB2  SER  25          2HB       SER  25   1.359   7.191  -0.144
  205    HB3  SER  25          1HB       SER  25   1.213   8.946  -0.270
  206    HG   SER  25           HG       SER  25   3.677   7.617   0.105
  207    H    ASP  26           H        ASP  26   0.496  10.065   2.726
  208    HA   ASP  26           HA       ASP  26  -1.595   8.330   3.719
  209    HB2  ASP  26          2HB       ASP  26  -1.176  11.316   4.030
  210    HB3  ASP  26          1HB       ASP  26  -2.557  10.452   4.687
  Start of MODEL   12
    1    H    ASN   1           H        ASN   1  -1.940   8.781   1.310
    2    HA   ASN   1           HA       ASN   1  -4.523   9.900   1.122
    3    HB2  ASN   1          2HB       ASN   1  -2.846   8.667  -1.077
    4    HB3  ASN   1          1HB       ASN   1  -4.182   9.787  -1.298
    5   HD21  ASN   1          1HD2      ASN   1  -3.854  11.984  -0.864
    6   HD22  ASN   1          2HD2      ASN   1  -2.277  12.633  -0.636
    7    HA   PRO   2           HA       PRO   2  -7.184   6.320   1.392
    8    HB2  PRO   2          2HB       PRO   2  -8.573   7.838  -0.787
    9    HB3  PRO   2          1HB       PRO   2  -9.261   7.044   0.636
   10    HG2  PRO   2          2HG       PRO   2  -8.924   9.669   0.632
   11    HG3  PRO   2          1HG       PRO   2  -8.549   8.721   2.082
   12    HD2  PRO   2          2HD       PRO   2  -6.705  10.004   0.134
   13    HD3  PRO   2          1HD       PRO   2  -6.493   9.703   1.869
   14    H    GLU   3           H        GLU   3  -6.411   7.550  -1.845
   15    HA   GLU   3           HA       GLU   3  -7.010   5.372  -3.441
   16    HB2  GLU   3          2HB       GLU   3  -6.304   7.605  -4.225
   17    HB3  GLU   3          1HB       GLU   3  -4.662   7.258  -3.710
   18    HG2  GLU   3          2HG       GLU   3  -4.831   6.986  -6.084
   19    HG3  GLU   3          1HG       GLU   3  -4.598   5.404  -5.342
   20    H    LEU   4           H        LEU   4  -3.962   6.050  -1.724
   21    HA   LEU   4           HA       LEU   4  -2.777   3.613  -2.628
   22    HB2  LEU   4          2HB       LEU   4  -1.865   5.775  -0.766
   23    HB3  LEU   4          1HB       LEU   4  -0.965   4.290  -0.930
   24    HG   LEU   4           HG       LEU   4   0.117   5.866  -2.294
   25   HD11  LEU   4          1HD1      LEU   4  -0.112   3.694  -3.322
   26   HD12  LEU   4          2HD1      LEU   4  -0.060   4.982  -4.516
   27   HD13  LEU   4          3HD1      LEU   4  -1.593   4.217  -4.130
   28   HD21  LEU   4          1HD2      LEU   4  -1.002   7.191  -4.038
   29   HD22  LEU   4          2HD2      LEU   4  -1.607   7.574  -2.428
   30   HD23  LEU   4          3HD2      LEU   4  -2.560   6.554  -3.509
   31    H    GLN   5           H        GLN   5  -4.180   4.807   0.329
   32    HA   GLN   5           HA       GLN   5  -3.469   2.558   1.865
   33    HB2  GLN   5          2HB       GLN   5  -5.667   4.572   2.280
   34    HB3  GLN   5          1HB       GLN   5  -5.206   3.352   3.464
   35    HG2  GLN   5          2HG       GLN   5  -3.393   5.493   2.365
   36    HG3  GLN   5          1HG       GLN   5  -4.173   5.515   3.943
   37   HE21  GLN   5          1HE2      GLN   5  -1.299   5.481   3.139
   38   HE22  GLN   5          2HE2      GLN   5  -0.637   4.175   4.046
   39    H    ARG   6           H        ARG   6  -6.109   3.096  -0.325
   40    HA   ARG   6           HA       ARG   6  -7.622   0.806   0.317
   41    HB2  ARG   6          2HB       ARG   6  -8.529   2.402  -1.275
   42    HB3  ARG   6          1HB       ARG   6  -7.168   2.144  -2.364
   43    HG2  ARG   6          2HG       ARG   6  -7.864  -0.210  -2.632
   44    HG3  ARG   6          1HG       ARG   6  -9.264   0.111  -1.619
   45    HD2  ARG   6          2HD       ARG   6 -10.069   1.733  -3.251
   46    HD3  ARG   6          1HD       ARG   6  -8.629   1.452  -4.236
   47    HE   ARG   6           HE       ARG   6  -9.671  -1.028  -3.990
   48   HH11  ARG   6          1HH1      ARG   6 -11.001   2.038  -5.134
   49   HH12  ARG   6          2HH1      ARG   6 -12.178   1.321  -6.139
   50   HH21  ARG   6          1HH2      ARG   6 -11.285  -2.027  -5.335
   51   HH22  ARG   6          2HH2      ARG   6 -12.340  -1.049  -6.252
   52    H    LYS   7           H        LYS   7  -5.022   1.346  -1.988
   53    HA   LYS   7           HA       LYS   7  -4.890  -1.158  -3.158
   54    HB2  LYS   7          2HB       LYS   7  -3.739   0.855  -3.998
   55    HB3  LYS   7          1HB       LYS   7  -2.628   0.777  -2.643
   56    HG2  LYS   7          2HG       LYS   7  -1.827  -1.411  -3.473
   57    HG3  LYS   7          1HG       LYS   7  -2.885  -1.230  -4.874
   58    HD2  LYS   7          2HD       LYS   7  -1.724   0.872  -5.440
   59    HD3  LYS   7          1HD       LYS   7  -0.628   0.604  -4.086
   60    HE2  LYS   7          2HE       LYS   7   0.448  -0.134  -6.116
   61    HE3  LYS   7          1HE       LYS   7   0.064  -1.538  -5.121
   62    HZ1  LYS   7          1HZ       LYS   7  -0.448  -1.952  -7.394
   63    HZ2  LYS   7          2HZ       LYS   7  -1.435  -0.597  -7.505
   64    HZ3  LYS   7          3HZ       LYS   7  -1.899  -1.899  -6.554
   65    H    CYS   8           H        CYS   8  -3.099   0.105  -0.389
   66    HA   CYS   8           HA       CYS   8  -1.490  -2.070   0.189
   67    HB2  CYS   8          2HB       CYS   8  -2.786  -0.239   2.212
   68    HB3  CYS   8          1HB       CYS   8  -1.335  -1.193   2.443
   69    H    LYS   9           H        LYS   9  -4.699  -1.274   1.501
   70    HA   LYS   9           HA       LYS   9  -4.774  -3.578   3.184
   71    HB2  LYS   9          2HB       LYS   9  -5.822  -1.307   3.601
   72    HB3  LYS   9          1HB       LYS   9  -7.049  -1.751   2.433
   73    HG2  LYS   9          2HG       LYS   9  -7.750  -3.602   3.839
   74    HG3  LYS   9          1HG       LYS   9  -6.476  -3.218   5.001
   75    HD2  LYS   9          2HD       LYS   9  -7.482  -0.941   5.225
   76    HD3  LYS   9          1HD       LYS   9  -8.829  -1.498   4.239
   77    HE2  LYS   9          2HE       LYS   9  -9.422  -1.637   6.567
   78    HE3  LYS   9          1HE       LYS   9  -9.263  -3.268   5.911
   79    HZ1  LYS   9          1HZ       LYS   9  -8.224  -3.005   8.100
   80    HZ2  LYS   9          2HZ       LYS   9  -7.182  -1.846   7.475
   81    HZ3  LYS   9          3HZ       LYS   9  -7.090  -3.442   6.941
   82    H    GLU  10           H        GLU  10  -5.763  -2.820   0.006
   83    HA   GLU  10           HA       GLU  10  -7.645  -4.912  -0.367
   84    HB2  GLU  10          2HB       GLU  10  -7.557  -2.817  -1.679
   85    HB3  GLU  10          1HB       GLU  10  -6.029  -3.328  -2.358
   86    HG2  GLU  10          2HG       GLU  10  -7.084  -5.106  -3.539
   87    HG3  GLU  10          1HG       GLU  10  -8.618  -4.795  -2.717
   88    H    LEU  11           H        LEU  11  -4.187  -4.528  -0.990
   89    HA   LEU  11           HA       LEU  11  -3.904  -7.173  -2.105
   90    HB2  LEU  11          2HB       LEU  11  -1.860  -5.185  -1.131
   91    HB3  LEU  11          1HB       LEU  11  -1.462  -6.709  -1.894
   92    HG   LEU  11           HG       LEU  11  -2.995  -4.474  -3.209
   93   HD11  LEU  11          1HD1      LEU  11  -0.129  -5.344  -3.524
   94   HD12  LEU  11          2HD1      LEU  11  -0.693  -3.848  -2.778
   95   HD13  LEU  11          3HD1      LEU  11  -0.952  -4.127  -4.500
   96   HD21  LEU  11          1HD2      LEU  11  -3.588  -6.645  -4.118
   97   HD22  LEU  11          2HD2      LEU  11  -1.886  -7.068  -4.268
   98   HD23  LEU  11          3HD2      LEU  11  -2.560  -5.783  -5.263
   99    H    DAS  12           H        DAS  12  -3.272  -5.603   0.968
  100    HA   DAS  12           HA       DAS  12  -2.945  -8.256   2.127
  101    HB2  DAS  12          1HB       DAS  12  -5.035  -7.281   2.848
  102    HB3  DAS  12          2HB       DAS  12  -4.215  -5.798   3.321
  103    H    THR  13           H        THR  13  -1.004  -8.587   2.754
  104    HA   THR  13           HA       THR  13   0.675  -6.318   3.513
  105    HB   THR  13           HB       THR  13   1.906  -8.141   4.853
  106    HG1  THR  13          1HG       THR  13   0.428  -9.874   5.455
  107   HG21  THR  13          1HG2      THR  13  -0.911  -7.372   5.657
  108   HG22  THR  13          2HG2      THR  13   0.543  -6.414   5.948
  109   HG23  THR  13          3HG2      THR  13   0.333  -7.969   6.754
  110    H    ARG  14           H        ARG  14  -0.001  -7.911   1.020
  111    HA   ARG  14           HA       ARG  14   2.381  -9.357   0.301
  112    HB2  ARG  14          2HB       ARG  14  -0.113  -8.665  -1.239
  113    HB3  ARG  14          1HB       ARG  14   1.191  -9.675  -1.848
  114    HG2  ARG  14          2HG       ARG  14   0.805 -11.257  -0.027
  115    HG3  ARG  14          1HG       ARG  14  -0.514 -10.245   0.558
  116    HD2  ARG  14          2HD       ARG  14  -1.744 -10.605  -1.484
  117    HD3  ARG  14          1HD       ARG  14  -0.391 -11.504  -2.174
  118    HE   ARG  14           HE       ARG  14  -1.313 -12.563   0.293
  119   HH11  ARG  14          1HH1      ARG  14  -1.996 -12.512  -3.197
  120   HH12  ARG  14          2HH1      ARG  14  -2.579 -14.093  -3.260
  121   HH21  ARG  14          1HH2      ARG  14  -2.198 -14.756   0.208
  122   HH22  ARG  14          2HH2      ARG  14  -2.734 -15.393  -1.277
  123    HA   DPR  15           HA       DPR  15   3.793  -6.428  -2.977
  124    HB2  DPR  15          1HB       DPR  15   6.403  -7.536  -2.122
  125    HB3  DPR  15          2HB       DPR  15   5.722  -7.406  -3.747
  126    HG2  DPR  15          1HG       DPR  15   5.908  -9.771  -2.525
  127    HG3  DPR  15          2HG       DPR  15   4.503  -9.372  -3.529
  128    HD2  DPR  15          1HD       DPR  15   4.762  -9.346  -0.539
  129    HD3  DPR  15          2HD       DPR  15   3.438  -9.957  -1.555
  130    H    DGL  16           H        DGL  16   4.659  -6.959   0.299
  131    HA   DGL  16           HA       DGL  16   6.235  -4.639   0.735
  132    HB2  DGL  16          1HB       DGL  16   6.258  -6.525   2.316
  133    HB3  DGL  16          2HB       DGL  16   4.565  -6.246   2.684
  134    HG2  DGL  16          1HG       DGL  16   5.117  -4.069   3.629
  135    HG3  DGL  16          2HG       DGL  16   6.814  -4.326   3.243
  136    H    DAL  17           H        DAL  17   2.827  -5.341   0.748
  137    HA   DAL  17           HA       DAL  17   1.912  -3.056   2.117
  138    HB1  DAL  17          1HB       DAL  17  -0.276  -3.587   1.215
  139    HB2  DAL  17          2HB       DAL  17   0.529  -5.054   1.772
  140    HB3  DAL  17          3HB       DAL  17   0.456  -4.689   0.050
  141    H    DGL  18           H        DGL  18   2.135  -3.779  -1.340
  142    HA   DGL  18           HA       DGL  18   1.230  -1.262  -2.181
  143    HB2  DGL  18          1HB       DGL  18   2.239  -1.856  -4.390
  144    HB3  DGL  18          2HB       DGL  18   1.120  -3.043  -3.741
  145    HG2  DGL  18          1HG       DGL  18   3.007  -4.390  -2.975
  146    HG3  DGL  18          2HG       DGL  18   4.111  -3.217  -3.683
  147    H    DAR  19           H        DAR  19   4.350  -2.308  -1.145
  148    HA   DAR  19           HA       DAR  19   5.760  -0.022  -2.131
  149    HB2  DAR  19          1HB       DAR  19   7.017  -2.063  -1.645
  150    HB3  DAR  19          2HB       DAR  19   6.475  -2.034   0.023
  151    HG2  DAR  19          1HG       DAR  19   8.797  -1.296  -0.209
  152    HG3  DAR  19          2HG       DAR  19   7.761  -0.026   0.446
  153    HD2  DAR  19          1HD       DAR  19   7.577   0.948  -1.789
  154    HD3  DAR  19          2HD       DAR  19   8.700  -0.263  -2.409
  155    HE   DAR  19           HE       DAR  19  10.137   0.774  -0.482
  156   HH11  DAR  19          1HH2      DAR  19  11.480   2.707  -0.574
  157   HH12  DAR  19          2HH2      DAR  19  11.056   3.981  -1.616
  158   HH21  DAR  19          1HH1      DAR  19   8.119   2.408  -2.882
  159   HH22  DAR  19          2HH1      DAR  19   9.068   3.823  -2.959
  160    H    DLY  20           H        DLY  20   4.458  -1.052   0.957
  161    HA   DLY  20           HA       DLY  20   5.041   1.114   2.572
  162    HB2  DLY  20          1HB       DLY  20   4.183  -1.042   3.357
  163    HB3  DLY  20          2HB       DLY  20   2.650  -0.743   2.569
  164    HG2  DLY  20          1HG       DLY  20   2.156   1.057   4.096
  165    HG3  DLY  20          2HG       DLY  20   3.729   0.853   4.872
  166    HD2  DLY  20          1HD       DLY  20   3.121  -1.422   5.528
  167    HD3  DLY  20          2HD       DLY  20   1.564  -1.254   4.720
  168    HE2  DLY  20          1HE       DLY  20   1.355  -0.955   7.140
  169    HE3  DLY  20          2HE       DLY  20   0.920   0.510   6.267
  170    HZ1  DLY  20          1HZ       DLY  20   2.324   0.930   8.231
  171    HZ2  DLY  20          2HZ       DLY  20   2.959   1.504   6.806
  172    HZ3  DLY  20          3HZ       DLY  20   3.585   0.085   7.490
  173    H    DCY  21           H        DCY  21   2.353   0.583   0.360
  174    HA   DCY  21           HA       DCY  21   0.745   2.754   0.843
  175    HB2  DCY  21          1HB       DCY  21   1.446   1.561  -1.846
  176    HB3  DCY  21          2HB       DCY  21   0.074   2.616  -1.542
  177    H    DAR  22           H        DAR  22   3.480   2.681  -1.470
  178    HA   DAR  22           HA       DAR  22   3.196   5.520  -1.922
  179    HB2  DAR  22          1HB       DAR  22   5.162   3.501  -2.990
  180    HB3  DAR  22          2HB       DAR  22   5.249   5.209  -3.378
  181    HG2  DAR  22          1HG       DAR  22   2.869   3.471  -3.957
  182    HG3  DAR  22          2HG       DAR  22   4.144   3.821  -5.126
  183    HD2  DAR  22          1HD       DAR  22   3.630   6.216  -4.961
  184    HD3  DAR  22          2HD       DAR  22   2.362   5.864  -3.787
  185    HE   DAR  22           HE       DAR  22   1.874   4.377  -6.098
  186   HH11  DAR  22          1HH1      DAR  22   1.847   7.764  -5.092
  187   HH12  DAR  22          2HH1      DAR  22   0.577   8.229  -6.110
  188   HH21  DAR  22          1HH2      DAR  22   0.122   4.973  -7.513
  189   HH22  DAR  22          2HH2      DAR  22  -0.442   6.575  -7.547
  190    H    DGL  23           H        DGL  23   5.003   3.542   0.205
  191    HA   DGL  23           HA       DGL  23   7.143   5.384   0.570
  192    HB2  DGL  23          1HB       DGL  23   7.422   2.994   1.055
  193    HB3  DGL  23          2HB       DGL  23   6.226   3.108   2.337
  194    HG2  DGL  23          1HG       DGL  23   7.669   4.595   3.592
  195    HG3  DGL  23          2HG       DGL  23   8.862   4.559   2.298
  196    H    DGL  24           H        DGL  24   4.091   4.796   2.235
  197    HA   DGL  24           HA       DGL  24   4.740   6.991   4.048
  198    HB2  DGL  24          1HB       DGL  24   2.467   5.022   4.142
  199    HB3  DGL  24          2HB       DGL  24   2.742   6.297   5.319
  200    HG2  DGL  24          1HG       DGL  24   4.891   5.288   5.904
  201    HG3  DGL  24          2HG       DGL  24   4.595   3.998   4.739
  202    H    SER  25           H        SER  25   2.329   6.155   1.556
  203    HA   SER  25           HA       SER  25   1.493   8.935   1.641
  204    HB2  SER  25          2HB       SER  25   0.792   6.766  -0.360
  205    HB3  SER  25          1HB       SER  25   0.525   8.501  -0.549
  206    HG   SER  25           HG       SER  25   2.995   8.467  -0.131
  207    H    ASP  26           H        ASP  26  -0.052   9.225   3.140
  208    HA   ASP  26           HA       ASP  26  -1.833   7.143   4.007
  209    HB2  ASP  26          2HB       ASP  26  -2.700   8.808   5.569
  210    HB3  ASP  26          1HB       ASP  26  -0.939   8.804   5.573
  Start of MODEL   13
    1    H    ASN   1           H        ASN   1  -1.734   7.445   0.960
    2    HA   ASN   1           HA       ASN   1  -3.710   9.195  -0.331
    3    HB2  ASN   1          2HB       ASN   1  -1.986   7.001  -1.507
    4    HB3  ASN   1          1HB       ASN   1  -3.147   7.957  -2.404
    5   HD21  ASN   1          1HD2      ASN   1  -2.618  10.119  -2.879
    6   HD22  ASN   1          2HD2      ASN   1  -1.001  10.684  -2.780
    7    HA   PRO   2           HA       PRO   2  -6.628   6.003   1.104
    8    HB2  PRO   2          2HB       PRO   2  -8.228   7.509  -0.926
    9    HB3  PRO   2          1HB       PRO   2  -8.702   6.966   0.689
   10    HG2  PRO   2          2HG       PRO   2  -8.093   9.505   0.304
   11    HG3  PRO   2          1HG       PRO   2  -7.507   8.662   1.751
   12    HD2  PRO   2          2HD       PRO   2  -6.026   9.433  -0.721
   13    HD3  PRO   2          1HD       PRO   2  -5.475   9.412   0.966
   14    H    GLU   3           H        GLU   3  -5.912   6.873  -2.200
   15    HA   GLU   3           HA       GLU   3  -7.023   4.721  -3.637
   16    HB2  GLU   3          2HB       GLU   3  -4.430   6.189  -4.155
   17    HB3  GLU   3          1HB       GLU   3  -5.314   5.227  -5.326
   18    HG2  GLU   3          2HG       GLU   3  -7.110   6.788  -5.357
   19    HG3  GLU   3          1HG       GLU   3  -6.423   7.685  -4.004
   20    H    LEU   4           H        LEU   4  -3.736   5.155  -2.405
   21    HA   LEU   4           HA       LEU   4  -2.844   2.545  -3.010
   22    HB2  LEU   4          2HB       LEU   4  -1.736   4.782  -1.352
   23    HB3  LEU   4          1HB       LEU   4  -1.017   3.193  -1.286
   24    HG   LEU   4           HG       LEU   4   0.234   4.643  -2.755
   25   HD11  LEU   4          1HD1      LEU   4   0.167   2.272  -3.229
   26   HD12  LEU   4          2HD1      LEU   4   0.354   3.227  -4.691
   27   HD13  LEU   4          3HD1      LEU   4  -1.212   2.512  -4.307
   28   HD21  LEU   4          1HD2      LEU   4  -0.712   5.454  -4.882
   29   HD22  LEU   4          2HD2      LEU   4  -1.528   6.164  -3.493
   30   HD23  LEU   4          3HD2      LEU   4  -2.298   4.858  -4.393
   31    H    GLN   5           H        GLN   5  -3.955   4.104  -0.069
   32    HA   GLN   5           HA       GLN   5  -3.367   1.948   1.621
   33    HB2  GLN   5          2HB       GLN   5  -5.413   4.126   2.003
   34    HB3  GLN   5          1HB       GLN   5  -4.793   3.070   3.269
   35    HG2  GLN   5          2HG       GLN   5  -2.545   3.948   2.919
   36    HG3  GLN   5          1HG       GLN   5  -3.151   4.994   1.637
   37   HE21  GLN   5          1HE2      GLN   5  -2.945   4.454   5.012
   38   HE22  GLN   5          2HE2      GLN   5  -3.584   5.991   5.487
   39    H    ARG   6           H        ARG   6  -6.295   2.700  -0.237
   40    HA   ARG   6           HA       ARG   6  -7.830   0.593   0.800
   41    HB2  ARG   6          2HB       ARG   6  -8.911   2.313  -0.551
   42    HB3  ARG   6          1HB       ARG   6  -7.927   1.886  -1.944
   43    HG2  ARG   6          2HG       ARG   6 -10.160   0.995  -2.211
   44    HG3  ARG   6          1HG       ARG   6  -9.004  -0.323  -2.013
   45    HD2  ARG   6          2HD       ARG   6  -9.638  -0.346   0.438
   46    HD3  ARG   6          1HD       ARG   6 -10.943   0.763   0.014
   47    HE   ARG   6           HE       ARG   6 -10.786  -1.724  -1.451
   48   HH11  ARG   6          1HH1      ARG   6 -12.471   0.146   1.071
   49   HH12  ARG   6          2HH1      ARG   6 -13.720  -1.003   1.239
   50   HH21  ARG   6          1HH2      ARG   6 -12.463  -3.265  -1.170
   51   HH22  ARG   6          2HH2      ARG   6 -13.756  -2.947  -0.079
   52    H    LYS   7           H        LYS   7  -5.606   0.791  -1.956
   53    HA   LYS   7           HA       LYS   7  -5.875  -1.832  -2.862
   54    HB2  LYS   7          2HB       LYS   7  -4.648  -0.145  -4.166
   55    HB3  LYS   7          1HB       LYS   7  -3.404  -0.071  -2.922
   56    HG2  LYS   7          2HG       LYS   7  -2.897  -2.458  -3.341
   57    HG3  LYS   7          1HG       LYS   7  -4.071  -2.446  -4.650
   58    HD2  LYS   7          2HD       LYS   7  -2.737  -0.747  -5.819
   59    HD3  LYS   7          1HD       LYS   7  -1.560  -0.768  -4.498
   60    HE2  LYS   7          2HE       LYS   7  -1.125  -3.138  -4.914
   61    HE3  LYS   7          1HE       LYS   7  -2.314  -3.133  -6.208
   62    HZ1  LYS   7          1HZ       LYS   7  -0.220  -2.999  -7.154
   63    HZ2  LYS   7          2HZ       LYS   7   0.331  -1.784  -6.181
   64    HZ3  LYS   7          3HZ       LYS   7  -0.881  -1.471  -7.348
   65    H    CYS   8           H        CYS   8  -3.535  -0.455  -0.581
   66    HA   CYS   8           HA       CYS   8  -2.106  -2.735   0.043
   67    HB2  CYS   8          2HB       CYS   8  -2.797  -0.396   1.817
   68    HB3  CYS   8          1HB       CYS   8  -1.527  -1.561   2.153
   69    H    LYS   9           H        LYS   9  -4.957  -1.441   1.722
   70    HA   LYS   9           HA       LYS   9  -4.997  -3.479   3.675
   71    HB2  LYS   9          2HB       LYS   9  -5.924  -1.262   4.053
   72    HB3  LYS   9          1HB       LYS   9  -7.117  -1.538   2.797
   73    HG2  LYS   9          2HG       LYS   9  -8.185  -3.240   4.125
   74    HG3  LYS   9          1HG       LYS   9  -6.930  -3.112   5.355
   75    HD2  LYS   9          2HD       LYS   9  -8.944  -1.908   6.022
   76    HD3  LYS   9          1HD       LYS   9  -7.591  -0.802   5.801
   77    HE2  LYS   9          2HE       LYS   9  -8.431  -0.153   3.628
   78    HE3  LYS   9          1HE       LYS   9  -9.734  -1.331   3.740
   79    HZ1  LYS   9          1HZ       LYS   9 -10.477   0.881   4.242
   80    HZ2  LYS   9          2HZ       LYS   9  -9.364   1.048   5.484
   81    HZ3  LYS   9          3HZ       LYS   9 -10.625  -0.074   5.617
   82    H    GLU  10           H        GLU  10  -6.539  -3.165   0.532
   83    HA   GLU  10           HA       GLU  10  -8.249  -5.422   1.007
   84    HB2  GLU  10          2HB       GLU  10  -9.077  -3.594  -0.332
   85    HB3  GLU  10          1HB       GLU  10  -7.734  -3.750  -1.448
   86    HG2  GLU  10          2HG       GLU  10  -8.560  -5.756  -2.314
   87    HG3  GLU  10          1HG       GLU  10  -9.740  -5.935  -1.021
   88    H    LEU  11           H        LEU  11  -5.269  -4.787  -0.724
   89    HA   LEU  11           HA       LEU  11  -5.093  -7.311  -2.010
   90    HB2  LEU  11          2HB       LEU  11  -3.922  -5.265  -2.777
   91    HB3  LEU  11          1HB       LEU  11  -2.957  -5.298  -1.325
   92    HG   LEU  11           HG       LEU  11  -1.967  -7.401  -2.022
   93   HD11  LEU  11          1HD1      LEU  11  -3.575  -6.990  -4.542
   94   HD12  LEU  11          2HD1      LEU  11  -3.735  -8.322  -3.392
   95   HD13  LEU  11          3HD1      LEU  11  -2.269  -8.157  -4.358
   96   HD21  LEU  11          1HD2      LEU  11  -0.594  -6.482  -3.848
   97   HD22  LEU  11          2HD2      LEU  11  -0.850  -5.314  -2.552
   98   HD23  LEU  11          3HD2      LEU  11  -1.768  -5.182  -4.053
   99    H    DAS  12           H        DAS  12  -3.520  -5.897   0.835
  100    HA   DAS  12           HA       DAS  12  -3.117  -8.602   1.875
  101    HB2  DAS  12          1HB       DAS  12  -4.766  -7.398   3.166
  102    HB3  DAS  12          2HB       DAS  12  -3.713  -5.995   3.278
  103    H    THR  13           H        THR  13  -1.027  -9.136   2.231
  104    HA   THR  13           HA       THR  13   0.827  -6.995   2.920
  105    HB   THR  13           HB       THR  13   1.329  -9.968   3.155
  106    HG1  THR  13          1HG       THR  13  -0.427  -8.370   4.514
  107   HG21  THR  13          1HG2      THR  13   3.274  -8.440   3.404
  108   HG22  THR  13          2HG2      THR  13   2.892  -9.265   4.914
  109   HG23  THR  13          3HG2      THR  13   2.417  -7.583   4.684
  110    H    ARG  14           H        ARG  14  -0.128  -8.557   0.212
  111    HA   ARG  14           HA       ARG  14   2.319  -9.136  -1.107
  112    HB2  ARG  14          2HB       ARG  14  -0.361  -8.324  -2.266
  113    HB3  ARG  14          1HB       ARG  14   0.992  -8.849  -3.230
  114    HG2  ARG  14          2HG       ARG  14  -0.337 -10.569  -1.145
  115    HG3  ARG  14          1HG       ARG  14  -0.789 -10.566  -2.846
  116    HD2  ARG  14          2HD       ARG  14   0.665 -12.406  -2.544
  117    HD3  ARG  14          1HD       ARG  14   1.615 -11.166  -3.350
  118    HE   ARG  14           HE       ARG  14   1.753 -11.577  -0.445
  119   HH11  ARG  14          1HH1      ARG  14   3.415 -11.387  -3.595
  120   HH12  ARG  14          2HH1      ARG  14   4.955 -11.618  -2.946
  121   HH21  ARG  14          1HH2      ARG  14   3.888 -11.896   0.426
  122   HH22  ARG  14          2HH2      ARG  14   5.253 -11.887  -0.583
  123    HA   DPR  15           HA       DPR  15   2.948  -5.089  -3.285
  124    HB2  DPR  15          1HB       DPR  15   5.750  -6.010  -3.286
  125    HB3  DPR  15          2HB       DPR  15   4.746  -5.482  -4.640
  126    HG2  DPR  15          1HG       DPR  15   5.411  -8.053  -4.323
  127    HG3  DPR  15          2HG       DPR  15   3.813  -7.579  -4.931
  128    HD2  DPR  15          1HD       DPR  15   4.607  -8.439  -2.173
  129    HD3  DPR  15          2HD       DPR  15   3.205  -8.929  -3.140
  130    H    DGL  16           H        DGL  16   4.351  -6.562  -0.537
  131    HA   DGL  16           HA       DGL  16   6.154  -4.683   0.480
  132    HB2  DGL  16          1HB       DGL  16   5.679  -6.964   1.355
  133    HB3  DGL  16          2HB       DGL  16   4.177  -6.366   2.037
  134    HG2  DGL  16          1HG       DGL  16   5.777  -6.505   3.778
  135    HG3  DGL  16          2HG       DGL  16   5.493  -4.802   3.427
  136    H    DAL  17           H        DAL  17   2.681  -4.853   0.630
  137    HA   DAL  17           HA       DAL  17   2.269  -2.770   2.497
  138    HB1  DAL  17          1HB       DAL  17  -0.055  -2.949   1.882
  139    HB2  DAL  17          2HB       DAL  17   0.651  -4.558   2.065
  140    HB3  DAL  17          3HB       DAL  17   0.373  -3.894   0.458
  141    H    DGL  18           H        DGL  18   2.207  -2.931  -1.054
  142    HA   DGL  18           HA       DGL  18   1.303  -0.248  -1.275
  143    HB2  DGL  18          1HB       DGL  18   1.597  -0.439  -3.660
  144    HB3  DGL  18          2HB       DGL  18   0.866  -1.913  -3.057
  145    HG2  DGL  18          1HG       DGL  18   3.102  -2.976  -3.110
  146    HG3  DGL  18          2HG       DGL  18   3.713  -1.521  -3.893
  147    H    DAR  19           H        DAR  19   4.394  -1.728  -0.987
  148    HA   DAR  19           HA       DAR  19   6.003   0.520  -1.761
  149    HB2  DAR  19          1HB       DAR  19   6.725  -1.377   0.474
  150    HB3  DAR  19          2HB       DAR  19   7.817  -0.470  -0.547
  151    HG2  DAR  19          1HG       DAR  19   6.202  -2.853  -1.338
  152    HG3  DAR  19          2HG       DAR  19   7.940  -2.776  -1.091
  153    HD2  DAR  19          1HD       DAR  19   8.147  -1.239  -2.974
  154    HD3  DAR  19          2HD       DAR  19   6.402  -1.354  -3.241
  155    HE   DAR  19           HE       DAR  19   7.925  -3.811  -3.153
  156   HH11  DAR  19          1HH2      DAR  19   7.812  -5.192  -5.007
  157   HH12  DAR  19          2HH2      DAR  19   7.102  -4.629  -6.450
  158   HH21  DAR  19          1HH1      DAR  19   6.372  -1.393  -5.239
  159   HH22  DAR  19          2HH1      DAR  19   6.270  -2.422  -6.583
  160    H    DLY  20           H        DLY  20   4.817  -0.748   1.297
  161    HA   DLY  20           HA       DLY  20   5.691   1.146   3.090
  162    HB2  DLY  20          1HB       DLY  20   4.566  -0.994   3.677
  163    HB3  DLY  20          2HB       DLY  20   3.049  -0.325   3.115
  164    HG2  DLY  20          1HG       DLY  20   3.157   1.388   4.850
  165    HG3  DLY  20          2HG       DLY  20   4.661   0.671   5.440
  166    HD2  DLY  20          1HD       DLY  20   3.479  -1.433   5.856
  167    HD3  DLY  20          2HD       DLY  20   1.974  -0.673   5.333
  168    HE2  DLY  20          1HE       DLY  20   3.690   0.237   7.635
  169    HE3  DLY  20          2HE       DLY  20   2.206  -0.699   7.783
  170    HZ1  DLY  20          1HZ       DLY  20   1.866   1.684   8.169
  171    HZ2  DLY  20          2HZ       DLY  20   0.949   1.110   6.906
  172    HZ3  DLY  20          3HZ       DLY  20   2.293   2.050   6.578
  173    H    DCY  21           H        DCY  21   2.596   1.069   1.386
  174    HA   DCY  21           HA       DCY  21   1.612   3.485   2.390
  175    HB2  DCY  21          1HB       DCY  21   0.945   2.035  -0.159
  176    HB3  DCY  21          2HB       DCY  21   0.011   3.383   0.498
  177    H    DAR  22           H        DAR  22   3.448   2.827  -0.589
  178    HA   DAR  22           HA       DAR  22   3.243   5.515  -1.510
  179    HB2  DAR  22          1HB       DAR  22   5.063   3.252  -2.301
  180    HB3  DAR  22          2HB       DAR  22   5.120   4.840  -3.050
  181    HG2  DAR  22          1HG       DAR  22   2.855   4.602  -3.839
  182    HG3  DAR  22          2HG       DAR  22   2.701   3.058  -3.003
  183    HD2  DAR  22          1HD       DAR  22   4.459   2.111  -4.393
  184    HD3  DAR  22          2HD       DAR  22   4.649   3.652  -5.232
  185    HE   DAR  22           HE       DAR  22   2.250   3.343  -5.858
  186   HH11  DAR  22          1HH1      DAR  22   4.477   0.607  -5.473
  187   HH12  DAR  22          2HH1      DAR  22   3.521  -0.481  -6.385
  188   HH21  DAR  22          1HH2      DAR  22   1.012   1.860  -7.214
  189   HH22  DAR  22          2HH2      DAR  22   1.554   0.264  -7.434
  190    H    DGL  23           H        DGL  23   5.320   3.909   0.701
  191    HA   DGL  23           HA       DGL  23   7.424   5.817   0.581
  192    HB2  DGL  23          1HB       DGL  23   7.744   3.481   1.341
  193    HB3  DGL  23          2HB       DGL  23   6.745   3.822   2.746
  194    HG2  DGL  23          1HG       DGL  23   8.395   5.577   3.396
  195    HG3  DGL  23          2HG       DGL  23   9.417   5.007   2.081
  196    H    DGL  24           H        DGL  24   4.666   5.249   2.751
  197    HA   DGL  24           HA       DGL  24   5.389   7.540   4.339
  198    HB2  DGL  24          1HB       DGL  24   3.429   7.022   5.718
  199    HB3  DGL  24          2HB       DGL  24   4.454   5.633   5.491
  200    HG2  DGL  24          1HG       DGL  24   2.882   4.819   3.736
  201    HG3  DGL  24          2HG       DGL  24   1.802   6.146   4.169
  202    H    SER  25           H        SER  25   2.846   6.783   2.022
  203    HA   SER  25           HA       SER  25   2.197   9.617   2.000
  204    HB2  SER  25          2HB       SER  25   2.136   7.588  -0.237
  205    HB3  SER  25          1HB       SER  25   1.688   9.290  -0.381
  206    HG   SER  25           HG       SER  25   4.115   8.832   0.770
  207    H    ASP  26           H        ASP  26   0.267   9.949   2.870
  208    HA   ASP  26           HA       ASP  26  -1.567   7.766   3.242
  209    HB2  ASP  26          2HB       ASP  26  -1.856  10.687   4.000
  210    HB3  ASP  26          1HB       ASP  26  -3.038   9.448   4.377
  Start of MODEL   14
    1    H    ASN   1           H        ASN   1  -1.605   8.091   0.681
    2    HA   ASN   1           HA       ASN   1  -3.948   9.605  -0.055
    3    HB2  ASN   1          2HB       ASN   1  -2.143   9.296  -1.689
    4    HB3  ASN   1          1HB       ASN   1  -2.326   7.551  -1.567
    5   HD21  ASN   1          1HD2      ASN   1  -3.594  10.466  -2.919
    6   HD22  ASN   1          2HD2      ASN   1  -4.762   9.696  -3.932
    7    HA   PRO   2           HA       PRO   2  -6.757   6.520   1.575
    8    HB2  PRO   2          2HB       PRO   2  -8.511   7.684  -0.535
    9    HB3  PRO   2          1HB       PRO   2  -8.860   7.381   1.172
   10    HG2  PRO   2          2HG       PRO   2  -8.340   9.843   0.350
   11    HG3  PRO   2          1HG       PRO   2  -7.675   9.248   1.881
   12    HD2  PRO   2          2HD       PRO   2  -6.313   9.652  -0.743
   13    HD3  PRO   2          1HD       PRO   2  -5.707   9.897   0.910
   14    H    GLU   3           H        GLU   3  -6.519   6.936  -1.948
   15    HA   GLU   3           HA       GLU   3  -7.733   4.440  -2.536
   16    HB2  GLU   3          2HB       GLU   3  -7.712   6.337  -4.114
   17    HB3  GLU   3          1HB       GLU   3  -5.972   6.147  -4.281
   18    HG2  GLU   3          2HG       GLU   3  -6.295   3.914  -5.196
   19    HG3  GLU   3          1HG       GLU   3  -8.040   4.104  -5.036
   20    H    LEU   4           H        LEU   4  -4.381   5.589  -2.419
   21    HA   LEU   4           HA       LEU   4  -3.181   3.169  -3.165
   22    HB2  LEU   4          2HB       LEU   4  -2.076   5.337  -1.383
   23    HB3  LEU   4          1HB       LEU   4  -1.146   4.077  -2.151
   24    HG   LEU   4           HG       LEU   4  -2.553   6.372  -3.507
   25   HD11  LEU   4          1HD1      LEU   4   0.364   5.670  -3.276
   26   HD12  LEU   4          2HD1      LEU   4  -0.464   6.976  -2.429
   27   HD13  LEU   4          3HD1      LEU   4  -0.304   7.025  -4.184
   28   HD21  LEU   4          1HD2      LEU   4  -2.754   4.380  -4.895
   29   HD22  LEU   4          2HD2      LEU   4  -1.019   4.094  -4.751
   30   HD23  LEU   4          3HD2      LEU   4  -1.610   5.521  -5.601
   31    H    GLN   5           H        GLN   5  -4.254   4.422  -0.090
   32    HA   GLN   5           HA       GLN   5  -3.084   2.377   1.476
   33    HB2  GLN   5          2HB       GLN   5  -5.297   4.319   2.086
   34    HB3  GLN   5          1HB       GLN   5  -4.626   3.208   3.278
   35    HG2  GLN   5          2HG       GLN   5  -2.426   4.216   2.982
   36    HG3  GLN   5          1HG       GLN   5  -3.084   5.302   1.770
   37   HE21  GLN   5          1HE2      GLN   5  -5.583   5.765   3.284
   38   HE22  GLN   5          2HE2      GLN   5  -5.115   6.803   4.564
   39    H    ARG   6           H        ARG   6  -6.395   2.769   0.192
   40    HA   ARG   6           HA       ARG   6  -7.238   0.305   1.339
   41    HB2  ARG   6          2HB       ARG   6  -9.222   0.407  -0.114
   42    HB3  ARG   6          1HB       ARG   6  -8.936   1.940   0.686
   43    HG2  ARG   6          2HG       ARG   6  -8.084   2.894  -1.320
   44    HG3  ARG   6          1HG       ARG   6  -8.147   1.336  -2.149
   45    HD2  ARG   6          2HD       ARG   6 -10.536   2.801  -1.036
   46    HD3  ARG   6          1HD       ARG   6 -10.046   2.829  -2.732
   47    HE   ARG   6           HE       ARG   6 -10.308   0.165  -1.947
   48   HH11  ARG   6          1HH1      ARG   6 -12.459   2.961  -2.340
   49   HH12  ARG   6          2HH1      ARG   6 -13.798   2.046  -2.839
   50   HH21  ARG   6          1HH2      ARG   6 -12.161  -1.106  -2.616
   51   HH22  ARG   6          2HH2      ARG   6 -13.622  -0.327  -2.989
   52    H    LYS   7           H        LYS   7  -5.571   1.121  -1.540
   53    HA   LYS   7           HA       LYS   7  -5.858  -1.211  -3.058
   54    HB2  LYS   7          2HB       LYS   7  -4.707   0.994  -3.658
   55    HB3  LYS   7          1HB       LYS   7  -3.329   0.416  -2.747
   56    HG2  LYS   7          2HG       LYS   7  -2.915   0.037  -5.057
   57    HG3  LYS   7          1HG       LYS   7  -3.212  -1.529  -4.297
   58    HD2  LYS   7          2HD       LYS   7  -5.448  -1.592  -5.134
   59    HD3  LYS   7          1HD       LYS   7  -5.333   0.067  -5.717
   60    HE2  LYS   7          2HE       LYS   7  -3.622  -0.614  -7.310
   61    HE3  LYS   7          1HE       LYS   7  -3.718  -2.273  -6.720
   62    HZ1  LYS   7          1HZ       LYS   7  -6.038  -2.314  -7.441
   63    HZ2  LYS   7          2HZ       LYS   7  -5.011  -1.995  -8.731
   64    HZ3  LYS   7          3HZ       LYS   7  -5.900  -0.746  -8.038
   65    H    CYS   8           H        CYS   8  -3.526  -0.306  -0.550
   66    HA   CYS   8           HA       CYS   8  -2.114  -2.750  -0.492
   67    HB2  CYS   8          2HB       CYS   8  -2.425  -0.706   1.692
   68    HB3  CYS   8          1HB       CYS   8  -1.176  -1.945   1.595
   69    H    LYS   9           H        LYS   9  -5.031  -1.641   1.074
   70    HA   LYS   9           HA       LYS   9  -5.058  -3.743   3.003
   71    HB2  LYS   9          2HB       LYS   9  -6.198  -1.586   3.379
   72    HB3  LYS   9          1HB       LYS   9  -7.322  -1.961   2.083
   73    HG2  LYS   9          2HG       LYS   9  -8.202  -3.843   3.334
   74    HG3  LYS   9          1HG       LYS   9  -7.000  -3.587   4.592
   75    HD2  LYS   9          2HD       LYS   9  -9.140  -1.606   3.827
   76    HD3  LYS   9          1HD       LYS   9  -9.235  -2.710   5.199
   77    HE2  LYS   9          2HE       LYS   9  -7.186  -1.694   6.118
   78    HE3  LYS   9          1HE       LYS   9  -7.172  -0.557   4.773
   79    HZ1  LYS   9          1HZ       LYS   9  -9.343  -0.784   6.770
   80    HZ2  LYS   9          2HZ       LYS   9  -9.254   0.362   5.544
   81    HZ3  LYS   9          3HZ       LYS   9  -8.121   0.359   6.791
   82    H    GLU  10           H        GLU  10  -6.257  -3.291  -0.228
   83    HA   GLU  10           HA       GLU  10  -7.876  -5.604  -0.319
   84    HB2  GLU  10          2HB       GLU  10  -8.061  -3.628  -1.831
   85    HB3  GLU  10          1HB       GLU  10  -6.528  -4.085  -2.557
   86    HG2  GLU  10          2HG       GLU  10  -8.393  -4.774  -3.924
   87    HG3  GLU  10          1HG       GLU  10  -7.488  -6.164  -3.312
   88    H    LEU  11           H        LEU  11  -4.544  -4.841  -1.165
   89    HA   LEU  11           HA       LEU  11  -3.858  -7.429  -2.131
   90    HB2  LEU  11          2HB       LEU  11  -2.200  -5.127  -1.150
   91    HB3  LEU  11          1HB       LEU  11  -1.491  -6.603  -1.761
   92    HG   LEU  11           HG       LEU  11  -3.267  -4.749  -3.349
   93   HD11  LEU  11          1HD1      LEU  11  -1.104  -3.738  -2.821
   94   HD12  LEU  11          2HD1      LEU  11  -1.213  -4.158  -4.529
   95   HD13  LEU  11          3HD1      LEU  11  -0.279  -5.174  -3.429
   96   HD21  LEU  11          1HD2      LEU  11  -2.469  -6.124  -5.253
   97   HD22  LEU  11          2HD2      LEU  11  -3.458  -7.028  -4.117
   98   HD23  LEU  11          3HD2      LEU  11  -1.705  -7.217  -4.101
   99    H    DAS  12           H        DAS  12  -3.622  -5.875   0.997
  100    HA   DAS  12           HA       DAS  12  -3.132  -8.483   2.195
  101    HB2  DAS  12          1HB       DAS  12  -5.029  -7.280   3.128
  102    HB3  DAS  12          2HB       DAS  12  -4.016  -5.870   3.432
  103    H    THR  13           H        THR  13  -1.066  -8.907   2.448
  104    HA   THR  13           HA       THR  13   0.659  -6.723   3.320
  105    HB   THR  13           HB       THR  13   0.537  -8.745   4.797
  106    HG1  THR  13          1HG       THR  13   2.379  -7.470   4.763
  107   HG21  THR  13          1HG2      THR  13   0.249 -10.471   3.112
  108   HG22  THR  13          2HG2      THR  13   1.680 -10.820   4.082
  109   HG23  THR  13          3HG2      THR  13   1.854 -10.140   2.463
  110    H    ARG  14           H        ARG  14  -0.260  -8.379   0.663
  111    HA   ARG  14           HA       ARG  14   2.132  -8.922  -0.722
  112    HB2  ARG  14          2HB       ARG  14  -0.686  -8.475  -1.710
  113    HB3  ARG  14          1HB       ARG  14   0.639  -8.975  -2.753
  114    HG2  ARG  14          2HG       ARG  14   0.925 -10.993  -1.448
  115    HG3  ARG  14          1HG       ARG  14  -0.344 -10.476  -0.344
  116    HD2  ARG  14          2HD       ARG  14  -1.970 -10.571  -2.148
  117    HD3  ARG  14          1HD       ARG  14  -0.706 -11.039  -3.287
  118    HE   ARG  14           HE       ARG  14  -0.462 -12.910  -1.429
  119   HH11  ARG  14          1HH1      ARG  14  -3.306 -11.756  -3.188
  120   HH12  ARG  14          2HH1      ARG  14  -4.169 -13.208  -3.047
  121   HH21  ARG  14          1HH2      ARG  14  -1.656 -14.943  -1.243
  122   HH22  ARG  14          2HH2      ARG  14  -3.211 -15.063  -1.918
  123    HA   DPR  15           HA       DPR  15   2.446  -5.023  -3.059
  124    HB2  DPR  15          1HB       DPR  15   4.904  -5.431  -4.060
  125    HB3  DPR  15          2HB       DPR  15   3.473  -6.176  -4.791
  126    HG2  DPR  15          1HG       DPR  15   5.518  -7.372  -2.972
  127    HG3  DPR  15          2HG       DPR  15   4.741  -8.072  -4.402
  128    HD2  DPR  15          1HD       DPR  15   3.987  -8.591  -1.803
  129    HD3  DPR  15          2HD       DPR  15   2.916  -8.765  -3.208
  130    H    DGL  16           H        DGL  16   4.083  -6.533  -0.513
  131    HA   DGL  16           HA       DGL  16   6.120  -4.595  -0.055
  132    HB2  DGL  16          1HB       DGL  16   6.054  -7.017   0.752
  133    HB3  DGL  16          2HB       DGL  16   4.921  -6.467   1.979
  134    HG2  DGL  16          1HG       DGL  16   7.187  -6.612   2.844
  135    HG3  DGL  16          2HG       DGL  16   6.585  -4.952   2.865
  136    H    DAL  17           H        DAL  17   2.852  -5.155   1.079
  137    HA   DAL  17           HA       DAL  17   2.740  -2.986   2.895
  138    HB1  DAL  17          1HB       DAL  17   0.505  -4.285   1.342
  139    HB2  DAL  17          2HB       DAL  17   0.312  -3.207   2.726
  140    HB3  DAL  17          3HB       DAL  17   1.092  -4.774   2.932
  141    H    DGL  18           H        DGL  18   2.121  -3.342  -0.536
  142    HA   DGL  18           HA       DGL  18   1.099  -0.786  -1.058
  143    HB2  DGL  18          1HB       DGL  18   1.003  -2.606  -2.714
  144    HB3  DGL  18          2HB       DGL  18   2.753  -2.558  -2.874
  145    HG2  DGL  18          1HG       DGL  18   2.597  -0.266  -3.736
  146    HG3  DGL  18          2HG       DGL  18   0.841  -0.358  -3.610
  147    H    DAR  19           H        DAR  19   4.384  -2.030  -1.074
  148    HA   DAR  19           HA       DAR  19   5.764   0.293  -1.759
  149    HB2  DAR  19          1HB       DAR  19   6.643  -1.944   0.079
  150    HB3  DAR  19          2HB       DAR  19   7.715  -0.723  -0.593
  151    HG2  DAR  19          1HG       DAR  19   7.291  -1.507  -2.820
  152    HG3  DAR  19          2HG       DAR  19   6.116  -2.674  -2.215
  153    HD2  DAR  19          1HD       DAR  19   7.907  -3.760  -0.910
  154    HD3  DAR  19          2HD       DAR  19   9.062  -2.625  -1.610
  155    HE   DAR  19           HE       DAR  19   7.966  -3.647  -3.788
  156   HH11  DAR  19          1HH2      DAR  19   8.622  -5.498  -4.941
  157   HH12  DAR  19          2HH2      DAR  19   9.348  -6.828  -4.159
  158   HH21  DAR  19          1HH1      DAR  19   9.129  -5.406  -0.889
  159   HH22  DAR  19          2HH1      DAR  19   9.631  -6.740  -1.788
  160    H    DLY  20           H        DLY  20   4.793  -0.921   1.413
  161    HA   DLY  20           HA       DLY  20   5.846   1.113   2.998
  162    HB2  DLY  20          1HB       DLY  20   4.800  -0.968   3.892
  163    HB3  DLY  20          2HB       DLY  20   3.222  -0.341   3.442
  164    HG2  DLY  20          1HG       DLY  20   3.475   0.052   5.762
  165    HG3  DLY  20          2HG       DLY  20   3.680   1.612   4.962
  166    HD2  DLY  20          1HD       DLY  20   6.171   1.183   5.030
  167    HD3  DLY  20          2HD       DLY  20   5.822  -0.176   6.095
  168    HE2  DLY  20          1HE       DLY  20   6.355   1.666   7.500
  169    HE3  DLY  20          2HE       DLY  20   4.609   1.442   7.583
  170    HZ1  DLY  20          1HZ       DLY  20   4.303   3.244   6.027
  171    HZ2  DLY  20          2HZ       DLY  20   6.008   3.418   5.896
  172    HZ3  DLY  20          3HZ       DLY  20   5.232   3.764   7.342
  173    H    DCY  21           H        DCY  21   2.685   0.899   1.390
  174    HA   DCY  21           HA       DCY  21   1.674   3.383   2.218
  175    HB2  DCY  21          1HB       DCY  21   1.112   1.877  -0.327
  176    HB3  DCY  21          2HB       DCY  21   0.141   3.208   0.294
  177    H    DAR  22           H        DAR  22   3.676   2.469  -0.523
  178    HA   DAR  22           HA       DAR  22   3.545   4.939  -1.874
  179    HB2  DAR  22          1HB       DAR  22   5.850   2.991  -1.858
  180    HB3  DAR  22          2HB       DAR  22   5.603   4.273  -3.024
  181    HG2  DAR  22          1HG       DAR  22   3.993   1.765  -2.691
  182    HG3  DAR  22          2HG       DAR  22   4.982   2.236  -4.066
  183    HD2  DAR  22          1HD       DAR  22   2.361   3.420  -3.187
  184    HD3  DAR  22          2HD       DAR  22   2.726   2.572  -4.687
  185    HE   DAR  22           HE       DAR  22   4.288   4.931  -4.359
  186   HH11  DAR  22          1HH1      DAR  22   1.271   3.636  -5.642
  187   HH12  DAR  22          2HH1      DAR  22   0.885   5.058  -6.507
  188   HH21  DAR  22          1HH2      DAR  22   3.706   6.888  -5.495
  189   HH22  DAR  22          2HH2      DAR  22   2.277   6.926  -6.413
  190    H    DGL  23           H        DGL  23   5.776   3.661   0.487
  191    HA   DGL  23           HA       DGL  23   7.617   5.701   0.728
  192    HB2  DGL  23          1HB       DGL  23   7.906   3.562   1.794
  193    HB3  DGL  23          2HB       DGL  23   6.463   3.794   2.763
  194    HG2  DGL  23          1HG       DGL  23   7.583   5.667   3.915
  195    HG3  DGL  23          2HG       DGL  23   9.056   5.286   3.026
  196    H    DGL  24           H        DGL  24   4.691   5.216   2.680
  197    HA   DGL  24           HA       DGL  24   5.110   7.735   3.997
  198    HB2  DGL  24          1HB       DGL  24   3.122   7.151   5.318
  199    HB3  DGL  24          2HB       DGL  24   4.352   5.899   5.332
  200    HG2  DGL  24          1HG       DGL  24   3.066   4.666   3.625
  201    HG3  DGL  24          2HG       DGL  24   1.796   5.884   3.754
  202    H    SER  25           H        SER  25   2.892   6.556   1.534
  203    HA   SER  25           HA       SER  25   2.000   9.284   1.267
  204    HB2  SER  25          2HB       SER  25   1.731   6.913  -0.598
  205    HB3  SER  25          1HB       SER  25   1.110   8.530  -0.939
  206    HG   SER  25           HG       SER  25   3.818   7.714  -0.639
  207    H    ASP  26           H        ASP  26   0.340   9.736   2.434
  208    HA   ASP  26           HA       ASP  26  -1.517   7.789   3.467
  209    HB2  ASP  26          2HB       ASP  26  -2.476   9.768   4.657
  210    HB3  ASP  26          1HB       ASP  26  -0.757   9.538   4.942
  Start of MODEL   15
    1    H    ASN   1           H        ASN   1  -1.326   8.623   0.796
    2    HA   ASN   1           HA       ASN   1  -3.843   9.535   0.072
    3    HB2  ASN   1          2HB       ASN   1  -2.212   7.426  -1.364
    4    HB3  ASN   1          1HB       ASN   1  -3.578   8.280  -2.058
    5   HD21  ASN   1          1HD2      ASN   1  -2.649  10.838  -0.695
    6   HD22  ASN   1          2HD2      ASN   1  -1.333  11.355  -1.662
    7    HA   PRO   2           HA       PRO   2  -6.388   6.559   2.096
    8    HB2  PRO   2          2HB       PRO   2  -8.741   7.308   0.812
    9    HB3  PRO   2          1HB       PRO   2  -8.096   8.035   2.285
   10    HG2  PRO   2          2HG       PRO   2  -7.898   8.968  -0.538
   11    HG3  PRO   2          1HG       PRO   2  -8.098   9.913   0.945
   12    HD2  PRO   2          2HD       PRO   2  -5.758   9.754  -0.322
   13    HD3  PRO   2          1HD       PRO   2  -5.842   9.832   1.451
   14    H    GLU   3           H        GLU   3  -6.854   6.960  -1.426
   15    HA   GLU   3           HA       GLU   3  -8.058   4.384  -1.629
   16    HB2  GLU   3          2HB       GLU   3  -8.569   6.262  -3.184
   17    HB3  GLU   3          1HB       GLU   3  -6.951   6.105  -3.851
   18    HG2  GLU   3          2HG       GLU   3  -8.670   5.034  -5.239
   19    HG3  GLU   3          1HG       GLU   3  -7.446   3.901  -4.670
   20    H    LEU   4           H        LEU   4  -4.839   5.605  -1.855
   21    HA   LEU   4           HA       LEU   4  -3.755   3.277  -3.069
   22    HB2  LEU   4          2HB       LEU   4  -2.608   5.498  -3.045
   23    HB3  LEU   4          1HB       LEU   4  -2.371   5.320  -1.324
   24    HG   LEU   4           HG       LEU   4  -0.916   3.357  -1.743
   25   HD11  LEU   4          1HD1      LEU   4  -1.863   2.605  -3.847
   26   HD12  LEU   4          2HD1      LEU   4  -0.134   2.901  -4.011
   27   HD13  LEU   4          3HD1      LEU   4  -1.291   4.070  -4.644
   28   HD21  LEU   4          1HD2      LEU   4   0.084   5.566  -1.494
   29   HD22  LEU   4          2HD2      LEU   4  -0.136   5.870  -3.214
   30   HD23  LEU   4          3HD2      LEU   4   0.974   4.609  -2.680
   31    H    GLN   5           H        GLN   5  -4.307   4.329   0.251
   32    HA   GLN   5           HA       GLN   5  -3.186   2.013   1.433
   33    HB2  GLN   5          2HB       GLN   5  -5.265   3.919   2.524
   34    HB3  GLN   5          1HB       GLN   5  -4.565   2.608   3.462
   35    HG2  GLN   5          2HG       GLN   5  -2.313   3.647   3.025
   36    HG3  GLN   5          1HG       GLN   5  -3.185   5.026   2.352
   37   HE21  GLN   5          1HE2      GLN   5  -4.280   6.418   3.739
   38   HE22  GLN   5          2HE2      GLN   5  -4.098   6.308   5.454
   39    H    ARG   6           H        ARG   6  -6.361   2.733   0.170
   40    HA   ARG   6           HA       ARG   6  -7.690   0.386   0.996
   41    HB2  ARG   6          2HB       ARG   6  -8.075   2.096  -1.456
   42    HB3  ARG   6          1HB       ARG   6  -9.105   0.730  -1.090
   43    HG2  ARG   6          2HG       ARG   6  -8.761   3.201   0.596
   44    HG3  ARG   6          1HG       ARG   6 -10.133   2.819  -0.449
   45    HD2  ARG   6          2HD       ARG   6 -10.510   0.774   0.922
   46    HD3  ARG   6          1HD       ARG   6  -9.258   1.343   2.021
   47    HE   ARG   6           HE       ARG   6 -11.492   3.108   1.464
   48   HH11  ARG   6          1HH1      ARG   6  -9.808   1.025   3.765
   49   HH12  ARG   6          2HH1      ARG   6 -10.820   1.385   5.076
   50   HH21  ARG   6          1HH2      ARG   6 -12.907   3.633   3.279
   51   HH22  ARG   6          2HH2      ARG   6 -12.642   2.883   4.779
   52    H    LYS   7           H        LYS   7  -5.743   1.112  -1.823
   53    HA   LYS   7           HA       LYS   7  -5.886  -1.263  -3.255
   54    HB2  LYS   7          2HB       LYS   7  -4.748   0.787  -4.019
   55    HB3  LYS   7          1HB       LYS   7  -3.502   0.536  -2.812
   56    HG2  LYS   7          2HG       LYS   7  -2.971  -1.629  -3.954
   57    HG3  LYS   7          1HG       LYS   7  -4.069  -1.125  -5.242
   58    HD2  LYS   7          2HD       LYS   7  -2.735   0.933  -5.524
   59    HD3  LYS   7          1HD       LYS   7  -1.617   0.343  -4.299
   60    HE2  LYS   7          2HE       LYS   7  -1.201  -1.648  -5.707
   61    HE3  LYS   7          1HE       LYS   7  -2.215  -0.927  -6.959
   62    HZ1  LYS   7          1HZ       LYS   7   0.304   0.132  -5.851
   63    HZ2  LYS   7          2HZ       LYS   7  -0.676   0.992  -6.933
   64    HZ3  LYS   7          3HZ       LYS   7   0.065  -0.450  -7.412
   65    H    CYS   8           H        CYS   8  -3.736  -0.327  -0.651
   66    HA   CYS   8           HA       CYS   8  -2.269  -2.698  -0.482
   67    HB2  CYS   8          2HB       CYS   8  -2.847  -0.586   1.573
   68    HB3  CYS   8          1HB       CYS   8  -1.591  -1.806   1.738
   69    H    LYS   9           H        LYS   9  -5.236  -1.654   1.110
   70    HA   LYS   9           HA       LYS   9  -5.379  -3.914   2.815
   71    HB2  LYS   9          2HB       LYS   9  -6.544  -1.794   3.314
   72    HB3  LYS   9          1HB       LYS   9  -7.582  -2.038   1.920
   73    HG2  LYS   9          2HG       LYS   9  -8.574  -3.981   2.942
   74    HG3  LYS   9          1HG       LYS   9  -7.448  -3.878   4.293
   75    HD2  LYS   9          2HD       LYS   9  -8.387  -1.759   4.965
   76    HD3  LYS   9          1HD       LYS   9  -9.458  -1.756   3.564
   77    HE2  LYS   9          2HE       LYS   9 -10.597  -3.726   4.395
   78    HE3  LYS   9          1HE       LYS   9  -9.468  -3.837   5.744
   79    HZ1  LYS   9          1HZ       LYS   9 -10.293  -1.746   6.565
   80    HZ2  LYS   9          2HZ       LYS   9 -11.561  -2.831   6.400
   81    HZ3  LYS   9          3HZ       LYS   9 -11.352  -1.595   5.266
   82    H    GLU  10           H        GLU  10  -6.357  -3.297  -0.454
   83    HA   GLU  10           HA       GLU  10  -7.843  -5.744  -0.713
   84    HB2  GLU  10          2HB       GLU  10  -6.721  -3.874  -2.808
   85    HB3  GLU  10          1HB       GLU  10  -7.736  -5.261  -3.165
   86    HG2  GLU  10          2HG       GLU  10  -9.562  -4.245  -1.903
   87    HG3  GLU  10          1HG       GLU  10  -8.520  -2.872  -1.528
   88    H    LEU  11           H        LEU  11  -4.589  -4.713  -1.051
   89    HA   LEU  11           HA       LEU  11  -3.686  -7.057  -2.474
   90    HB2  LEU  11          2HB       LEU  11  -2.759  -4.762  -2.810
   91    HB3  LEU  11          1HB       LEU  11  -2.131  -4.818  -1.183
   92    HG   LEU  11           HG       LEU  11  -0.567  -6.584  -1.817
   93   HD11  LEU  11          1HD1      LEU  11  -1.782  -6.304  -4.568
   94   HD12  LEU  11          2HD1      LEU  11  -1.919  -7.717  -3.516
   95   HD13  LEU  11          3HD1      LEU  11  -0.350  -7.248  -4.166
   96   HD21  LEU  11          1HD2      LEU  11  -0.564  -4.256  -3.733
   97   HD22  LEU  11          2HD2      LEU  11   0.825  -5.264  -3.320
   98   HD23  LEU  11          3HD2      LEU  11   0.080  -4.242  -2.092
   99    H    DAS  12           H        DAS  12  -4.156  -6.132   0.762
  100    HA   DAS  12           HA       DAS  12  -3.274  -8.746   1.660
  101    HB2  DAS  12          1HB       DAS  12  -5.432  -7.906   2.475
  102    HB3  DAS  12          2HB       DAS  12  -4.634  -6.507   3.183
  103    H    THR  13           H        THR  13  -1.192  -8.916   1.960
  104    HA   THR  13           HA       THR  13   0.220  -6.644   3.118
  105    HB   THR  13           HB       THR  13  -0.273  -8.332   4.905
  106    HG1  THR  13          1HG       THR  13   1.878  -7.069   4.522
  107   HG21  THR  13          1HG2      THR  13   0.930 -10.488   4.885
  108   HG22  THR  13          2HG2      THR  13   1.515 -10.134   3.259
  109   HG23  THR  13          3HG2      THR  13  -0.210 -10.367   3.542
  110    H    ARG  14           H        ARG  14  -0.166  -8.202   0.467
  111    HA   ARG  14           HA       ARG  14   2.428  -9.261  -0.060
  112    HB2  ARG  14          2HB       ARG  14  -0.081  -8.965  -1.659
  113    HB3  ARG  14          1HB       ARG  14   1.433  -9.230  -2.511
  114    HG2  ARG  14          2HG       ARG  14   0.281 -11.335  -2.161
  115    HG3  ARG  14          1HG       ARG  14   1.783 -11.292  -1.259
  116    HD2  ARG  14          2HD       ARG  14   0.082 -12.300   0.109
  117    HD3  ARG  14          1HD       ARG  14   0.503 -10.732   0.779
  118    HE   ARG  14           HE       ARG  14  -1.629 -10.155  -0.768
  119   HH11  ARG  14          1HH1      ARG  14  -1.150 -12.637   1.738
  120   HH12  ARG  14          2HH1      ARG  14  -2.782 -12.674   2.187
  121   HH21  ARG  14          1HH2      ARG  14  -3.863 -10.206  -0.105
  122   HH22  ARG  14          2HH2      ARG  14  -4.348 -11.256   1.125
  123    HA   DPR  15           HA       DPR  15   3.769  -5.876  -2.860
  124    HB2  DPR  15          1HB       DPR  15   6.438  -6.422  -2.591
  125    HB3  DPR  15          2HB       DPR  15   5.404  -7.184  -3.803
  126    HG2  DPR  15          1HG       DPR  15   6.321  -8.229  -1.162
  127    HG3  DPR  15          2HG       DPR  15   6.176  -9.068  -2.716
  128    HD2  DPR  15          1HD       DPR  15   4.350  -9.330  -0.748
  129    HD3  DPR  15          2HD       DPR  15   3.916  -9.408  -2.467
  130    H    DGL  16           H        DGL  16   4.532  -6.786   0.385
  131    HA   DGL  16           HA       DGL  16   6.124  -4.647   1.268
  132    HB2  DGL  16          1HB       DGL  16   5.528  -6.806   2.498
  133    HB3  DGL  16          2HB       DGL  16   3.982  -6.086   2.876
  134    HG2  DGL  16          1HG       DGL  16   6.635  -4.991   3.790
  135    HG3  DGL  16          2HG       DGL  16   5.601  -6.032   4.747
  136    H    DAL  17           H        DAL  17   2.644  -5.107   1.159
  137    HA   DAL  17           HA       DAL  17   1.719  -2.815   2.388
  138    HB1  DAL  17          1HB       DAL  17   0.509  -4.307   0.063
  139    HB2  DAL  17          2HB       DAL  17  -0.353  -3.184   1.106
  140    HB3  DAL  17          3HB       DAL  17   0.284  -4.689   1.770
  141    H    DGL  18           H        DGL  18   2.397  -3.341  -1.014
  142    HA   DGL  18           HA       DGL  18   1.695  -0.933  -2.180
  143    HB2  DGL  18          1HB       DGL  18   2.477  -2.975  -3.361
  144    HB3  DGL  18          2HB       DGL  18   4.109  -2.646  -2.813
  145    HG2  DGL  18          1HG       DGL  18   4.061  -1.895  -5.018
  146    HG3  DGL  18          2HG       DGL  18   3.921  -0.441  -4.029
  147    H    DAR  19           H        DAR  19   4.760  -1.844  -0.708
  148    HA   DAR  19           HA       DAR  19   6.031   0.675  -1.250
  149    HB2  DAR  19          1HB       DAR  19   6.920  -1.690   0.378
  150    HB3  DAR  19          2HB       DAR  19   7.817  -0.182   0.388
  151    HG2  DAR  19          1HG       DAR  19   8.854  -1.702  -1.155
  152    HG3  DAR  19          2HG       DAR  19   8.135  -0.366  -2.049
  153    HD2  DAR  19          1HD       DAR  19   6.220  -1.731  -2.607
  154    HD3  DAR  19          2HD       DAR  19   6.911  -3.085  -1.720
  155    HE   DAR  19           HE       DAR  19   8.770  -2.235  -3.605
  156   HH11  DAR  19          1HH2      DAR  19   9.062  -3.409  -5.631
  157   HH12  DAR  19          2HH2      DAR  19   7.821  -4.421  -6.186
  158   HH21  DAR  19          1HH1      DAR  19   5.606  -3.794  -3.507
  159   HH22  DAR  19          2HH1      DAR  19   5.803  -4.632  -4.982
  160    H    DLY  20           H        DLY  20   4.700  -0.871   1.600
  161    HA   DLY  20           HA       DLY  20   5.193   0.990   3.567
  162    HB2  DLY  20          1HB       DLY  20   4.172  -1.146   4.060
  163    HB3  DLY  20          2HB       DLY  20   2.784  -0.775   3.063
  164    HG2  DLY  20          1HG       DLY  20   2.123  -0.638   5.338
  165    HG3  DLY  20          2HG       DLY  20   2.118   0.979   4.656
  166    HD2  DLY  20          1HD       DLY  20   3.041   1.283   6.756
  167    HD3  DLY  20          2HD       DLY  20   4.433   1.265   5.687
  168    HE2  DLY  20          1HE       DLY  20   3.518  -1.169   7.206
  169    HE3  DLY  20          2HE       DLY  20   4.676  -0.025   7.861
  170    HZ1  DLY  20          1HZ       DLY  20   6.124  -0.500   5.957
  171    HZ2  DLY  20          2HZ       DLY  20   5.113  -1.781   5.473
  172    HZ3  DLY  20          3HZ       DLY  20   5.866  -1.790   6.963
  173    H    DCY  21           H        DCY  21   2.591   0.962   1.192
  174    HA   DCY  21           HA       DCY  21   1.424   3.359   2.177
  175    HB2  DCY  21          1HB       DCY  21   1.024   1.748  -0.310
  176    HB3  DCY  21          2HB       DCY  21   0.028   3.148   0.088
  177    H    DAR  22           H        DAR  22   3.234   2.607  -0.846
  178    HA   DAR  22           HA       DAR  22   2.946   5.238  -1.849
  179    HB2  DAR  22          1HB       DAR  22   4.305   4.599  -3.705
  180    HB3  DAR  22          2HB       DAR  22   3.298   3.221  -3.289
  181    HG2  DAR  22          1HG       DAR  22   5.128   2.164  -2.170
  182    HG3  DAR  22          2HG       DAR  22   6.171   3.551  -2.456
  183    HD2  DAR  22          1HD       DAR  22   5.823   3.149  -4.932
  184    HD3  DAR  22          2HD       DAR  22   5.084   1.608  -4.471
  185    HE   DAR  22           HE       DAR  22   7.651   2.151  -3.322
  186   HH11  DAR  22          1HH1      DAR  22   6.003   0.638  -6.107
  187   HH12  DAR  22          2HH1      DAR  22   7.305  -0.389  -6.490
  188   HH21  DAR  22          1HH2      DAR  22   9.433   0.689  -3.887
  189   HH22  DAR  22          2HH2      DAR  22   9.277  -0.364  -5.214
  190    H    DGL  23           H        DGL  23   5.543   3.802   0.089
  191    HA   DGL  23           HA       DGL  23   7.431   5.807  -0.629
  192    HB2  DGL  23          1HB       DGL  23   7.434   3.974   1.767
  193    HB3  DGL  23          2HB       DGL  23   8.787   4.962   1.245
  194    HG2  DGL  23          1HG       DGL  23   7.569   2.635  -0.218
  195    HG3  DGL  23          2HG       DGL  23   9.157   2.705   0.535
  196    H    DGL  24           H        DGL  24   5.032   5.540   1.846
  197    HA   DGL  24           HA       DGL  24   6.040   7.927   3.148
  198    HB2  DGL  24          1HB       DGL  24   3.781   6.073   3.858
  199    HB3  DGL  24          2HB       DGL  24   4.122   7.552   4.739
  200    HG2  DGL  24          1HG       DGL  24   6.360   6.697   5.277
  201    HG3  DGL  24          2HG       DGL  24   5.965   5.196   4.439
  202    H    SER  25           H        SER  25   2.879   6.870   1.921
  203    HA   SER  25           HA       SER  25   2.192   9.658   1.717
  204    HB2  SER  25          2HB       SER  25   1.007   9.068  -0.496
  205    HB3  SER  25          1HB       SER  25   2.759   9.242  -0.538
  206    HG   SER  25           HG       SER  25   2.053   6.682   0.027
  207    H    ASP  26           H        ASP  26   0.193  10.100   2.399
  208    HA   ASP  26           HA       ASP  26  -1.157   7.900   3.743
  209    HB2  ASP  26          2HB       ASP  26  -2.441   9.630   4.927
  210    HB3  ASP  26          1HB       ASP  26  -0.710   9.892   5.071
  Start of MODEL   16
    1    H    ASN   1           H        ASN   1  -1.529   8.844   0.303
    2    HA   ASN   1           HA       ASN   1  -4.137   9.687  -0.348
    3    HB2  ASN   1          2HB       ASN   1  -2.392   9.392  -2.066
    4    HB3  ASN   1          1HB       ASN   1  -2.460   7.646  -1.824
    5   HD21  ASN   1          1HD2      ASN   1  -4.025  10.406  -3.147
    6   HD22  ASN   1          2HD2      ASN   1  -5.246   9.557  -4.012
    7    HA   PRO   2           HA       PRO   2  -6.402   6.479   1.674
    8    HB2  PRO   2          2HB       PRO   2  -8.817   6.935   0.420
    9    HB3  PRO   2          1HB       PRO   2  -8.225   7.844   1.813
   10    HG2  PRO   2          2HG       PRO   2  -8.122   8.542  -1.089
   11    HG3  PRO   2          1HG       PRO   2  -8.477   9.584   0.300
   12    HD2  PRO   2          2HD       PRO   2  -6.095   9.597  -0.911
   13    HD3  PRO   2          1HD       PRO   2  -6.238   9.815   0.848
   14    H    GLU   3           H        GLU   3  -6.487   6.794  -1.849
   15    HA   GLU   3           HA       GLU   3  -7.674   4.225  -2.189
   16    HB2  GLU   3          2HB       GLU   3  -6.320   5.997  -4.219
   17    HB3  GLU   3          1HB       GLU   3  -7.214   4.530  -4.599
   18    HG2  GLU   3          2HG       GLU   3  -8.292   7.073  -3.416
   19    HG3  GLU   3          1HG       GLU   3  -8.642   6.390  -5.005
   20    H    LEU   4           H        LEU   4  -4.420   5.472  -2.227
   21    HA   LEU   4           HA       LEU   4  -3.191   3.039  -2.988
   22    HB2  LEU   4          2HB       LEU   4  -2.215   5.529  -1.650
   23    HB3  LEU   4          1HB       LEU   4  -1.197   4.114  -1.617
   24    HG   LEU   4           HG       LEU   4  -1.109   4.102  -4.078
   25   HD11  LEU   4          1HD1      LEU   4  -2.756   6.613  -3.926
   26   HD12  LEU   4          2HD1      LEU   4  -3.262   5.067  -4.607
   27   HD13  LEU   4          3HD1      LEU   4  -1.965   5.987  -5.370
   28   HD21  LEU   4          1HD2      LEU   4   0.244   6.107  -4.371
   29   HD22  LEU   4          2HD2      LEU   4   0.586   5.321  -2.827
   30   HD23  LEU   4          3HD2      LEU   4  -0.411   6.772  -2.877
   31    H    GLN   5           H        GLN   5  -4.097   4.425   0.103
   32    HA   GLN   5           HA       GLN   5  -3.060   2.356   1.711
   33    HB2  GLN   5          2HB       GLN   5  -5.451   4.146   2.195
   34    HB3  GLN   5          1HB       GLN   5  -4.696   3.143   3.426
   35    HG2  GLN   5          2HG       GLN   5  -2.623   4.412   3.215
   36    HG3  GLN   5          1HG       GLN   5  -3.337   5.385   1.935
   37   HE21  GLN   5          1HE2      GLN   5  -5.929   5.505   3.323
   38   HE22  GLN   5          2HE2      GLN   5  -5.722   6.633   4.598
   39    H    ARG   6           H        ARG   6  -6.229   2.760   0.170
   40    HA   ARG   6           HA       ARG   6  -7.443   0.375   1.043
   41    HB2  ARG   6          2HB       ARG   6  -7.814   1.835  -1.569
   42    HB3  ARG   6          1HB       ARG   6  -8.834   0.522  -1.017
   43    HG2  ARG   6          2HG       ARG   6  -9.481   1.888   0.921
   44    HG3  ARG   6          1HG       ARG   6  -8.514   3.215   0.270
   45    HD2  ARG   6          2HD       ARG   6 -10.866   3.454  -0.322
   46    HD3  ARG   6          1HD       ARG   6  -9.865   3.218  -1.760
   47    HE   ARG   6           HE       ARG   6 -11.129   0.905  -0.545
   48   HH11  ARG   6          1HH1      ARG   6 -11.045   3.186  -3.293
   49   HH12  ARG   6          2HH1      ARG   6 -12.130   2.275  -4.226
   50   HH21  ARG   6          1HH2      ARG   6 -12.583  -0.326  -1.901
   51   HH22  ARG   6          2HH2      ARG   6 -13.006   0.249  -3.443
   52    H    LYS   7           H        LYS   7  -5.331   1.049  -1.640
   53    HA   LYS   7           HA       LYS   7  -5.479  -1.339  -3.078
   54    HB2  LYS   7          2HB       LYS   7  -4.419   0.769  -3.822
   55    HB3  LYS   7          1HB       LYS   7  -3.127   0.507  -2.670
   56    HG2  LYS   7          2HG       LYS   7  -2.469  -1.509  -3.889
   57    HG3  LYS   7          1HG       LYS   7  -3.751  -1.204  -5.065
   58    HD2  LYS   7          2HD       LYS   7  -2.734   1.025  -5.505
   59    HD3  LYS   7          1HD       LYS   7  -1.399   0.582  -4.445
   60    HE2  LYS   7          2HE       LYS   7  -0.734   0.191  -6.718
   61    HE3  LYS   7          1HE       LYS   7  -0.954  -1.357  -5.910
   62    HZ1  LYS   7          1HZ       LYS   7  -2.923  -0.064  -7.710
   63    HZ2  LYS   7          2HZ       LYS   7  -3.124  -1.561  -6.960
   64    HZ3  LYS   7          3HZ       LYS   7  -1.929  -1.363  -8.115
   65    H    CYS   8           H        CYS   8  -3.377  -0.383  -0.424
   66    HA   CYS   8           HA       CYS   8  -1.885  -2.763  -0.269
   67    HB2  CYS   8          2HB       CYS   8  -2.540  -0.793   1.902
   68    HB3  CYS   8          1HB       CYS   8  -1.219  -1.962   1.910
   69    H    LYS   9           H        LYS   9  -4.937  -1.771   1.096
   70    HA   LYS   9           HA       LYS   9  -5.072  -4.062   2.812
   71    HB2  LYS   9          2HB       LYS   9  -7.083  -1.922   2.150
   72    HB3  LYS   9          1HB       LYS   9  -7.345  -3.194   3.342
   73    HG2  LYS   9          2HG       LYS   9  -5.379  -2.405   4.595
   74    HG3  LYS   9          1HG       LYS   9  -5.156  -1.134   3.405
   75    HD2  LYS   9          2HD       LYS   9  -7.248  -0.126   3.996
   76    HD3  LYS   9          1HD       LYS   9  -7.630  -1.476   5.069
   77    HE2  LYS   9          2HE       LYS   9  -5.264   0.359   5.423
   78    HE3  LYS   9          1HE       LYS   9  -6.800   0.548   6.262
   79    HZ1  LYS   9          1HZ       LYS   9  -5.181  -0.602   7.611
   80    HZ2  LYS   9          2HZ       LYS   9  -5.012  -1.829   6.480
   81    HZ3  LYS   9          3HZ       LYS   9  -6.476  -1.614   7.287
   82    H    GLU  10           H        GLU  10  -5.912  -3.305  -0.372
   83    HA   GLU  10           HA       GLU  10  -7.811  -5.368  -0.859
   84    HB2  GLU  10          2HB       GLU  10  -7.544  -3.302  -2.223
   85    HB3  GLU  10          1HB       GLU  10  -5.958  -3.857  -2.717
   86    HG2  GLU  10          2HG       GLU  10  -7.483  -4.252  -4.482
   87    HG3  GLU  10          1HG       GLU  10  -7.033  -5.805  -3.779
   88    H    LEU  11           H        LEU  11  -4.334  -4.928  -1.191
   89    HA   LEU  11           HA       LEU  11  -3.841  -7.580  -2.195
   90    HB2  LEU  11          2HB       LEU  11  -1.958  -5.463  -1.166
   91    HB3  LEU  11          1HB       LEU  11  -1.449  -6.952  -1.925
   92    HG   LEU  11           HG       LEU  11  -3.018  -4.745  -3.262
   93   HD11  LEU  11          1HD1      LEU  11  -0.958  -4.362  -4.523
   94   HD12  LEU  11          2HD1      LEU  11  -0.140  -5.589  -3.558
   95   HD13  LEU  11          3HD1      LEU  11  -0.719  -4.108  -2.794
   96   HD21  LEU  11          1HD2      LEU  11  -3.578  -6.928  -4.200
   97   HD22  LEU  11          2HD2      LEU  11  -1.866  -7.308  -4.373
   98   HD23  LEU  11          3HD2      LEU  11  -2.580  -6.015  -5.333
   99    H    DAS  12           H        DAS  12  -3.619  -5.972   0.924
  100    HA   DAS  12           HA       DAS  12  -3.326  -8.593   2.204
  101    HB2  DAS  12          1HB       DAS  12  -5.265  -7.277   2.933
  102    HB3  DAS  12          2HB       DAS  12  -4.214  -5.923   3.322
  103    H    THR  13           H        THR  13  -1.231  -9.041   2.439
  104    HA   THR  13           HA       THR  13   0.502  -6.896   3.448
  105    HB   THR  13           HB       THR  13   0.268  -8.855   5.003
  106    HG1  THR  13          1HG       THR  13   2.492  -7.678   4.294
  107   HG21  THR  13          1HG2      THR  13   1.332 -11.004   4.411
  108   HG22  THR  13          2HG2      THR  13   1.611 -10.400   2.778
  109   HG23  THR  13          3HG2      THR  13  -0.035 -10.641   3.358
  110    H    ARG  14           H        ARG  14  -0.334  -8.338   0.723
  111    HA   ARG  14           HA       ARG  14   2.206  -9.010  -0.425
  112    HB2  ARG  14          2HB       ARG  14  -0.536  -8.686  -1.676
  113    HB3  ARG  14          1HB       ARG  14   0.880  -9.290  -2.523
  114    HG2  ARG  14          2HG       ARG  14  -0.481 -10.574  -0.164
  115    HG3  ARG  14          1HG       ARG  14  -0.559 -11.119  -1.838
  116    HD2  ARG  14          2HD       ARG  14   1.878 -11.036  -0.068
  117    HD3  ARG  14          1HD       ARG  14   1.016 -12.474  -0.611
  118    HE   ARG  14           HE       ARG  14   1.694 -11.258  -2.906
  119   HH11  ARG  14          1HH1      ARG  14   3.527 -12.402  -0.118
  120   HH12  ARG  14          2HH1      ARG  14   4.987 -12.601  -0.975
  121   HH21  ARG  14          1HH2      ARG  14   3.722 -11.499  -4.097
  122   HH22  ARG  14          2HH2      ARG  14   5.095 -12.051  -3.277
  123    HA   DPR  15           HA       DPR  15   2.336  -5.174  -3.086
  124    HB2  DPR  15          1HB       DPR  15   4.818  -5.565  -4.089
  125    HB3  DPR  15          2HB       DPR  15   3.381  -6.291  -4.817
  126    HG2  DPR  15          1HG       DPR  15   5.373  -7.510  -2.937
  127    HG3  DPR  15          2HG       DPR  15   4.688  -8.186  -4.426
  128    HD2  DPR  15          1HD       DPR  15   3.760  -8.876  -1.987
  129    HD3  DPR  15          2HD       DPR  15   2.710  -8.755  -3.408
  130    H    DGL  16           H        DGL  16   4.311  -6.594  -0.638
  131    HA   DGL  16           HA       DGL  16   6.109  -4.448  -0.185
  132    HB2  DGL  16          1HB       DGL  16   6.367  -6.787   0.678
  133    HB3  DGL  16          2HB       DGL  16   5.084  -6.458   1.830
  134    HG2  DGL  16          1HG       DGL  16   7.233  -6.271   2.907
  135    HG3  DGL  16          2HG       DGL  16   6.448  -4.695   2.839
  136    H    DAL  17           H        DAL  17   2.862  -5.168   0.843
  137    HA   DAL  17           HA       DAL  17   2.589  -3.146   2.788
  138    HB1  DAL  17          1HB       DAL  17   0.458  -4.349   1.017
  139    HB2  DAL  17          2HB       DAL  17   0.185  -3.445   2.511
  140    HB3  DAL  17          3HB       DAL  17   0.999  -5.005   2.559
  141    H    DGL  18           H        DGL  18   1.911  -3.273  -0.688
  142    HA   DGL  18           HA       DGL  18   0.929  -0.678  -1.109
  143    HB2  DGL  18          1HB       DGL  18   0.985  -2.467  -2.872
  144    HB3  DGL  18          2HB       DGL  18   2.728  -2.262  -2.979
  145    HG2  DGL  18          1HG       DGL  18   2.075   0.246  -3.431
  146    HG3  DGL  18          2HG       DGL  18   0.542  -0.465  -3.917
  147    H    DAR  19           H        DAR  19   4.151  -1.975  -1.033
  148    HA   DAR  19           HA       DAR  19   5.619   0.225  -1.839
  149    HB2  DAR  19          1HB       DAR  19   6.329  -2.223  -1.498
  150    HB3  DAR  19          2HB       DAR  19   6.573  -1.793   0.188
  151    HG2  DAR  19          1HG       DAR  19   8.665  -1.721  -1.032
  152    HG3  DAR  19          2HG       DAR  19   8.207  -0.107  -0.476
  153    HD2  DAR  19          1HD       DAR  19   9.040  -0.154  -2.818
  154    HD3  DAR  19          2HD       DAR  19   7.410   0.486  -2.661
  155    HE   DAR  19           HE       DAR  19   8.095  -2.223  -3.592
  156   HH11  DAR  19          1HH2      DAR  19   6.566  -3.184  -5.112
  157   HH12  DAR  19          2HH2      DAR  19   5.233  -2.277  -5.651
  158   HH21  DAR  19          1HH1      DAR  19   5.965   0.651  -3.834
  159   HH22  DAR  19          2HH1      DAR  19   4.859  -0.158  -4.874
  160    H    DLY  20           H        DLY  20   4.784  -0.883   1.431
  161    HA   DLY  20           HA       DLY  20   6.032   1.204   2.821
  162    HB2  DLY  20          1HB       DLY  20   5.163  -0.922   3.837
  163    HB3  DLY  20          2HB       DLY  20   3.542  -0.261   3.684
  164    HG2  DLY  20          1HG       DLY  20   4.219   1.634   5.106
  165    HG3  DLY  20          2HG       DLY  20   5.798   0.878   5.313
  166    HD2  DLY  20          1HD       DLY  20   4.669  -1.108   6.272
  167    HD3  DLY  20          2HD       DLY  20   3.142  -0.225   6.184
  168    HE2  DLY  20          1HE       DLY  20   4.121   1.543   7.588
  169    HE3  DLY  20          2HE       DLY  20   5.598   0.593   7.724
  170    HZ1  DLY  20          1HZ       DLY  20   4.285  -1.177   8.747
  171    HZ2  DLY  20          2HZ       DLY  20   2.922  -0.180   8.741
  172    HZ3  DLY  20          3HZ       DLY  20   4.280   0.243   9.639
  173    H    DCY  21           H        DCY  21   2.705   0.877   1.634
  174    HA   DCY  21           HA       DCY  21   1.696   3.272   2.662
  175    HB2  DCY  21          1HB       DCY  21   0.965   1.927   0.080
  176    HB3  DCY  21          2HB       DCY  21   0.003   3.151   0.901
  177    H    DAR  22           H        DAR  22   3.174   2.625  -0.490
  178    HA   DAR  22           HA       DAR  22   2.897   5.285  -1.432
  179    HB2  DAR  22          1HB       DAR  22   4.683   3.031  -2.312
  180    HB3  DAR  22          2HB       DAR  22   4.571   4.566  -3.163
  181    HG2  DAR  22          1HG       DAR  22   2.259   4.185  -3.659
  182    HG3  DAR  22          2HG       DAR  22   2.236   2.737  -2.651
  183    HD2  DAR  22          1HD       DAR  22   2.370   2.152  -5.003
  184    HD3  DAR  22          2HD       DAR  22   3.824   1.657  -4.147
  185    HE   DAR  22           HE       DAR  22   4.303   4.168  -5.218
  186   HH11  DAR  22          1HH1      DAR  22   3.763   0.821  -6.385
  187   HH12  DAR  22          2HH1      DAR  22   4.608   1.082  -7.828
  188   HH21  DAR  22          1HH2      DAR  22   5.466   4.454  -7.195
  189   HH22  DAR  22          2HH2      DAR  22   5.565   3.181  -8.321
  190    H    DGL  23           H        DGL  23   5.310   3.680   0.452
  191    HA   DGL  23           HA       DGL  23   7.322   5.615   0.226
  192    HB2  DGL  23          1HB       DGL  23   7.706   3.351   1.062
  193    HB3  DGL  23          2HB       DGL  23   6.685   3.676   2.450
  194    HG2  DGL  23          1HG       DGL  23   8.234   5.314   3.259
  195    HG3  DGL  23          2HG       DGL  23   9.267   5.076   1.851
  196    H    DGL  24           H        DGL  24   4.696   5.188   2.575
  197    HA   DGL  24           HA       DGL  24   5.433   7.578   3.993
  198    HB2  DGL  24          1HB       DGL  24   2.921   5.932   4.233
  199    HB3  DGL  24          2HB       DGL  24   3.457   7.171   5.355
  200    HG2  DGL  24          1HG       DGL  24   5.482   5.805   5.798
  201    HG3  DGL  24          2HG       DGL  24   4.773   4.531   4.805
  202    H    SER  25           H        SER  25   2.797   6.669   1.824
  203    HA   SER  25           HA       SER  25   2.278   9.504   1.396
  204    HB2  SER  25          2HB       SER  25   0.950   8.786  -0.571
  205    HB3  SER  25          1HB       SER  25   2.566   8.095  -0.643
  206    HG   SER  25           HG       SER  25   1.590   6.192   0.342
  207    H    ASP  26           H        ASP  26  -0.056  10.149   1.319
  208    HA   ASP  26           HA       ASP  26  -1.498   8.750   3.476
  209    HB2  ASP  26          2HB       ASP  26  -2.535  10.892   4.042
  210    HB3  ASP  26          1HB       ASP  26  -0.781  11.018   4.100
  Start of MODEL   17
    1    H    ASN   1           H        ASN   1  -2.278   7.525   1.191
    2    HA   ASN   1           HA       ASN   1  -3.955   9.450  -0.259
    3    HB2  ASN   1          2HB       ASN   1  -2.076   7.339  -1.364
    4    HB3  ASN   1          1HB       ASN   1  -3.292   8.181  -2.312
    5   HD21  ASN   1          1HD2      ASN   1  -0.345   8.087  -2.527
    6   HD22  ASN   1          2HD2      ASN   1   0.171   9.727  -2.492
    7    HA   PRO   2           HA       PRO   2  -7.002   6.459   1.262
    8    HB2  PRO   2          2HB       PRO   2  -8.458   7.846  -0.953
    9    HB3  PRO   2          1HB       PRO   2  -9.034   7.404   0.659
   10    HG2  PRO   2          2HG       PRO   2  -8.307   9.889   0.177
   11    HG3  PRO   2          1HG       PRO   2  -7.835   9.109   1.697
   12    HD2  PRO   2          2HD       PRO   2  -6.185   9.736  -0.702
   13    HD3  PRO   2          1HD       PRO   2  -5.722   9.699   1.011
   14    H    GLU   3           H        GLU   3  -6.777   6.950  -2.273
   15    HA   GLU   3           HA       GLU   3  -7.926   4.405  -2.809
   16    HB2  GLU   3          2HB       GLU   3  -6.522   6.362  -4.627
   17    HB3  GLU   3          1HB       GLU   3  -7.087   4.807  -5.198
   18    HG2  GLU   3          2HG       GLU   3  -8.679   6.538  -5.766
   19    HG3  GLU   3          1HG       GLU   3  -9.386   5.422  -4.610
   20    H    LEU   4           H        LEU   4  -4.624   5.495  -2.507
   21    HA   LEU   4           HA       LEU   4  -3.451   3.078  -3.463
   22    HB2  LEU   4          2HB       LEU   4  -2.217   5.212  -3.368
   23    HB3  LEU   4          1HB       LEU   4  -2.360   5.212  -1.624
   24    HG   LEU   4           HG       LEU   4  -0.936   3.197  -1.529
   25   HD11  LEU   4          1HD1      LEU   4   0.318   2.512  -3.516
   26   HD12  LEU   4          2HD1      LEU   4  -0.635   3.625  -4.498
   27   HD13  LEU   4          3HD1      LEU   4  -1.414   2.250  -3.711
   28   HD21  LEU   4          1HD2      LEU   4   1.154   4.334  -2.091
   29   HD22  LEU   4          2HD2      LEU   4   0.031   5.420  -1.268
   30   HD23  LEU   4          3HD2      LEU   4   0.253   5.536  -3.014
   31    H    GLN   5           H        GLN   5  -4.214   4.407  -0.305
   32    HA   GLN   5           HA       GLN   5  -3.331   2.321   1.319
   33    HB2  GLN   5          2HB       GLN   5  -5.474   4.402   1.681
   34    HB3  GLN   5          1HB       GLN   5  -5.088   3.240   2.940
   35    HG2  GLN   5          2HG       GLN   5  -3.080   5.118   1.719
   36    HG3  GLN   5          1HG       GLN   5  -3.979   5.457   3.197
   37   HE21  GLN   5          1HE2      GLN   5  -3.557   4.253   5.012
   38   HE22  GLN   5          2HE2      GLN   5  -2.092   3.360   5.218
   39    H    ARG   6           H        ARG   6  -6.422   2.825  -0.283
   40    HA   ARG   6           HA       ARG   6  -7.893   0.670   0.651
   41    HB2  ARG   6          2HB       ARG   6  -8.894   2.312  -0.805
   42    HB3  ARG   6          1HB       ARG   6  -7.773   1.912  -2.092
   43    HG2  ARG   6          2HG       ARG   6  -8.773  -0.331  -2.255
   44    HG3  ARG   6          1HG       ARG   6  -9.942   0.123  -1.013
   45    HD2  ARG   6          2HD       ARG   6 -10.851   1.830  -2.415
   46    HD3  ARG   6          1HD       ARG   6  -9.573   1.601  -3.600
   47    HE   ARG   6           HE       ARG   6 -10.564  -0.769  -3.681
   48   HH11  ARG   6          1HH1      ARG   6 -12.488   2.165  -3.220
   49   HH12  ARG   6          2HH1      ARG   6 -13.746   1.710  -4.251
   50   HH21  ARG   6          1HH2      ARG   6 -12.348  -1.456  -5.109
   51   HH22  ARG   6          2HH2      ARG   6 -13.650  -0.385  -5.367
   52    H    LYS   7           H        LYS   7  -5.774   0.824  -2.186
   53    HA   LYS   7           HA       LYS   7  -5.982  -1.817  -2.996
   54    HB2  LYS   7          2HB       LYS   7  -4.986  -0.121  -4.417
   55    HB3  LYS   7          1HB       LYS   7  -3.670   0.103  -3.278
   56    HG2  LYS   7          2HG       LYS   7  -2.895  -2.170  -3.718
   57    HG3  LYS   7          1HG       LYS   7  -4.218  -2.399  -4.861
   58    HD2  LYS   7          2HD       LYS   7  -3.353  -0.680  -6.291
   59    HD3  LYS   7          1HD       LYS   7  -2.117  -0.256  -5.106
   60    HE2  LYS   7          2HE       LYS   7  -1.174  -1.594  -6.894
   61    HE3  LYS   7          1HE       LYS   7  -1.100  -2.453  -5.365
   62    HZ1  LYS   7          1HZ       LYS   7  -1.773  -3.909  -7.129
   63    HZ2  LYS   7          2HZ       LYS   7  -3.076  -2.933  -7.543
   64    HZ3  LYS   7          3HZ       LYS   7  -3.077  -3.752  -6.085
   65    H    CYS   8           H        CYS   8  -3.640  -0.327  -0.818
   66    HA   CYS   8           HA       CYS   8  -2.102  -2.597  -0.309
   67    HB2  CYS   8          2HB       CYS   8  -2.704  -0.267   1.474
   68    HB3  CYS   8          1HB       CYS   8  -1.410  -1.430   1.743
   69    H    LYS   9           H        LYS   9  -5.035  -1.443   1.342
   70    HA   LYS   9           HA       LYS   9  -4.885  -3.500   3.346
   71    HB2  LYS   9          2HB       LYS   9  -5.931  -1.250   3.714
   72    HB3  LYS   9          1HB       LYS   9  -7.232  -1.714   2.633
   73    HG2  LYS   9          2HG       LYS   9  -7.852  -3.529   4.182
   74    HG3  LYS   9          1HG       LYS   9  -6.551  -3.035   5.260
   75    HD2  LYS   9          2HD       LYS   9  -8.875  -1.283   4.447
   76    HD3  LYS   9          1HD       LYS   9  -8.789  -2.188   5.953
   77    HE2  LYS   9          2HE       LYS   9  -6.874  -0.009   5.092
   78    HE3  LYS   9          1HE       LYS   9  -8.197   0.194   6.229
   79    HZ1  LYS   9          1HZ       LYS   9  -6.089  -0.102   7.374
   80    HZ2  LYS   9          2HZ       LYS   9  -5.826  -1.586   6.656
   81    HZ3  LYS   9          3HZ       LYS   9  -7.108  -1.386   7.723
   82    H    GLU  10           H        GLU  10  -6.189  -3.194   0.195
   83    HA   GLU  10           HA       GLU  10  -7.966  -5.446   0.290
   84    HB2  GLU  10          2HB       GLU  10  -8.165  -3.459  -1.250
   85    HB3  GLU  10          1HB       GLU  10  -6.727  -4.024  -2.076
   86    HG2  GLU  10          2HG       GLU  10  -7.929  -6.100  -2.650
   87    HG3  GLU  10          1HG       GLU  10  -9.378  -5.421  -1.907
   88    H    LEU  11           H        LEU  11  -4.643  -4.799  -0.510
   89    HA   LEU  11           HA       LEU  11  -4.014  -7.362  -1.640
   90    HB2  LEU  11          2HB       LEU  11  -2.302  -5.147  -0.545
   91    HB3  LEU  11          1HB       LEU  11  -1.634  -6.590  -1.255
   92    HG   LEU  11           HG       LEU  11  -3.321  -4.538  -2.681
   93   HD11  LEU  11          1HD1      LEU  11  -1.103  -3.719  -2.109
   94   HD12  LEU  11          2HD1      LEU  11  -1.238  -4.012  -3.842
   95   HD13  LEU  11          3HD1      LEU  11  -0.378  -5.161  -2.820
   96   HD21  LEU  11          1HD2      LEU  11  -1.919  -7.010  -3.678
   97   HD22  LEU  11          2HD2      LEU  11  -2.632  -5.766  -4.694
   98   HD23  LEU  11          3HD2      LEU  11  -3.663  -6.732  -3.637
   99    H    DAS  12           H        DAS  12  -3.515  -5.791   1.448
  100    HA   DAS  12           HA       DAS  12  -3.073  -8.408   2.663
  101    HB2  DAS  12          1HB       DAS  12  -4.848  -7.218   3.741
  102    HB3  DAS  12          2HB       DAS  12  -3.902  -5.739   3.821
  103    H    THR  13           H        THR  13  -1.036  -8.915   2.952
  104    HA   THR  13           HA       THR  13   0.874  -6.767   3.509
  105    HB   THR  13           HB       THR  13   0.767  -8.734   5.096
  106    HG1  THR  13          1HG       THR  13   2.916  -7.614   4.033
  107   HG21  THR  13          1HG2      THR  13   1.850 -10.267   2.724
  108   HG22  THR  13          2HG2      THR  13   0.283 -10.520   3.493
  109   HG23  THR  13          3HG2      THR  13   1.770 -10.880   4.372
  110    H    ARG  14           H        ARG  14  -0.385  -8.236   0.989
  111    HA   ARG  14           HA       ARG  14   1.790  -9.203  -0.549
  112    HB2  ARG  14          2HB       ARG  14  -1.019  -8.404  -1.293
  113    HB3  ARG  14          1HB       ARG  14   0.123  -9.074  -2.448
  114    HG2  ARG  14          2HG       ARG  14   0.265 -11.093  -1.157
  115    HG3  ARG  14          1HG       ARG  14  -0.807 -10.418   0.074
  116    HD2  ARG  14          2HD       ARG  14  -2.610 -10.295  -1.535
  117    HD3  ARG  14          1HD       ARG  14  -1.545 -10.863  -2.818
  118    HE   ARG  14           HE       ARG  14  -1.515 -12.710  -0.731
  119   HH11  ARG  14          1HH1      ARG  14  -3.698 -11.569  -3.298
  120   HH12  ARG  14          2HH1      ARG  14  -4.606 -13.009  -3.352
  121   HH21  ARG  14          1HH2      ARG  14  -2.769 -14.707  -0.860
  122   HH22  ARG  14          2HH2      ARG  14  -4.072 -14.799  -1.953
  123    HA   DPR  15           HA       DPR  15   2.291  -5.577  -3.352
  124    HB2  DPR  15          1HB       DPR  15   4.866  -6.845  -3.975
  125    HB3  DPR  15          2HB       DPR  15   3.541  -6.410  -5.059
  126    HG2  DPR  15          1HG       DPR  15   4.106  -8.971  -4.507
  127    HG3  DPR  15          2HG       DPR  15   2.442  -8.409  -4.743
  128    HD2  DPR  15          1HD       DPR  15   3.925  -8.898  -2.186
  129    HD3  DPR  15          2HD       DPR  15   2.292  -9.428  -2.652
  130    H    DGL  16           H        DGL  16   4.023  -6.768  -0.663
  131    HA   DGL  16           HA       DGL  16   6.068  -4.773  -0.568
  132    HB2  DGL  16          1HB       DGL  16   6.217  -6.854   0.748
  133    HB3  DGL  16          2HB       DGL  16   4.818  -6.358   1.688
  134    HG2  DGL  16          1HG       DGL  16   6.786  -5.931   2.979
  135    HG3  DGL  16          2HG       DGL  16   6.108  -4.390   2.470
  136    H    DAL  17           H        DAL  17   2.740  -5.008   0.401
  137    HA   DAL  17           HA       DAL  17   2.546  -2.843   2.135
  138    HB1  DAL  17          1HB       DAL  17   0.444  -3.869   0.228
  139    HB2  DAL  17          2HB       DAL  17   0.160  -2.864   1.650
  140    HB3  DAL  17          3HB       DAL  17   0.766  -4.508   1.839
  141    H    DGL  18           H        DGL  18   2.506  -3.016  -1.353
  142    HA   DGL  18           HA       DGL  18   1.661  -0.418  -1.975
  143    HB2  DGL  18          1HB       DGL  18   3.610  -2.188  -3.446
  144    HB3  DGL  18          2HB       DGL  18   2.847  -0.755  -4.115
  145    HG2  DGL  18          1HG       DGL  18   0.670  -1.788  -3.843
  146    HG3  DGL  18          2HG       DGL  18   1.440  -3.226  -3.179
  147    H    DAR  19           H        DAR  19   4.873  -1.718  -1.355
  148    HA   DAR  19           HA       DAR  19   6.225   0.729  -1.895
  149    HB2  DAR  19          1HB       DAR  19   7.190  -1.702  -0.374
  150    HB3  DAR  19          2HB       DAR  19   8.201  -0.351  -0.869
  151    HG2  DAR  19          1HG       DAR  19   7.538  -0.846  -3.231
  152    HG3  DAR  19          2HG       DAR  19   6.778  -2.318  -2.635
  153    HD2  DAR  19          1HD       DAR  19   9.683  -1.615  -2.296
  154    HD3  DAR  19          2HD       DAR  19   9.044  -2.689  -3.530
  155    HE   DAR  19           HE       DAR  19   8.501  -3.428  -0.750
  156   HH11  DAR  19          1HH2      DAR  19   9.442  -5.437  -0.018
  157   HH12  DAR  19          2HH2      DAR  19  10.521  -6.284  -1.026
  158   HH21  DAR  19          1HH1      DAR  19  10.425  -3.942  -3.690
  159   HH22  DAR  19          2HH1      DAR  19  11.092  -5.410  -3.152
  160    H    DLY  20           H        DLY  20   5.025  -0.854   0.970
  161    HA   DLY  20           HA       DLY  20   6.040   0.966   2.855
  162    HB2  DLY  20          1HB       DLY  20   5.078  -1.266   3.422
  163    HB3  DLY  20          2HB       DLY  20   3.484  -0.653   3.014
  164    HG2  DLY  20          1HG       DLY  20   3.633   0.980   4.821
  165    HG3  DLY  20          2HG       DLY  20   5.243   0.382   5.223
  166    HD2  DLY  20          1HD       DLY  20   4.301  -1.827   5.709
  167    HD3  DLY  20          2HD       DLY  20   2.688  -1.214   5.346
  168    HE2  DLY  20          1HE       DLY  20   2.914   0.429   7.161
  169    HE3  DLY  20          2HE       DLY  20   4.516  -0.206   7.527
  170    HZ1  DLY  20          1HZ       DLY  20   3.503  -2.344   8.075
  171    HZ2  DLY  20          2HZ       DLY  20   1.971  -1.722   7.746
  172    HZ3  DLY  20          3HZ       DLY  20   2.871  -1.117   9.023
  173    H    DCY  21           H        DCY  21   2.986   0.899   1.022
  174    HA   DCY  21           HA       DCY  21   1.910   3.211   2.192
  175    HB2  DCY  21          1HB       DCY  21   1.342   1.914  -0.464
  176    HB3  DCY  21          2HB       DCY  21   0.388   3.229   0.231
  177    H    DAR  22           H        DAR  22   4.061   2.767  -0.531
  178    HA   DAR  22           HA       DAR  22   3.905   5.459  -1.428
  179    HB2  DAR  22          1HB       DAR  22   6.149   3.458  -1.715
  180    HB3  DAR  22          2HB       DAR  22   6.087   5.013  -2.531
  181    HG2  DAR  22          1HG       DAR  22   4.157   2.744  -2.924
  182    HG3  DAR  22          2HG       DAR  22   5.445   3.241  -4.027
  183    HD2  DAR  22          1HD       DAR  22   4.375   5.431  -4.274
  184    HD3  DAR  22          2HD       DAR  22   3.060   4.882  -3.231
  185    HE   DAR  22           HE       DAR  22   3.472   3.127  -5.397
  186   HH11  DAR  22          1HH1      DAR  22   1.962   6.217  -4.538
  187   HH12  DAR  22          2HH1      DAR  22   0.823   6.154  -5.808
  188   HH21  DAR  22          1HH2      DAR  22   1.928   3.075  -7.138
  189   HH22  DAR  22          2HH2      DAR  22   0.800   4.332  -7.319
  190    H    DGL  23           H        DGL  23   5.975   3.771   0.843
  191    HA   DGL  23           HA       DGL  23   7.664   5.944   1.412
  192    HB2  DGL  23          1HB       DGL  23   8.241   3.606   1.869
  193    HB3  DGL  23          2HB       DGL  23   6.982   3.528   3.084
  194    HG2  DGL  23          1HG       DGL  23   8.143   5.098   4.478
  195    HG3  DGL  23          2HG       DGL  23   9.367   5.349   3.234
  196    H    DGL  24           H        DGL  24   4.603   4.894   2.797
  197    HA   DGL  24           HA       DGL  24   4.701   6.828   4.927
  198    HB2  DGL  24          1HB       DGL  24   2.394   5.136   3.965
  199    HB3  DGL  24          2HB       DGL  24   2.397   6.112   5.424
  200    HG2  DGL  24          1HG       DGL  24   4.147   3.735   4.870
  201    HG3  DGL  24          2HG       DGL  24   2.760   3.786   5.955
  202    H    SER  25           H        SER  25   2.572   6.464   2.075
  203    HA   SER  25           HA       SER  25   2.137   9.366   2.166
  204    HB2  SER  25          2HB       SER  25   1.700   7.397  -0.089
  205    HB3  SER  25          1HB       SER  25   1.487   9.145  -0.177
  206    HG   SER  25           HG       SER  25   3.942   7.893   0.494
  207    H    ASP  26           H        ASP  26   0.176   9.970   2.946
  208    HA   ASP  26           HA       ASP  26  -1.860   7.960   3.175
  209    HB2  ASP  26          2HB       ASP  26  -1.607   9.503   5.062
  210    HB3  ASP  26          1HB       ASP  26  -1.920  10.874   3.997
  Start of MODEL   18
    1    H    ASN   1           H        ASN   1  -1.719   7.193   0.756
    2    HA   ASN   1           HA       ASN   1  -3.722   9.277   0.405
    3    HB2  ASN   1          2HB       ASN   1  -2.235   7.548  -1.603
    4    HB3  ASN   1          1HB       ASN   1  -3.438   8.752  -2.033
    5   HD21  ASN   1          1HD2      ASN   1  -1.878   9.832  -3.269
    6   HD22  ASN   1          2HD2      ASN   1  -0.681  10.831  -2.539
    7    HA   PRO   2           HA       PRO   2  -7.326   6.751   0.607
    8    HB2  PRO   2          2HB       PRO   2  -7.878   7.859  -2.114
    9    HB3  PRO   2          1HB       PRO   2  -8.971   7.699  -0.732
   10    HG2  PRO   2          2HG       PRO   2  -7.889  10.053  -1.283
   11    HG3  PRO   2          1HG       PRO   2  -8.023   9.499   0.395
   12    HD2  PRO   2          2HD       PRO   2  -5.617   9.681  -1.345
   13    HD3  PRO   2          1HD       PRO   2  -5.764   9.856   0.415
   14    H    GLU   3           H        GLU   3  -6.146   6.800  -2.797
   15    HA   GLU   3           HA       GLU   3  -7.097   4.225  -3.368
   16    HB2  GLU   3          2HB       GLU   3  -4.920   5.811  -4.724
   17    HB3  GLU   3          1HB       GLU   3  -5.537   4.284  -5.327
   18    HG2  GLU   3          2HG       GLU   3  -7.766   5.279  -5.534
   19    HG3  GLU   3          1HG       GLU   3  -7.115   6.820  -4.972
   20    H    LEU   4           H        LEU   4  -4.001   5.311  -2.132
   21    HA   LEU   4           HA       LEU   4  -2.701   2.835  -2.463
   22    HB2  LEU   4          2HB       LEU   4  -2.089   5.206  -0.724
   23    HB3  LEU   4          1HB       LEU   4  -1.081   3.777  -0.779
   24    HG   LEU   4           HG       LEU   4  -1.664   5.571  -3.142
   25   HD11  LEU   4          1HD1      LEU   4   0.812   5.271  -1.458
   26   HD12  LEU   4          2HD1      LEU   4  -0.251   6.678  -1.491
   27   HD13  LEU   4          3HD1      LEU   4   0.675   6.233  -2.927
   28   HD21  LEU   4          1HD2      LEU   4   0.136   4.292  -4.215
   29   HD22  LEU   4          2HD2      LEU   4  -1.256   3.291  -3.835
   30   HD23  LEU   4          3HD2      LEU   4   0.187   3.214  -2.821
   31    H    GLN   5           H        GLN   5  -4.214   4.327   0.388
   32    HA   GLN   5           HA       GLN   5  -3.612   2.128   2.055
   33    HB2  GLN   5          2HB       GLN   5  -5.718   4.266   2.385
   34    HB3  GLN   5          1HB       GLN   5  -5.291   3.098   3.627
   35    HG2  GLN   5          2HG       GLN   5  -3.431   5.140   2.419
   36    HG3  GLN   5          1HG       GLN   5  -4.211   5.262   3.992
   37   HE21  GLN   5          1HE2      GLN   5  -3.799   2.406   4.654
   38   HE22  GLN   5          2HE2      GLN   5  -2.115   2.269   4.978
   39    H    ARG   6           H        ARG   6  -6.451   2.885   0.119
   40    HA   ARG   6           HA       ARG   6  -7.982   0.674   1.058
   41    HB2  ARG   6          2HB       ARG   6  -8.242   2.274  -1.502
   42    HB3  ARG   6          1HB       ARG   6  -9.441   1.129  -0.911
   43    HG2  ARG   6          2HG       ARG   6  -9.883   2.472   1.014
   44    HG3  ARG   6          1HG       ARG   6  -8.538   3.547   0.637
   45    HD2  ARG   6          2HD       ARG   6  -9.712   4.163  -1.461
   46    HD3  ARG   6          1HD       ARG   6 -11.096   3.205  -0.930
   47    HE   ARG   6           HE       ARG   6 -10.658   4.853   1.149
   48   HH11  ARG   6          1HH1      ARG   6 -11.054   5.517  -2.310
   49   HH12  ARG   6          2HH1      ARG   6 -11.777   7.037  -2.107
   50   HH21  ARG   6          1HH2      ARG   6 -11.622   6.984   1.447
   51   HH22  ARG   6          2HH2      ARG   6 -12.111   7.890   0.105
   52    H    LYS   7           H        LYS   7  -5.703   1.125  -1.580
   53    HA   LYS   7           HA       LYS   7  -6.033  -1.382  -2.790
   54    HB2  LYS   7          2HB       LYS   7  -4.779   0.378  -3.908
   55    HB3  LYS   7          1HB       LYS   7  -3.613   0.402  -2.598
   56    HG2  LYS   7          2HG       LYS   7  -2.780  -1.758  -3.199
   57    HG3  LYS   7          1HG       LYS   7  -4.055  -1.976  -4.393
   58    HD2  LYS   7          2HD       LYS   7  -1.919  -1.354  -5.434
   59    HD3  LYS   7          1HD       LYS   7  -3.157  -0.137  -5.714
   60    HE2  LYS   7          2HE       LYS   7  -2.224   1.230  -3.927
   61    HE3  LYS   7          1HE       LYS   7  -0.992   0.001  -3.623
   62    HZ1  LYS   7          1HZ       LYS   7  -0.266   0.303  -5.915
   63    HZ2  LYS   7          2HZ       LYS   7   0.027   1.563  -4.961
   64    HZ3  LYS   7          3HZ       LYS   7  -1.262   1.670  -6.091
   65    H    CYS   8           H        CYS   8  -3.703  -0.264  -0.351
   66    HA   CYS   8           HA       CYS   8  -2.503  -2.731   0.091
   67    HB2  CYS   8          2HB       CYS   8  -2.842  -0.391   1.967
   68    HB3  CYS   8          1HB       CYS   8  -1.740  -1.738   2.241
   69    H    LYS   9           H        LYS   9  -5.429  -1.367   1.440
   70    HA   LYS   9           HA       LYS   9  -5.892  -3.260   3.446
   71    HB2  LYS   9          2HB       LYS   9  -7.127  -1.133   3.223
   72    HB3  LYS   9          1HB       LYS   9  -7.907  -1.751   1.777
   73    HG2  LYS   9          2HG       LYS   9  -8.941  -3.529   3.111
   74    HG3  LYS   9          1HG       LYS   9  -8.194  -2.862   4.561
   75    HD2  LYS   9          2HD       LYS   9  -9.385  -0.735   4.140
   76    HD3  LYS   9          1HD       LYS   9 -10.188  -1.490   2.765
   77    HE2  LYS   9          2HE       LYS   9 -10.377  -2.385   5.642
   78    HE3  LYS   9          1HE       LYS   9 -11.623  -1.527   4.741
   79    HZ1  LYS   9          1HZ       LYS   9 -10.580  -4.219   4.038
   80    HZ2  LYS   9          2HZ       LYS   9 -11.870  -3.436   3.285
   81    HZ3  LYS   9          3HZ       LYS   9 -11.997  -3.936   4.872
   82    H    GLU  10           H        GLU  10  -6.974  -3.146   0.052
   83    HA   GLU  10           HA       GLU  10  -8.307  -5.666   0.145
   84    HB2  GLU  10          2HB       GLU  10  -8.919  -3.845  -1.399
   85    HB3  GLU  10          1HB       GLU  10  -7.373  -4.018  -2.210
   86    HG2  GLU  10          2HG       GLU  10  -7.998  -6.320  -2.819
   87    HG3  GLU  10          1HG       GLU  10  -9.581  -6.050  -2.095
   88    H    LEU  11           H        LEU  11  -5.134  -4.598  -0.812
   89    HA   LEU  11           HA       LEU  11  -4.334  -6.962  -2.187
   90    HB2  LEU  11          2HB       LEU  11  -3.480  -4.758  -2.718
   91    HB3  LEU  11          1HB       LEU  11  -2.783  -4.620  -1.126
   92    HG   LEU  11           HG       LEU  11  -1.197  -6.412  -1.673
   93   HD11  LEU  11          1HD1      LEU  11  -1.004  -7.169  -3.999
   94   HD12  LEU  11          2HD1      LEU  11  -2.479  -6.286  -4.401
   95   HD13  LEU  11          3HD1      LEU  11  -2.540  -7.648  -3.282
   96   HD21  LEU  11          1HD2      LEU  11  -0.629  -4.063  -2.037
   97   HD22  LEU  11          2HD2      LEU  11  -1.270  -4.160  -3.679
   98   HD23  LEU  11          3HD2      LEU  11   0.146  -5.110  -3.220
   99    H    DAS  12           H        DAS  12  -3.961  -5.803   1.098
  100    HA   DAS  12           HA       DAS  12  -2.933  -8.422   1.870
  101    HB2  DAS  12          1HB       DAS  12  -4.777  -7.629   3.191
  102    HB3  DAS  12          2HB       DAS  12  -3.990  -6.080   3.461
  103    H    THR  13           H        THR  13  -0.909  -8.711   2.680
  104    HA   THR  13           HA       THR  13   0.761  -6.326   3.052
  105    HB   THR  13           HB       THR  13   1.349  -9.170   3.966
  106    HG1  THR  13          1HG       THR  13  -0.611  -7.645   4.878
  107   HG21  THR  13          1HG2      THR  13   3.293  -7.633   3.927
  108   HG22  THR  13          2HG2      THR  13   2.854  -8.063   5.580
  109   HG23  THR  13          3HG2      THR  13   2.401  -6.488   4.930
  110    H    ARG  14           H        ARG  14  -0.086  -7.811   0.597
  111    HA   ARG  14           HA       ARG  14   2.343  -8.965  -0.434
  112    HB2  ARG  14          2HB       ARG  14  -0.303  -8.378  -1.806
  113    HB3  ARG  14          1HB       ARG  14   1.021  -9.305  -2.505
  114    HG2  ARG  14          2HG       ARG  14   0.802 -10.941  -0.666
  115    HG3  ARG  14          1HG       ARG  14  -0.588 -10.036  -0.071
  116    HD2  ARG  14          2HD       ARG  14  -0.365 -11.314  -2.788
  117    HD3  ARG  14          1HD       ARG  14  -1.190 -12.013  -1.401
  118    HE   ARG  14           HE       ARG  14  -2.469  -9.717  -1.598
  119   HH11  ARG  14          1HH1      ARG  14  -1.481 -11.934  -4.176
  120   HH12  ARG  14          2HH1      ARG  14  -2.847 -11.688  -5.149
  121   HH21  ARG  14          1HH2      ARG  14  -4.449  -9.418  -2.933
  122   HH22  ARG  14          2HH2      ARG  14  -4.573 -10.262  -4.402
  123    HA   DPR  15           HA       DPR  15   3.144  -5.372  -3.256
  124    HB2  DPR  15          1HB       DPR  15   5.891  -6.414  -3.210
  125    HB3  DPR  15          2HB       DPR  15   4.841  -6.123  -4.598
  126    HG2  DPR  15          1HG       DPR  15   5.492  -8.613  -3.803
  127    HG3  DPR  15          2HG       DPR  15   3.912  -8.232  -4.507
  128    HD2  DPR  15          1HD       DPR  15   4.664  -8.587  -1.630
  129    HD3  DPR  15          2HD       DPR  15   3.244  -9.204  -2.502
  130    H    DGL  16           H        DGL  16   4.341  -6.567  -0.346
  131    HA   DGL  16           HA       DGL  16   6.285  -4.698   0.468
  132    HB2  DGL  16          1HB       DGL  16   5.553  -6.971   1.475
  133    HB3  DGL  16          2HB       DGL  16   4.269  -6.082   2.253
  134    HG2  DGL  16          1HG       DGL  16   7.199  -5.645   2.712
  135    HG3  DGL  16          2HG       DGL  16   6.116  -6.535   3.768
  136    H    DAL  17           H        DAL  17   2.796  -4.905   0.943
  137    HA   DAL  17           HA       DAL  17   2.385  -2.567   2.413
  138    HB1  DAL  17          1HB       DAL  17   0.705  -4.320   2.193
  139    HB2  DAL  17          2HB       DAL  17   0.516  -3.924   0.485
  140    HB3  DAL  17          3HB       DAL  17   0.058  -2.750   1.718
  141    H    DGL  18           H        DGL  18   2.200  -3.172  -1.039
  142    HA   DGL  18           HA       DGL  18   1.445  -0.754  -2.088
  143    HB2  DGL  18          1HB       DGL  18   1.798  -2.706  -3.468
  144    HB3  DGL  18          2HB       DGL  18   3.502  -2.750  -3.063
  145    HG2  DGL  18          1HG       DGL  18   3.310  -1.936  -5.283
  146    HG3  DGL  18          2HG       DGL  18   3.790  -0.603  -4.226
  147    H    DAR  19           H        DAR  19   4.739  -1.781  -1.425
  148    HA   DAR  19           HA       DAR  19   5.966   0.669  -2.176
  149    HB2  DAR  19          1HB       DAR  19   7.048  -1.480  -0.380
  150    HB3  DAR  19          2HB       DAR  19   7.991  -0.263  -1.225
  151    HG2  DAR  19          1HG       DAR  19   7.348  -1.238  -3.364
  152    HG3  DAR  19          2HG       DAR  19   6.379  -2.449  -2.521
  153    HD2  DAR  19          1HD       DAR  19   9.366  -2.089  -2.374
  154    HD3  DAR  19          2HD       DAR  19   8.486  -3.424  -3.122
  155    HE   DAR  19           HE       DAR  19   7.981  -3.012  -0.310
  156   HH11  DAR  19          1HH2      DAR  19   8.689  -4.606   1.189
  157   HH12  DAR  19          2HH2      DAR  19   9.684  -5.898   0.672
  158   HH21  DAR  19          1HH1      DAR  19   9.840  -4.852  -2.706
  159   HH22  DAR  19          2HH1      DAR  19  10.360  -6.021  -1.595
  160    H    DLY  20           H        DLY  20   5.148  -0.769   0.958
  161    HA   DLY  20           HA       DLY  20   6.266   1.306   2.495
  162    HB2  DLY  20          1HB       DLY  20   5.839  -0.961   3.365
  163    HB3  DLY  20          2HB       DLY  20   4.112  -0.668   3.264
  164    HG2  DLY  20          1HG       DLY  20   4.261   1.059   4.940
  165    HG3  DLY  20          2HG       DLY  20   6.014   0.894   4.992
  166    HD2  DLY  20          1HD       DLY  20   5.803  -1.383   5.798
  167    HD3  DLY  20          2HD       DLY  20   4.044  -1.274   5.696
  168    HE2  DLY  20          1HE       DLY  20   4.022   0.475   7.358
  169    HE3  DLY  20          2HE       DLY  20   5.782   0.478   7.419
  170    HZ1  DLY  20          1HZ       DLY  20   4.724  -0.753   9.256
  171    HZ2  DLY  20          2HZ       DLY  20   5.779  -1.696   8.349
  172    HZ3  DLY  20          3HZ       DLY  20   4.130  -1.881   8.143
  173    H    DCY  21           H        DCY  21   3.046   0.855   1.123
  174    HA   DCY  21           HA       DCY  21   1.884   3.065   2.455
  175    HB2  DCY  21          1HB       DCY  21   1.118   1.656  -0.099
  176    HB3  DCY  21          2HB       DCY  21   0.174   2.976   0.593
  177    H    DAR  22           H        DAR  22   3.492   2.702  -0.680
  178    HA   DAR  22           HA       DAR  22   3.050   5.391  -1.437
  179    HB2  DAR  22          1HB       DAR  22   5.045   3.369  -2.422
  180    HB3  DAR  22          2HB       DAR  22   4.800   4.944  -3.162
  181    HG2  DAR  22          1HG       DAR  22   2.474   4.349  -3.635
  182    HG3  DAR  22          2HG       DAR  22   2.735   2.768  -2.900
  183    HD2  DAR  22          1HD       DAR  22   2.885   2.615  -5.314
  184    HD3  DAR  22          2HD       DAR  22   4.445   2.269  -4.569
  185    HE   DAR  22           HE       DAR  22   4.222   4.999  -5.229
  186   HH11  DAR  22          1HH1      DAR  22   4.681   1.834  -6.764
  187   HH12  DAR  22          2HH1      DAR  22   5.629   2.431  -8.040
  188   HH21  DAR  22          1HH2      DAR  22   5.560   5.821  -7.000
  189   HH22  DAR  22          2HH2      DAR  22   6.147   4.730  -8.168
  190    H    DGL  23           H        DGL  23   5.512   3.845   0.446
  191    HA   DGL  23           HA       DGL  23   7.399   5.952   0.443
  192    HB2  DGL  23          1HB       DGL  23   7.890   3.633   1.173
  193    HB3  DGL  23          2HB       DGL  23   6.865   3.877   2.579
  194    HG2  DGL  23          1HG       DGL  23   8.363   5.668   3.334
  195    HG3  DGL  23          2HG       DGL  23   9.415   5.343   1.960
  196    H    DGL  24           H        DGL  24   4.849   5.079   2.751
  197    HA   DGL  24           HA       DGL  24   5.220   7.386   4.391
  198    HB2  DGL  24          1HB       DGL  24   3.027   5.343   4.209
  199    HB3  DGL  24          2HB       DGL  24   3.002   6.668   5.361
  200    HG2  DGL  24          1HG       DGL  24   5.156   4.586   5.173
  201    HG3  DGL  24          2HG       DGL  24   3.825   4.580   6.333
  202    H    SER  25           H        SER  25   2.946   6.512   1.884
  203    HA   SER  25           HA       SER  25   2.000   9.267   1.866
  204    HB2  SER  25          2HB       SER  25   3.394   8.561  -0.118
  205    HB3  SER  25          1HB       SER  25   2.230   7.284  -0.431
  206    HG   SER  25           HG       SER  25   0.729   9.341  -0.379
  207    H    ASP  26           H        ASP  26   0.340   8.725   3.366
  208    HA   ASP  26           HA       ASP  26  -1.323   6.467   2.825
  209    HB2  ASP  26          2HB       ASP  26  -2.625   7.132   4.831
  210    HB3  ASP  26          1HB       ASP  26  -0.908   7.003   5.164
  Start of MODEL   19
    1    H    ASN   1           H        ASN   1  -2.084   7.433   1.374
    2    HA   ASN   1           HA       ASN   1  -4.131   9.355   0.524
    3    HB2  ASN   1          2HB       ASN   1  -2.395   9.104  -1.226
    4    HB3  ASN   1          1HB       ASN   1  -2.729   7.379  -1.288
    5   HD21  ASN   1          1HD2      ASN   1  -3.900  10.526  -2.016
    6   HD22  ASN   1          2HD2      ASN   1  -5.180  10.077  -3.073
    7    HA   PRO   2           HA       PRO   2  -6.908   6.348   2.210
    8    HB2  PRO   2          2HB       PRO   2  -8.697   7.680   0.231
    9    HB3  PRO   2          1HB       PRO   2  -8.984   7.306   1.933
   10    HG2  PRO   2          2HG       PRO   2  -8.388   9.779   1.227
   11    HG3  PRO   2          1HG       PRO   2  -7.671   9.067   2.682
   12    HD2  PRO   2          2HD       PRO   2  -6.448   9.566   0.015
   13    HD3  PRO   2          1HD       PRO   2  -5.740   9.681   1.643
   14    H    GLU   3           H        GLU   3  -7.161   6.907  -1.324
   15    HA   GLU   3           HA       GLU   3  -8.314   4.344  -1.756
   16    HB2  GLU   3          2HB       GLU   3  -8.761   6.264  -3.223
   17    HB3  GLU   3          1HB       GLU   3  -7.081   6.223  -3.749
   18    HG2  GLU   3          2HG       GLU   3  -7.411   4.082  -4.778
   19    HG3  GLU   3          1HG       GLU   3  -9.059   3.998  -4.155
   20    H    LEU   4           H        LEU   4  -5.066   5.650  -2.101
   21    HA   LEU   4           HA       LEU   4  -3.852   3.411  -3.287
   22    HB2  LEU   4          2HB       LEU   4  -2.743   5.594  -3.101
   23    HB3  LEU   4          1HB       LEU   4  -2.743   5.427  -1.355
   24    HG   LEU   4           HG       LEU   4  -1.172   3.585  -1.503
   25   HD11  LEU   4          1HD1      LEU   4  -0.056   3.046  -3.614
   26   HD12  LEU   4          2HD1      LEU   4  -1.157   4.131  -4.460
   27   HD13  LEU   4          3HD1      LEU   4  -1.780   2.678  -3.676
   28   HD21  LEU   4          1HD2      LEU   4  -0.314   5.836  -1.235
   29   HD22  LEU   4          2HD2      LEU   4  -0.300   6.061  -2.983
   30   HD23  LEU   4          3HD2      LEU   4   0.785   4.890  -2.238
   31    H    GLN   5           H        GLN   5  -4.229   4.335   0.097
   32    HA   GLN   5           HA       GLN   5  -3.126   2.022   1.221
   33    HB2  GLN   5          2HB       GLN   5  -5.036   4.091   2.254
   34    HB3  GLN   5          1HB       GLN   5  -4.546   2.730   3.248
   35    HG2  GLN   5          2HG       GLN   5  -2.626   4.666   1.972
   36    HG3  GLN   5          1HG       GLN   5  -3.224   4.812   3.622
   37   HE21  GLN   5          1HE2      GLN   5  -3.194   1.958   4.125
   38   HE22  GLN   5          2HE2      GLN   5  -1.545   1.505   4.318
   39    H    ARG   6           H        ARG   6  -6.425   2.784   0.239
   40    HA   ARG   6           HA       ARG   6  -7.650   0.440   1.124
   41    HB2  ARG   6          2HB       ARG   6  -9.082   2.199   0.318
   42    HB3  ARG   6          1HB       ARG   6  -8.274   2.222  -1.241
   43    HG2  ARG   6          2HG       ARG   6 -10.488   1.190  -1.390
   44    HG3  ARG   6          1HG       ARG   6  -9.206   0.049  -1.793
   45    HD2  ARG   6          2HD       ARG   6  -9.340  -0.704   0.632
   46    HD3  ARG   6          1HD       ARG   6 -10.862   0.194   0.715
   47    HE   ARG   6           HE       ARG   6 -11.169  -1.321  -1.456
   48   HH11  ARG   6          1HH1      ARG   6 -10.341  -2.070   1.874
   49   HH12  ARG   6          2HH1      ARG   6 -10.795  -3.706   1.807
   50   HH21  ARG   6          1HH2      ARG   6 -11.720  -3.554  -1.631
   51   HH22  ARG   6          2HH2      ARG   6 -11.629  -4.598  -0.296
   52    H    LYS   7           H        LYS   7  -6.087   1.149  -1.973
   53    HA   LYS   7           HA       LYS   7  -6.360  -1.324  -3.217
   54    HB2  LYS   7          2HB       LYS   7  -4.060   0.638  -3.350
   55    HB3  LYS   7          1HB       LYS   7  -4.248  -0.730  -4.429
   56    HG2  LYS   7          2HG       LYS   7  -6.231   1.525  -4.188
   57    HG3  LYS   7          1HG       LYS   7  -4.948   1.453  -5.392
   58    HD2  LYS   7          2HD       LYS   7  -5.895  -0.690  -6.196
   59    HD3  LYS   7          1HD       LYS   7  -7.235  -0.486  -5.062
   60    HE2  LYS   7          2HE       LYS   7  -7.873   1.587  -6.170
   61    HE3  LYS   7          1HE       LYS   7  -6.490   1.440  -7.250
   62    HZ1  LYS   7          1HZ       LYS   7  -7.467  -0.576  -8.169
   63    HZ2  LYS   7          2HZ       LYS   7  -8.548   0.705  -8.305
   64    HZ3  LYS   7          3HZ       LYS   7  -8.781  -0.450  -7.132
   65    H    CYS   8           H        CYS   8  -3.766  -0.159  -1.115
   66    HA   CYS   8           HA       CYS   8  -2.258  -2.505  -1.104
   67    HB2  CYS   8          2HB       CYS   8  -2.447  -0.369   1.009
   68    HB3  CYS   8          1HB       CYS   8  -1.207  -1.613   0.936
   69    H    LYS   9           H        LYS   9  -4.972  -1.547   1.000
   70    HA   LYS   9           HA       LYS   9  -4.595  -3.865   2.638
   71    HB2  LYS   9          2HB       LYS   9  -5.636  -1.785   3.526
   72    HB3  LYS   9          1HB       LYS   9  -7.023  -2.058   2.481
   73    HG2  LYS   9          2HG       LYS   9  -7.574  -4.086   3.657
   74    HG3  LYS   9          1HG       LYS   9  -6.116  -3.959   4.637
   75    HD2  LYS   9          2HD       LYS   9  -6.963  -1.868   5.604
   76    HD3  LYS   9          1HD       LYS   9  -8.419  -2.011   4.620
   77    HE2  LYS   9          2HE       LYS   9  -7.512  -3.970   6.725
   78    HE3  LYS   9          1HE       LYS   9  -8.805  -2.788   6.905
   79    HZ1  LYS   9          1HZ       LYS   9  -8.770  -5.072   5.004
   80    HZ2  LYS   9          2HZ       LYS   9  -9.980  -3.913   5.073
   81    HZ3  LYS   9          3HZ       LYS   9  -9.727  -4.934   6.377
   82    H    GLU  10           H        GLU  10  -6.353  -3.147  -0.242
   83    HA   GLU  10           HA       GLU  10  -7.877  -5.570  -0.209
   84    HB2  GLU  10          2HB       GLU  10  -8.540  -3.461  -1.416
   85    HB3  GLU  10          1HB       GLU  10  -7.203  -3.722  -2.520
   86    HG2  GLU  10          2HG       GLU  10  -8.218  -5.743  -3.330
   87    HG3  GLU  10          1HG       GLU  10  -9.508  -5.602  -2.135
   88    H    LEU  11           H        LEU  11  -4.717  -4.623  -0.959
   89    HA   LEU  11           HA       LEU  11  -4.018  -7.014  -2.443
   90    HB2  LEU  11          2HB       LEU  11  -3.019  -4.809  -2.971
   91    HB3  LEU  11          1HB       LEU  11  -2.331  -4.749  -1.370
   92    HG   LEU  11           HG       LEU  11  -0.874  -6.632  -1.915
   93   HD11  LEU  11          1HD1      LEU  11  -2.103  -6.423  -4.668
   94   HD12  LEU  11          2HD1      LEU  11  -2.276  -7.778  -3.550
   95   HD13  LEU  11          3HD1      LEU  11  -0.700  -7.404  -4.244
   96   HD21  LEU  11          1HD2      LEU  11  -0.094  -4.362  -2.277
   97   HD22  LEU  11          2HD2      LEU  11  -0.772  -4.371  -3.905
   98   HD23  LEU  11          3HD2      LEU  11   0.567  -5.446  -3.501
   99    H    DAS  12           H        DAS  12  -3.941  -5.823   0.824
  100    HA   DAS  12           HA       DAS  12  -3.189  -8.467   1.783
  101    HB2  DAS  12          1HB       DAS  12  -5.108  -7.575   2.905
  102    HB3  DAS  12          2HB       DAS  12  -4.297  -6.051   3.218
  103    H    THR  13           H        THR  13  -1.315  -8.953   2.523
  104    HA   THR  13           HA       THR  13   0.468  -6.802   3.402
  105    HB   THR  13           HB       THR  13   0.049  -8.607   5.062
  106    HG1  THR  13          1HG       THR  13   2.138  -7.574   5.008
  107   HG21  THR  13          1HG2      THR  13   0.972 -10.870   4.667
  108   HG22  THR  13          2HG2      THR  13   1.317 -10.412   2.997
  109   HG23  THR  13          3HG2      THR  13  -0.349 -10.473   3.570
  110    H    ARG  14           H        ARG  14  -0.259  -8.306   0.707
  111    HA   ARG  14           HA       ARG  14   2.263  -9.233  -0.231
  112    HB2  ARG  14          2HB       ARG  14  -0.241  -8.496  -1.776
  113    HB3  ARG  14          1HB       ARG  14   1.153  -9.326  -2.450
  114    HG2  ARG  14          2HG       ARG  14  -0.641 -10.358  -0.264
  115    HG3  ARG  14          1HG       ARG  14  -0.666 -10.868  -1.952
  116    HD2  ARG  14          2HD       ARG  14   1.657 -11.190  -0.040
  117    HD3  ARG  14          1HD       ARG  14   0.550 -12.464  -0.534
  118    HE   ARG  14           HE       ARG  14   1.414 -11.695  -2.881
  119   HH11  ARG  14          1HH1      ARG  14   3.370 -12.136   0.058
  120   HH12  ARG  14          2HH1      ARG  14   4.720 -12.700  -0.793
  121   HH21  ARG  14          1HH2      ARG  14   3.305 -12.469  -4.012
  122   HH22  ARG  14          2HH2      ARG  14   4.688 -12.896  -3.105
  123    HA   DPR  15           HA       DPR  15   3.351  -5.565  -2.777
  124    HB2  DPR  15          1HB       DPR  15   6.067  -6.614  -2.412
  125    HB3  DPR  15          2HB       DPR  15   5.195  -6.272  -3.909
  126    HG2  DPR  15          1HG       DPR  15   5.724  -8.784  -3.140
  127    HG3  DPR  15          2HG       DPR  15   4.222  -8.359  -3.982
  128    HD2  DPR  15          1HD       DPR  15   4.684  -8.811  -1.057
  129    HD3  DPR  15          2HD       DPR  15   3.364  -9.390  -2.093
  130    H    DGL  16           H        DGL  16   4.289  -6.735   0.283
  131    HA   DGL  16           HA       DGL  16   6.116  -4.820   1.196
  132    HB2  DGL  16          1HB       DGL  16   5.589  -6.946   2.328
  133    HB3  DGL  16          2HB       DGL  16   3.997  -6.335   2.739
  134    HG2  DGL  16          1HG       DGL  16   5.417  -6.217   4.648
  135    HG3  DGL  16          2HG       DGL  16   5.044  -4.584   4.098
  136    H    DAL  17           H        DAL  17   2.579  -4.933   1.428
  137    HA   DAL  17           HA       DAL  17   2.283  -2.478   2.810
  138    HB1  DAL  17          1HB       DAL  17   0.552  -4.229   2.764
  139    HB2  DAL  17          2HB       DAL  17   0.249  -3.860   1.064
  140    HB3  DAL  17          3HB       DAL  17  -0.067  -2.647   2.306
  141    H    DGL  18           H        DGL  18   2.341  -3.355  -0.535
  142    HA   DGL  18           HA       DGL  18   1.592  -0.961  -1.765
  143    HB2  DGL  18          1HB       DGL  18   1.686  -2.944  -3.056
  144    HB3  DGL  18          2HB       DGL  18   3.329  -3.286  -2.566
  145    HG2  DGL  18          1HG       DGL  18   3.215  -2.632  -4.896
  146    HG3  DGL  18          2HG       DGL  18   4.178  -1.521  -3.936
  147    H    DAR  19           H        DAR  19   4.813  -2.148  -0.856
  148    HA   DAR  19           HA       DAR  19   6.154   0.199  -1.739
  149    HB2  DAR  19          1HB       DAR  19   7.085  -1.880   0.238
  150    HB3  DAR  19          2HB       DAR  19   8.102  -0.663  -0.511
  151    HG2  DAR  19          1HG       DAR  19   6.668  -2.890  -1.957
  152    HG3  DAR  19          2HG       DAR  19   8.382  -2.854  -1.562
  153    HD2  DAR  19          1HD       DAR  19   8.221  -2.257  -3.843
  154    HD3  DAR  19          2HD       DAR  19   8.584  -0.779  -2.970
  155    HE   DAR  19           HE       DAR  19   5.804  -0.979  -3.295
  156   HH11  DAR  19          1HH2      DAR  19   4.666   0.273  -5.051
  157   HH12  DAR  19          2HH2      DAR  19   5.628   0.825  -6.340
  158   HH21  DAR  19          1HH1      DAR  19   8.724  -0.380  -5.194
  159   HH22  DAR  19          2HH1      DAR  19   7.929   0.482  -6.432
  160    H    DLY  20           H        DLY  20   4.790  -0.798   1.331
  161    HA   DLY  20           HA       DLY  20   5.760   1.345   2.865
  162    HB2  DLY  20          1HB       DLY  20   4.749  -0.689   3.838
  163    HB3  DLY  20          2HB       DLY  20   3.186  -0.203   3.209
  164    HG2  DLY  20          1HG       DLY  20   3.143   1.728   4.648
  165    HG3  DLY  20          2HG       DLY  20   4.776   1.385   5.215
  166    HD2  DLY  20          1HD       DLY  20   3.991  -0.747   6.146
  167    HD3  DLY  20          2HD       DLY  20   2.353  -0.367   5.617
  168    HE2  DLY  20          1HE       DLY  20   3.992   1.259   7.557
  169    HE3  DLY  20          2HE       DLY  20   2.722   0.134   8.007
  170    HZ1  DLY  20          1HZ       DLY  20   1.119   1.530   6.801
  171    HZ2  DLY  20          2HZ       DLY  20   2.321   2.635   6.418
  172    HZ3  DLY  20          3HZ       DLY  20   1.905   2.379   8.002
  173    H    DCY  21           H        DCY  21   2.848   0.991   0.881
  174    HA   DCY  21           HA       DCY  21   1.670   3.443   1.498
  175    HB2  DCY  21          1HB       DCY  21   1.518   1.743  -0.982
  176    HB3  DCY  21          2HB       DCY  21   0.598   3.227  -0.787
  177    H    DAR  22           H        DAR  22   4.070   2.630  -0.956
  178    HA   DAR  22           HA       DAR  22   4.009   5.275  -2.048
  179    HB2  DAR  22          1HB       DAR  22   6.119   3.149  -2.425
  180    HB3  DAR  22          2HB       DAR  22   5.937   4.610  -3.385
  181    HG2  DAR  22          1HG       DAR  22   4.007   2.304  -3.237
  182    HG3  DAR  22          2HG       DAR  22   5.057   2.711  -4.589
  183    HD2  DAR  22          1HD       DAR  22   2.801   4.430  -3.550
  184    HD3  DAR  22          2HD       DAR  22   2.734   3.415  -4.979
  185    HE   DAR  22           HE       DAR  22   4.845   5.386  -4.976
  186   HH11  DAR  22          1HH1      DAR  22   1.524   4.624  -6.026
  187   HH12  DAR  22          2HH1      DAR  22   1.453   5.886  -7.157
  188   HH21  DAR  22          1HH2      DAR  22   4.721   7.106  -6.600
  189   HH22  DAR  22          2HH2      DAR  22   3.305   7.269  -7.534
  190    H    DGL  23           H        DGL  23   5.831   3.694   0.459
  191    HA   DGL  23           HA       DGL  23   7.796   5.739   0.711
  192    HB2  DGL  23          1HB       DGL  23   8.061   3.438   1.583
  193    HB3  DGL  23          2HB       DGL  23   6.809   3.757   2.773
  194    HG2  DGL  23          1HG       DGL  23   8.919   3.947   3.858
  195    HG3  DGL  23          2HG       DGL  23   8.242   5.567   3.704
  196    H    DGL  24           H        DGL  24   4.711   5.079   2.335
  197    HA   DGL  24           HA       DGL  24   5.038   7.324   4.101
  198    HB2  DGL  24          1HB       DGL  24   2.745   5.409   3.769
  199    HB3  DGL  24          2HB       DGL  24   2.888   6.625   5.031
  200    HG2  DGL  24          1HG       DGL  24   4.805   4.350   4.606
  201    HG3  DGL  24          2HG       DGL  24   3.501   4.360   5.786
  202    H    SER  25           H        SER  25   3.093   6.685   1.189
  203    HA   SER  25           HA       SER  25   2.303   9.469   1.245
  204    HB2  SER  25          2HB       SER  25   1.765   7.284  -0.809
  205    HB3  SER  25          1HB       SER  25   1.314   8.977  -0.997
  206    HG   SER  25           HG       SER  25   3.926   8.689  -0.346
  207    H    ASP  26           H        ASP  26   0.693   9.861   2.619
  208    HA   ASP  26           HA       ASP  26  -1.259   7.898   3.324
  209    HB2  ASP  26          2HB       ASP  26  -1.213  10.856   3.996
  210    HB3  ASP  26          1HB       ASP  26  -2.348   9.691   4.648
  Start of MODEL   20
    1    H    ASN   1           H        ASN   1  -1.234   8.998   0.238
    2    HA   ASN   1           HA       ASN   1  -3.877   9.525  -0.683
    3    HB2  ASN   1          2HB       ASN   1  -1.797   7.550  -1.635
    4    HB3  ASN   1          1HB       ASN   1  -3.329   7.805  -2.455
    5   HD21  ASN   1          1HD2      ASN   1  -0.588   8.222  -3.404
    6   HD22  ASN   1          2HD2      ASN   1  -0.468   9.880  -3.835
    7    HA   PRO   2           HA       PRO   2  -5.734   6.289   1.917
    8    HB2  PRO   2          2HB       PRO   2  -8.240   7.346   0.785
    9    HB3  PRO   2          1HB       PRO   2  -7.744   7.224   2.477
   10    HG2  PRO   2          2HG       PRO   2  -7.892   9.588   1.242
   11    HG3  PRO   2          1HG       PRO   2  -6.626   9.239   2.432
   12    HD2  PRO   2          2HD       PRO   2  -6.474   9.218  -0.553
   13    HD3  PRO   2          1HD       PRO   2  -5.326   9.896   0.633
   14    H    GLU   3           H        GLU   3  -6.585   7.061  -1.428
   15    HA   GLU   3           HA       GLU   3  -7.936   4.649  -2.016
   16    HB2  GLU   3          2HB       GLU   3  -6.477   6.598  -3.796
   17    HB3  GLU   3          1HB       GLU   3  -7.398   5.239  -4.406
   18    HG2  GLU   3          2HG       GLU   3  -9.432   6.108  -3.548
   19    HG3  GLU   3          1HG       GLU   3  -8.582   7.349  -2.633
   20    H    LEU   4           H        LEU   4  -4.594   5.608  -2.119
   21    HA   LEU   4           HA       LEU   4  -3.577   3.261  -3.327
   22    HB2  LEU   4          2HB       LEU   4  -2.254   5.323  -3.184
   23    HB3  LEU   4          1HB       LEU   4  -2.286   5.228  -1.443
   24    HG   LEU   4           HG       LEU   4  -0.941   3.172  -1.521
   25   HD11  LEU   4          1HD1      LEU   4  -1.593   2.320  -3.685
   26   HD12  LEU   4          2HD1      LEU   4   0.159   2.503  -3.590
   27   HD13  LEU   4          3HD1      LEU   4  -0.805   3.684  -4.477
   28   HD21  LEU   4          1HD2      LEU   4   0.148   5.319  -1.235
   29   HD22  LEU   4          2HD2      LEU   4   0.264   5.520  -2.981
   30   HD23  LEU   4          3HD2      LEU   4   1.161   4.233  -2.179
   31    H    GLN   5           H        GLN   5  -3.823   4.329   0.054
   32    HA   GLN   5           HA       GLN   5  -2.805   2.005   1.221
   33    HB2  GLN   5          2HB       GLN   5  -4.772   3.983   2.363
   34    HB3  GLN   5          1HB       GLN   5  -3.962   2.735   3.303
   35    HG2  GLN   5          2HG       GLN   5  -1.795   3.719   2.734
   36    HG3  GLN   5          1HG       GLN   5  -2.616   4.974   1.808
   37   HE21  GLN   5          1HE2      GLN   5  -1.917   3.744   4.978
   38   HE22  GLN   5          2HE2      GLN   5  -2.405   5.152   5.834
   39    H    ARG   6           H        ARG   6  -6.111   2.732   0.293
   40    HA   ARG   6           HA       ARG   6  -7.363   0.479   1.397
   41    HB2  ARG   6          2HB       ARG   6  -8.013   2.102  -1.039
   42    HB3  ARG   6          1HB       ARG   6  -9.018   0.769  -0.495
   43    HG2  ARG   6          2HG       ARG   6  -9.406   1.904   1.618
   44    HG3  ARG   6          1HG       ARG   6  -8.350   3.224   1.106
   45    HD2  ARG   6          2HD       ARG   6 -10.757   3.704   0.813
   46    HD3  ARG   6          1HD       ARG   6  -9.835   3.794  -0.689
   47    HE   ARG   6           HE       ARG   6 -10.780   1.225  -0.540
   48   HH11  ARG   6          1HH1      ARG   6 -12.352   4.383  -0.498
   49   HH12  ARG   6          2HH1      ARG   6 -13.692   3.898  -1.428
   50   HH21  ARG   6          1HH2      ARG   6 -12.569   0.555  -1.789
   51   HH22  ARG   6          2HH2      ARG   6 -13.837   1.648  -2.177
   52    H    LYS   7           H        LYS   7  -5.758   0.896  -1.712
   53    HA   LYS   7           HA       LYS   7  -6.437  -1.693  -2.655
   54    HB2  LYS   7          2HB       LYS   7  -4.258   0.195  -3.563
   55    HB3  LYS   7          1HB       LYS   7  -4.714  -1.280  -4.407
   56    HG2  LYS   7          2HG       LYS   7  -6.526   1.080  -3.907
   57    HG3  LYS   7          1HG       LYS   7  -5.708   0.710  -5.426
   58    HD2  LYS   7          2HD       LYS   7  -6.953  -1.359  -5.640
   59    HD3  LYS   7          1HD       LYS   7  -7.693  -1.120  -4.063
   60    HE2  LYS   7          2HE       LYS   7  -9.228  -0.529  -5.870
   61    HE3  LYS   7          1HE       LYS   7  -8.838   0.853  -4.860
   62    HZ1  LYS   7          1HZ       LYS   7  -7.554   0.303  -7.496
   63    HZ2  LYS   7          2HZ       LYS   7  -7.352   1.662  -6.517
   64    HZ3  LYS   7          3HZ       LYS   7  -8.824   1.384  -7.229
   65    H    CYS   8           H        CYS   8  -3.903  -0.457  -0.699
   66    HA   CYS   8           HA       CYS   8  -2.194  -2.712  -0.739
   67    HB2  CYS   8          2HB       CYS   8  -2.732  -0.738   1.471
   68    HB3  CYS   8          1HB       CYS   8  -1.356  -1.821   1.405
   69    H    LYS   9           H        LYS   9  -4.798  -1.694   1.441
   70    HA   LYS   9           HA       LYS   9  -4.761  -3.946   3.136
   71    HB2  LYS   9          2HB       LYS   9  -7.031  -2.053   2.493
   72    HB3  LYS   9          1HB       LYS   9  -6.977  -3.157   3.862
   73    HG2  LYS   9          2HG       LYS   9  -5.124  -1.962   4.826
   74    HG3  LYS   9          1HG       LYS   9  -4.989  -0.939   3.397
   75    HD2  LYS   9          2HD       LYS   9  -6.103   0.282   5.169
   76    HD3  LYS   9          1HD       LYS   9  -7.244  -0.040   3.868
   77    HE2  LYS   9          2HE       LYS   9  -8.142  -1.940   5.145
   78    HE3  LYS   9          1HE       LYS   9  -7.001  -1.587   6.443
   79    HZ1  LYS   9          1HZ       LYS   9  -9.145   0.226   5.484
   80    HZ2  LYS   9          2HZ       LYS   9  -8.074   0.553   6.753
   81    HZ3  LYS   9          3HZ       LYS   9  -9.184  -0.697   6.889
   82    H    GLU  10           H        GLU  10  -6.223  -3.320   0.079
   83    HA   GLU  10           HA       GLU  10  -8.009  -5.514   0.006
   84    HB2  GLU  10          2HB       GLU  10  -8.282  -3.582  -1.431
   85    HB3  GLU  10          1HB       GLU  10  -6.714  -3.874  -2.157
   86    HG2  GLU  10          2HG       GLU  10  -7.546  -5.975  -3.083
   87    HG3  GLU  10          1HG       GLU  10  -9.134  -5.635  -2.395
   88    H    LEU  11           H        LEU  11  -4.764  -4.908  -1.224
   89    HA   LEU  11           HA       LEU  11  -4.362  -7.409  -2.481
   90    HB2  LEU  11          2HB       LEU  11  -3.162  -5.317  -3.009
   91    HB3  LEU  11          1HB       LEU  11  -2.387  -5.388  -1.455
   92    HG   LEU  11           HG       LEU  11  -1.203  -7.432  -2.081
   93   HD11  LEU  11          1HD1      LEU  11  -2.796  -8.382  -3.657
   94   HD12  LEU  11          2HD1      LEU  11  -1.210  -8.209  -4.408
   95   HD13  LEU  11          3HD1      LEU  11  -2.492  -7.059  -4.783
   96   HD21  LEU  11          1HD2      LEU  11  -0.889  -5.171  -4.047
   97   HD22  LEU  11          2HD2      LEU  11   0.310  -6.426  -3.730
   98   HD23  LEU  11          3HD2      LEU  11  -0.136  -5.290  -2.456
   99    H    DAS  12           H        DAS  12  -3.611  -6.130   0.692
  100    HA   DAS  12           HA       DAS  12  -2.923  -8.844   1.549
  101    HB2  DAS  12          1HB       DAS  12  -5.143  -8.092   2.369
  102    HB3  DAS  12          2HB       DAS  12  -4.373  -6.707   3.132
  103    H    THR  13           H        THR  13  -1.015  -9.021   2.577
  104    HA   THR  13           HA       THR  13   0.338  -6.508   3.240
  105    HB   THR  13           HB       THR  13   0.113  -8.133   5.152
  106    HG1  THR  13          1HG       THR  13   2.004  -6.686   4.779
  107   HG21  THR  13          1HG2      THR  13   1.484 -10.187   5.161
  108   HG22  THR  13          2HG2      THR  13   1.927  -9.889   3.480
  109   HG23  THR  13          3HG2      THR  13   0.253 -10.238   3.901
  110    H    ARG  14           H        ARG  14  -0.030  -8.457   0.810
  111    HA   ARG  14           HA       ARG  14   2.592  -9.223   0.018
  112    HB2  ARG  14          2HB       ARG  14   0.051  -8.940  -1.603
  113    HB3  ARG  14          1HB       ARG  14   1.533  -9.675  -2.191
  114    HG2  ARG  14          2HG       ARG  14  -0.142 -10.675   0.110
  115    HG3  ARG  14          1HG       ARG  14  -0.096 -11.355  -1.516
  116    HD2  ARG  14          2HD       ARG  14   2.221 -11.209   0.416
  117    HD3  ARG  14          1HD       ARG  14   1.287 -12.648   0.028
  118    HE   ARG  14           HE       ARG  14   2.090 -12.114  -2.358
  119   HH11  ARG  14          1HH1      ARG  14   4.024 -11.851   0.603
  120   HH12  ARG  14          2HH1      ARG  14   5.516 -12.002  -0.214
  121   HH21  ARG  14          1HH2      ARG  14   4.144 -12.331  -3.433
  122   HH22  ARG  14          2HH2      ARG  14   5.584 -12.319  -2.524
  123    HA   DPR  15           HA       DPR  15   3.285  -5.809  -3.008
  124    HB2  DPR  15          1HB       DPR  15   5.969  -6.166  -3.208
  125    HB3  DPR  15          2HB       DPR  15   4.811  -7.080  -4.180
  126    HG2  DPR  15          1HG       DPR  15   6.263  -7.885  -1.691
  127    HG3  DPR  15          2HG       DPR  15   5.938  -8.836  -3.150
  128    HD2  DPR  15          1HD       DPR  15   4.493  -9.089  -0.873
  129    HD3  DPR  15          2HD       DPR  15   3.801  -9.356  -2.483
  130    H    DGL  16           H        DGL  16   4.623  -6.595   0.080
  131    HA   DGL  16           HA       DGL  16   6.211  -4.336   0.608
  132    HB2  DGL  16          1HB       DGL  16   6.181  -6.299   2.121
  133    HB3  DGL  16          2HB       DGL  16   4.523  -5.919   2.570
  134    HG2  DGL  16          1HG       DGL  16   5.365  -3.699   3.401
  135    HG3  DGL  16          2HG       DGL  16   6.998  -4.290   3.139
  136    H    DAL  17           H        DAL  17   2.815  -5.003   0.952
  137    HA   DAL  17           HA       DAL  17   1.998  -2.831   2.438
  138    HB1  DAL  17          1HB       DAL  17  -0.220  -3.322   1.668
  139    HB2  DAL  17          2HB       DAL  17   0.650  -4.839   1.887
  140    HB3  DAL  17          3HB       DAL  17   0.417  -4.184   0.268
  141    H    DGL  18           H        DGL  18   1.970  -3.140  -1.100
  142    HA   DGL  18           HA       DGL  18   1.035  -0.523  -1.574
  143    HB2  DGL  18          1HB       DGL  18   0.899  -2.512  -3.119
  144    HB3  DGL  18          2HB       DGL  18   2.603  -2.299  -3.450
  145    HG2  DGL  18          1HG       DGL  18   0.586  -0.158  -4.042
  146    HG3  DGL  18          2HG       DGL  18   0.992  -1.422  -5.194
  147    H    DAR  19           H        DAR  19   4.304  -1.889  -1.491
  148    HA   DAR  19           HA       DAR  19   5.778   0.405  -2.205
  149    HB2  DAR  19          1HB       DAR  19   6.488  -1.823  -0.297
  150    HB3  DAR  19          2HB       DAR  19   7.617  -0.601  -0.848
  151    HG2  DAR  19          1HG       DAR  19   7.450  -1.373  -3.103
  152    HG3  DAR  19          2HG       DAR  19   6.247  -2.580  -2.627
  153    HD2  DAR  19          1HD       DAR  19   8.517  -3.524  -2.825
  154    HD3  DAR  19          2HD       DAR  19   7.876  -3.662  -1.186
  155    HE   DAR  19           HE       DAR  19   9.387  -1.292  -1.506
  156   HH11  DAR  19          1HH2      DAR  19  11.470  -1.088  -0.496
  157   HH12  DAR  19          2HH2      DAR  19  12.291  -2.475   0.037
  158   HH21  DAR  19          1HH1      DAR  19   9.815  -4.792  -1.029
  159   HH22  DAR  19          2HH1      DAR  19  11.341  -4.641  -0.308
  160    H    DLY  20           H        DLY  20   4.830  -0.818   0.939
  161    HA   DLY  20           HA       DLY  20   5.964   1.250   2.449
  162    HB2  DLY  20          1HB       DLY  20   5.475  -1.021   3.252
  163    HB3  DLY  20          2HB       DLY  20   3.764  -0.673   3.124
  164    HG2  DLY  20          1HG       DLY  20   3.854   0.900   4.911
  165    HG3  DLY  20          2HG       DLY  20   5.617   0.818   4.946
  166    HD2  DLY  20          1HD       DLY  20   4.585  -0.526   6.741
  167    HD3  DLY  20          2HD       DLY  20   5.531  -1.513   5.628
  168    HE2  DLY  20          1HE       DLY  20   3.448  -2.144   4.454
  169    HE3  DLY  20          2HE       DLY  20   2.522  -1.224   5.635
  170    HZ1  DLY  20          1HZ       DLY  20   3.485  -2.682   7.362
  171    HZ2  DLY  20          2HZ       DLY  20   4.165  -3.639   6.116
  172    HZ3  DLY  20          3HZ       DLY  20   2.501  -3.477   6.247
  173    H    DCY  21           H        DCY  21   2.766   0.823   1.006
  174    HA   DCY  21           HA       DCY  21   1.604   3.060   2.241
  175    HB2  DCY  21          1HB       DCY  21   0.985   1.812  -0.418
  176    HB3  DCY  21          2HB       DCY  21   0.063   3.133   0.292
  177    H    DAR  22           H        DAR  22   3.487   2.792  -0.776
  178    HA   DAR  22           HA       DAR  22   3.138   5.601  -1.254
  179    HB2  DAR  22          1HB       DAR  22   4.684   5.384  -3.119
  180    HB3  DAR  22          2HB       DAR  22   3.526   4.069  -3.155
  181    HG2  DAR  22          1HG       DAR  22   5.145   2.546  -2.267
  182    HG3  DAR  22          2HG       DAR  22   6.313   3.851  -2.085
  183    HD2  DAR  22          1HD       DAR  22   6.838   2.611  -4.062
  184    HD3  DAR  22          2HD       DAR  22   6.248   4.203  -4.527
  185    HE   DAR  22           HE       DAR  22   4.230   2.139  -4.492
  186   HH11  DAR  22          1HH1      DAR  22   6.607   3.850  -6.483
  187   HH12  DAR  22          2HH1      DAR  22   5.904   3.346  -7.953
  188   HH21  DAR  22          1HH2      DAR  22   3.400   1.419  -6.395
  189   HH22  DAR  22          2HH2      DAR  22   4.037   1.871  -7.935
  190    H    DGL  23           H        DGL  23   5.268   3.702   0.582
  191    HA   DGL  23           HA       DGL  23   7.376   5.532   1.041
  192    HB2  DGL  23          1HB       DGL  23   7.466   3.151   1.664
  193    HB3  DGL  23          2HB       DGL  23   6.161   3.394   2.809
  194    HG2  DGL  23          1HG       DGL  23   8.201   3.254   4.015
  195    HG3  DGL  23          2HG       DGL  23   7.600   4.907   4.094
  196    H    DGL  24           H        DGL  24   4.452   4.764   2.874
  197    HA   DGL  24           HA       DGL  24   4.606   6.874   4.731
  198    HB2  DGL  24          1HB       DGL  24   2.237   5.293   3.745
  199    HB3  DGL  24          2HB       DGL  24   2.210   6.387   5.117
  200    HG2  DGL  24          1HG       DGL  24   3.758   5.004   6.321
  201    HG3  DGL  24          2HG       DGL  24   3.916   3.929   4.929
  202    H    SER  25           H        SER  25   2.483   6.447   1.925
  203    HA   SER  25           HA       SER  25   2.508   9.273   1.396
  204    HB2  SER  25          2HB       SER  25   2.584   7.626  -0.469
  205    HB3  SER  25          1HB       SER  25   1.017   7.000   0.033
  206    HG   SER  25           HG       SER  25   1.438   8.846  -1.680
  207    H    ASP  26           H        ASP  26   0.353  10.267   0.960
  208    HA   ASP  26           HA       ASP  26  -1.272   9.883   3.376
  209    HB2  ASP  26          2HB       ASP  26  -0.199  12.120   2.855
  210    HB3  ASP  26          1HB       ASP  26  -1.251  12.226   1.454