*HEADER    ANTIMICROBIAL PROTEIN                   26-JUN-19   6PIP              
*TITLE     NMR SOLUTION STRUCTURE OF CYCLIC TACHYPLESIN III                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TACHYPLESIN-3;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: TACHYPLESIN III;                                            
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: TACHYPLEUS GIGAS;                               
*SOURCE   4 ORGANISM_COMMON: SOUTHEAST ASIAN HORSESHOE CRAB;                     
*SOURCE   5 ORGANISM_TAXID: 6852                                                 
*KEYWDS    DEFENSE PEPTIDE, CYCLIC PEPTIDE, ANTIMICROBIAL PROTEIN                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    P.J.HARVEY,S.TROEIRA HENRIQUES,F.VERNEN                               
*REVDAT   1   11-SEP-19 6PIP    0                                                
# Restraints file 1: cT3restraintspdb.tbl
!distance restraints
assign (resid   8 and name   HA)   (resid   9 and name   HN)   2.360    0.560    0.560  
assign (resid   9 and name   HA)   (resid  10 and name   HN)   2.540    0.740    0.740  
assign (resid   9 and name   HN)   (resid  10 and name   HN)   2.690    0.890    0.890  
assign (resid  12 and name   HA)   (resid  13 and name   HN)   2.195    0.395    0.395  
assign (resid  15 and name   HA)   (resid  16 and name   HN)   2.225    0.425    0.425  
assign (resid  16 and name   HA)   (resid  17 and name   HN)   2.215    0.415    0.415  
assign (resid  17 and name   HA)   (resid  18 and name   HN)   2.310    0.510    0.510  
assign (resid   1 and name   HN)   (resid  18 and name  HA1)   2.300    0.500    0.500  
assign (resid   2 and name   HA)   (resid   3 and name   HN)   2.230    0.430    0.430  
assign (resid   3 and name   HA)   (resid   4 and name   HN)   2.185    0.385    0.385  
assign (resid   5 and name   HA)   (resid   6 and name   HN)   2.190    0.390    0.390  
assign (resid   7 and name   HA)   (resid   8 and name   HN)   2.190    0.390    0.390  
assign (resid   1 and name   HN)   (resid   1 and name  HB2)   2.815    1.015    1.015  
assign (resid   1 and name   HN)   (resid   1 and name  HB1)   2.815    1.015    1.015  
assign (resid  15 and name   HN)   (resid  15 and name  HB2)   2.760    0.960    0.960  
assign (resid   1 and name   HN)   (resid   1 and name  HG2)   2.805    1.005    1.005  
assign (resid  15 and name   HN)   (resid  15 and name  HB1)   2.760    0.960    0.960  
assign (resid   1 and name   HN)   (resid   1 and name  HG1)   2.805    1.005    1.005  
assign (resid   1 and name   HN)   (resid  18 and name  HA2)   2.710    0.910    0.910  
assign (resid   1 and name   HN)   (resid   2 and name   HN)   2.480    0.680    0.680  
assign (resid   1 and name   HN)   (resid  17 and name   HN)   3.560    1.760    1.760  
assign (resid   4 and name   HN)   (resid  17 and name   HN)   3.650    1.850    1.850  
assign (resid  13 and name   HN)   (resid  15 and name   HN)   3.405    1.605    1.605  
assign (resid   1 and name  HB1)   (resid   2 and name   HN)   3.350    1.550    1.550  
assign (resid   1 and name  HB2)   (resid   2 and name   HN)   3.350    1.550    1.550  
assign (resid   2 and name   HN)   (resid  17 and name  HB2)   3.635    1.835    1.835  
assign (resid   2 and name   HN)   (resid  17 and name  HB1)   3.635    1.835    1.835  
assign (resid   2 and name   HN)   (resid   2 and name  HB2)   2.530    0.730    0.730  
assign (resid   2 and name   HN)   (resid   2 and name  HB1)   2.530    0.730    0.730  
assign (resid   2 and name   HN)   (resid  18 and name  HA2)   3.640    1.840    1.840  
assign (resid   2 and name   HN)   (resid  18 and name  HA1)   2.960    1.160    1.160  
assign (resid   2 and name   HN)   (resid  16 and name   HA)   3.650    1.850    1.850  
assign (resid   2 and name   HN)   (resid   2 and name  HD1)   3.355    1.555    1.555  
assign (resid   2 and name   HN)   (resid  17 and name   HN)   2.935    1.135    1.135  
assign (resid   2 and name   HN)   (resid   3 and name   HN)   3.230    1.430    1.430  
assign (resid   2 and name   HN)   (resid  18 and name   HN)   3.445    1.645    1.645  
assign (resid   2 and name  HE1)   (resid   4 and name  HD#)   3.195    1.395    1.395  
assign (resid   2 and name  HD1)   (resid   3 and name   HN)   3.175    1.375    1.375  
assign (resid   2 and name  HD1)   (resid   4 and name  HB1)   3.230    1.430    1.430  
assign (resid   2 and name  HB2)   (resid   3 and name   HN)   3.260    1.460    1.460  
assign (resid   2 and name  HB1)   (resid   3 and name   HN)   3.260    1.460    1.460  
assign (resid   2 and name  HB2)   (resid  17 and name   HN)   3.360    1.560    1.560  
assign (resid   2 and name  HB1)   (resid  17 and name   HN)   3.360    1.560    1.560  
assign (resid   3 and name   HN)   (resid   3 and name  HB2)   2.530    0.730    0.730  
assign (resid   3 and name   HN)   (resid   3 and name  HB1)   2.885    1.085    1.085  
assign (resid   3 and name   HN)   (resid   4 and name  HD#)   3.450    1.650    1.650  
assign (resid   3 and name   HN)   (resid   4 and name   HN)   3.210    1.410    1.410  
assign (resid   3 and name  HB1)   (resid   4 and name   HN)   2.690    0.890    0.890  
assign (resid   4 and name   HN)   (resid   4 and name  HB1)   2.720    0.920    0.920  
assign (resid   4 and name   HN)   (resid   4 and name  HD#)   2.755    0.955    0.955  
assign (resid   5 and name   HA)   (resid   5 and name  HG2)   2.950    1.150    1.150  
assign (resid   5 and name   HA)   (resid   5 and name  HG1)   2.950    1.150    1.150  
assign (resid   6 and name HG2#)   (resid  16 and name   HN)   3.615    1.815    1.815  
assign (resid   4 and name  HB2)   (resid   5 and name   HN)   2.300    0.500    0.500  
assign (resid  10 and name   HN)   (resid  10 and name  HA2)   2.375    0.575    0.575  
assign (resid   4 and name  HD#)   (resid   5 and name   HN)   3.000    1.200    1.200  
assign (resid   8 and name  HD#)   (resid  10 and name   HN)   3.650    1.850    1.850  
assign (resid  13 and name  HD#)   (resid  16 and name   HN)   3.650    1.850    1.850  
assign (resid   8 and name   HN)   (resid  10 and name   HN)   2.965    1.165    1.165  
assign (resid  11 and name   HA)   (resid  11 and name HG11)   2.970    1.170    1.170  
assign (resid  11 and name   HA)   (resid  11 and name HG12)   2.915    1.115    1.115  
assign (resid  11 and name   HA)   (resid  11 and name HD1#)   2.900    1.100    1.100  
assign (resid   6 and name   HA)   (resid   6 and name HG2#)   2.575    0.775    0.775  
assign (resid  11 and name   HA)   (resid  11 and name HG2#)   2.680    0.880    0.880  
assign (resid   6 and name   HN)   (resid   6 and name HG2#)   2.730    0.930    0.930  
assign (resid   6 and name   HN)   (resid   6 and name   HB)   2.645    0.845    0.845  
assign (resid   5 and name  HG2)   (resid   6 and name   HN)   3.005    1.205    1.205  
assign (resid   5 and name  HG1)   (resid   6 and name   HN)   3.005    1.205    1.205  
assign (resid   6 and name   HN)   (resid  12 and name  HB1)   3.235    1.435    1.435  
assign (resid   5 and name  HD2)   (resid   6 and name   HN)   3.650    1.850    1.850  
assign (resid   5 and name  HD1)   (resid   6 and name   HN)   3.650    1.850    1.850  
assign (resid   6 and name   HN)   (resid  12 and name   HA)   3.370    1.570    1.570  
assign (resid   6 and name   HN)   (resid  13 and name  HD#)   3.230    1.430    1.430  
assign (resid   6 and name   HN)   (resid   7 and name   HN)   3.085    1.285    1.285  
assign (resid   6 and name   HN)   (resid  13 and name   HN)   2.560    0.760    0.760  
assign (resid   7 and name   HA)   (resid   8 and name  HB2)   3.330    1.530    1.530  
assign (resid   7 and name   HA)   (resid   8 and name  HB1)   3.490    1.690    1.690  
assign (resid   7 and name   HA)   (resid  12 and name  HB1)   3.250    1.450    1.450  
assign (resid   6 and name HG1#)   (resid   7 and name   HN)   2.735    0.935    0.935  
assign (resid  14 and name   HN)   (resid  14 and name  HB1)   2.435    0.635    0.635  
assign (resid  14 and name   HN)   (resid  14 and name  HB2)   2.435    0.635    0.635  
assign (resid   7 and name   HN)   (resid   7 and name  HB1)   2.905    1.105    1.105  
assign (resid   7 and name  HB1)   (resid   8 and name   HN)   2.725    0.925    0.925  
assign (resid   8 and name   HN)   (resid   8 and name  HB1)   2.475    0.675    0.675  
assign (resid  13 and name  HD#)   (resid  14 and name   HN)   3.025    1.225    1.225  
assign (resid   7 and name   HN)   (resid  13 and name   HN)   3.530    1.730    1.730  
assign (resid   8 and name   HN)   (resid   9 and name  HB2)   3.565    1.765    1.765  
assign (resid   8 and name   HN)   (resid  11 and name HG11)   3.560    1.760    1.760  
assign (resid   8 and name   HN)   (resid  11 and name   HB)   3.090    1.290    1.290  
assign (resid   8 and name   HN)   (resid  12 and name  HB1)   3.635    1.835    1.835  
assign (resid   8 and name   HN)   (resid  12 and name   HA)   2.750    0.950    0.950  
assign (resid   8 and name   HN)   (resid   8 and name  HD#)   3.095    1.295    1.295  
assign (resid   8 and name   HN)   (resid  13 and name  HD#)   3.360    1.560    1.560  
assign (resid   8 and name   HN)   (resid  11 and name   HN)   2.600    0.800    0.800  
assign (resid   8 and name  HD#)   (resid   9 and name  HB2)   2.945    1.145    1.145  
assign (resid   8 and name  HE#)   (resid   9 and name  HB2)   3.115    1.315    1.315  
assign (resid   8 and name  HD#)   (resid   9 and name  HG2)   3.175    1.375    1.375  
assign (resid   8 and name  HD#)   (resid  11 and name HD1#)   2.870    1.070    1.070  
assign (resid   8 and name  HE#)   (resid  11 and name HD1#)   2.900    1.100    1.100  
assign (resid   8 and name  HB1)   (resid  11 and name HD1#)   2.865    1.065    1.065  
assign (resid   9 and name   HN)   (resid   9 and name  HG1)   2.885    1.085    1.085  
assign (resid   9 and name   HN)   (resid   9 and name  HG2)   2.885    1.085    1.085  
assign (resid   8 and name  HB2)   (resid   9 and name   HN)   3.410    1.610    1.610  
assign (resid   8 and name  HB1)   (resid   9 and name   HN)   3.595    1.795    1.795  
assign (resid   9 and name   HN)   (resid   9 and name   HA)   2.265    0.465    0.465  
assign (resid   8 and name  HD#)   (resid   9 and name   HN)   3.010    1.210    1.210  
assign (resid   9 and name   HN)   (resid  11 and name   HN)   3.240    1.440    1.440  
assign (resid  15 and name  HB1)   (resid  16 and name   HN)   3.065    1.265    1.265  
assign (resid  15 and name  HB2)   (resid  16 and name   HN)   3.065    1.265    1.265  
assign (resid   9 and name  HB1)   (resid  10 and name   HN)   3.285    1.485    1.485  
assign (resid   7 and name  HB1)   (resid  10 and name   HN)   3.085    1.285    1.285  
assign (resid  10 and name   HN)   (resid  11 and name   HN)   2.600    0.800    0.800  
assign (resid  11 and name   HA)   (resid  12 and name  HB2)   3.390    1.590    1.590  
assign (resid  11 and name   HN)   (resid  11 and name HG2#)   2.975    1.175    1.175  
assign (resid  11 and name   HN)   (resid  11 and name HG12)   2.905    1.105    1.105  
assign (resid  11 and name   HN)   (resid  11 and name HG11)   2.790    0.990    0.990  
assign (resid  11 and name   HN)   (resid  11 and name   HB)   2.495    0.695    0.695  
assign (resid   9 and name  HB1)   (resid  11 and name   HN)   3.360    1.560    1.560  
assign (resid   7 and name  HB1)   (resid  11 and name   HN)   3.380    1.580    1.580  
assign (resid   8 and name  HB1)   (resid  11 and name   HN)   3.160    1.360    1.360  
assign (resid   9 and name   HA)   (resid  11 and name   HN)   3.355    1.555    1.555  
assign (resid   8 and name   HA)   (resid  11 and name   HN)   3.445    1.645    1.645  
assign (resid   7 and name   HA)   (resid  11 and name   HN)   3.515    1.715    1.715  
assign (resid   8 and name  HD#)   (resid  11 and name   HN)   3.470    1.670    1.670  
assign (resid  11 and name   HN)   (resid  12 and name   HN)   3.255    1.455    1.455  
assign (resid  11 and name HG2#)   (resid  12 and name   HA)   3.300    1.500    1.500  
assign (resid  11 and name HG2#)   (resid  12 and name   HN)   2.660    0.860    0.860  
assign (resid  11 and name HG12)   (resid  12 and name   HN)   3.525    1.725    1.725  
assign (resid  11 and name HG11)   (resid  12 and name   HN)   3.415    1.615    1.615  
assign (resid  11 and name   HB)   (resid  12 and name   HN)   3.130    1.330    1.330  
assign (resid  12 and name   HN)   (resid  12 and name  HB1)   2.825    1.025    1.025  
assign (resid  12 and name   HN)   (resid  12 and name  HB2)   2.495    0.695    0.695  
assign (resid  12 and name  HB1)   (resid  13 and name   HN)   2.610    0.810    0.810  
assign (resid   4 and name   HA)   (resid   6 and name HG2#)   3.600    1.800    1.800  
assign (resid   6 and name HG2#)   (resid  13 and name   HN)   3.475    1.675    1.675  
assign (resid  11 and name HG2#)   (resid  13 and name   HN)   3.630    1.830    1.830  
assign (resid   6 and name   HB)   (resid  13 and name   HN)   3.010    1.210    1.210  
assign (resid  13 and name   HN)   (resid  13 and name  HB1)   2.820    1.020    1.020  
assign (resid  13 and name   HN)   (resid  13 and name  HB2)   2.925    1.125    1.125  
assign (resid   6 and name   HA)   (resid  13 and name   HN)   3.460    1.660    1.660  
assign (resid   5 and name   HA)   (resid  13 and name   HN)   3.225    1.425    1.425  
assign (resid   7 and name   HA)   (resid  13 and name   HN)   2.730    0.930    0.930  
assign (resid  13 and name   HN)   (resid  13 and name  HD#)   2.695    0.895    0.895  
assign (resid  14 and name   HN)   (resid  14 and name  HG2)   3.285    1.485    1.485  
assign (resid  14 and name   HN)   (resid  14 and name  HG1)   3.285    1.485    1.485  
assign (resid  13 and name  HB2)   (resid  14 and name   HN)   2.440    0.640    0.640  
assign (resid   4 and name  HD#)   (resid  17 and name   HN)   3.325    1.525    1.525  
assign (resid  12 and name   HA)   (resid  13 and name  HD#)   2.840    1.040    1.040  
assign (resid   7 and name   HA)   (resid  13 and name  HD#)   3.255    1.455    1.455  
assign (resid   3 and name   HA)   (resid   4 and name  HD#)   2.790    0.990    0.990  
assign (resid   4 and name  HD#)   (resid   5 and name   HA)   3.290    1.490    1.490  
assign (resid  13 and name  HD#)   (resid  15 and name   HA)   3.105    1.305    1.305  
assign (resid  11 and name   HA)   (resid  13 and name  HD#)   3.500    1.700    1.700  
assign (resid   4 and name  HD#)   (resid   6 and name   HA)   3.330    1.530    1.530  
assign (resid  13 and name  HD#)   (resid  15 and name  HD2)   3.650    1.850    1.850  
assign (resid  13 and name  HD#)   (resid  15 and name  HD1)   3.650    1.850    1.850  
assign (resid   6 and name   HB)   (resid  13 and name  HD#)   2.885    1.085    1.085  
assign (resid  13 and name  HD#)   (resid  15 and name  HB2)   3.040    1.240    1.240  
assign (resid  13 and name  HD#)   (resid  15 and name  HB1)   3.040    1.240    1.240  
assign (resid  11 and name HG2#)   (resid  13 and name  HD#)   2.465    0.665    0.665  
assign (resid  14 and name   HA)   (resid  15 and name   HN)   2.545    0.745    0.745  
assign (resid  17 and name   HN)   (resid  17 and name  HG2)   3.420    1.620    1.620  
assign (resid  17 and name   HN)   (resid  17 and name  HG1)   3.420    1.620    1.620  
assign (resid  17 and name   HN)   (resid  17 and name  HB2)   2.770    0.970    0.970  
assign (resid  17 and name   HN)   (resid  17 and name  HB1)   2.770    0.970    0.970  
assign (resid  16 and name  HB1)   (resid  17 and name   HN)   2.735    0.935    0.935  
assign (resid  17 and name   HN)   (resid  18 and name   HN)   3.275    1.475    1.475  
assign (resid  17 and name  HB2)   (resid  18 and name   HN)   3.320    1.520    1.520  
assign (resid  17 and name  HB1)   (resid  18 and name   HN)   3.320    1.520    1.520  
assign (resid  18 and name   HN)   (resid  18 and name  HA2)   2.330    0.530    0.530  
assign (resid  17 and name   HA)   (resid  17 and name  HG2)   3.020    1.220    1.220  
assign (resid  17 and name   HA)   (resid  17 and name  HG1)   3.020    1.220    1.220  
assign (resid  10 and name  HA1)   (resid  11 and name HG11)   2.875    1.075    1.075  
assign (resid   5 and name  HB1)   (resid  12 and name  HB1)   3.645    1.845    1.845  
assign (resid   5 and name  HG2)   (resid  12 and name  HB1)   3.060    1.260    1.260  
assign (resid   5 and name  HG1)   (resid  12 and name  HB1)   3.060    1.260    1.260  
assign (resid   3 and name  HB1)   (resid  14 and name  HG2)   3.130    1.330    1.330  
assign (resid   3 and name  HB1)   (resid  14 and name  HG1)   3.130    1.330    1.330  
assign (resid  11 and name   HB)   (resid  11 and name HD1#)   2.760    0.960    0.960  
assign (resid   4 and name  HD#)   (resid   6 and name HG2#)   2.650    0.850    0.850  
assign (resid   2 and name   HN)   (resid  16 and name  HB1)   3.530    1.730    1.730  
assign (resid   2 and name  HD1)   (resid   3 and name  HB2)   3.410    1.610    1.610  
assign (resid   2 and name   HA)   (resid   2 and name  HD1)   2.930    1.130    1.130  
assign (resid   2 and name  HD1)   (resid   3 and name   HA)   3.550    1.750    1.750  
assign (resid   2 and name  HD1)   (resid   4 and name  HD#)   3.210    1.410    1.410  
assign (resid   5 and name   HA)   (resid   5 and name  HD2)   3.650    1.850    1.850  
assign (resid   5 and name   HA)   (resid   5 and name  HD1)   3.650    1.850    1.850  
assign (resid   8 and name  HD#)   (resid   9 and name  HB1)   3.575    1.775    1.775  
assign (resid   8 and name  HD#)   (resid   9 and name  HG1)   3.175    1.375    1.375  
assign (resid   8 and name   HA)   (resid   8 and name  HD#)   2.650    0.850    0.850  
assign (resid   8 and name   HA)   (resid   8 and name  HE#)   3.510    1.710    1.710  
assign (resid   8 and name  HB1)   (resid  12 and name   HA)   3.540    1.740    1.740  
assign (resid  15 and name   HA)   (resid  15 and name  HD2)   3.650    1.850    1.850  
assign (resid  15 and name   HA)   (resid  15 and name  HD1)   3.650    1.850    1.850  
assign (resid   5 and name  HB2)   (resid  12 and name  HB1)   3.645    1.845    1.845  
assign (resid   9 and name  HB2)   (resid  11 and name HD1#)   2.555    0.755    0.755  
assign (resid   8 and name   HA)   (resid  11 and name HD1#)   3.650    1.850    1.850  
assign (resid   1 and name   HN)   (resid   1 and name  HB#)   2.435    0.635    0.635  
assign (resid   1 and name   HN)   (resid   1 and name  HG#)   2.480    0.680    0.680  
assign (resid   1 and name   HN)   (resid  17 and name  HB#)   3.570    1.770    1.770  
assign (resid   1 and name   HA)   (resid   1 and name  HG#)   2.760    0.960    0.960  
assign (resid   1 and name  HB#)   (resid   2 and name   HN)   3.000    1.200    1.200  
assign (resid   1 and name  HG#)   (resid   2 and name   HN)   3.130    1.330    1.330  
assign (resid   2 and name   HN)   (resid  17 and name  HB#)   3.245    1.445    1.445  
assign (resid   2 and name  HB#)   (resid   3 and name   HN)   2.895    1.095    1.095  
assign (resid   2 and name  HB#)   (resid  17 and name   HN)   2.945    1.145    1.145  
assign (resid   5 and name   HN)   (resid   5 and name  HB#)   2.455    0.655    0.655  
assign (resid   5 and name   HN)   (resid   5 and name  HG#)   3.145    1.345    1.345  
assign (resid   5 and name   HA)   (resid   5 and name  HD#)   3.325    1.525    1.525  
assign (resid   5 and name  HB#)   (resid   5 and name  HG#)   2.010    0.210    0.210  
assign (resid   5 and name  HB#)   (resid   6 and name   HN)   3.060    1.260    1.260  
assign (resid   5 and name  HG#)   (resid  12 and name  HB1)   2.775    0.975    0.975  
assign (resid   8 and name  HD#)   (resid   9 and name  HG#)   2.790    0.990    0.990  
assign (resid   8 and name  HE#)   (resid   9 and name  HG#)   3.140    1.340    1.340  
assign (resid   8 and name  HE#)   (resid   9 and name  HD#)   2.705    0.905    0.905  
assign (resid   9 and name   HN)   (resid   9 and name  HG#)   2.605    0.805    0.805  
assign (resid   9 and name   HA)   (resid   9 and name  HG#)   2.735    0.935    0.935  
assign (resid   9 and name  HD#)   (resid  11 and name HD1#)   2.950    1.150    1.150  
assign (resid  13 and name  HD#)   (resid  15 and name  HB#)   2.700    0.900    0.900  
assign (resid  13 and name  HD#)   (resid  15 and name  HD#)   3.280    1.480    1.480  
assign (resid  14 and name  HB#)   (resid  14 and name  HG#)   2.055    0.255    0.255  
assign (resid  14 and name  HB#)   (resid  14 and name  HD#)   2.545    0.745    0.745  
assign (resid  14 and name  HD#)   (resid  15 and name   HN)   3.570    1.770    1.770  
assign (resid  15 and name   HN)   (resid  15 and name  HB#)   2.485    0.685    0.685  
assign (resid  15 and name   HA)   (resid  15 and name  HD#)   3.225    1.425    1.425  
assign (resid  15 and name  HB#)   (resid  16 and name   HN)   2.730    0.930    0.930  
assign (resid  15 and name  HG#)   (resid  16 and name   HN)   3.100    1.300    1.300  
assign (resid  17 and name   HN)   (resid  17 and name  HG#)   3.040    1.240    1.240  
assign (resid  17 and name  HB#)   (resid  17 and name   HE)   3.380    1.580    1.580  
!dihedral restraints
assign (resid  17 and name  HG#)   (resid  18 and name   HN)   3.215    1.415    1.415  
assign (resid 1     and name C    ) (resid 2     and name N    ) (resid 2     and name CA   ) (resid 2     and name C    )    1.0  -90.0   30.0 2
assign (resid 2     and name N    ) (resid 2     and name CA   ) (resid 2     and name C    ) (resid 3     and name N    )    1.0  130.0   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 -130.0   20.0 2
assign (resid 3     and name N    ) (resid 3     and name CA   ) (resid 3     and name C    ) (resid 4     and name N    )    1.0  150.0   30.0 2
assign (resid 3     and name C    ) (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    )    1.0 -120.0   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  140.0   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 -110.0   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  130.0   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 -100.0   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  130.0   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 -130.0   20.0 2
assign (resid 7     and name N    ) (resid 7     and name CA   ) (resid 7     and name C    ) (resid 8     and name N    )    1.0  150.0   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 -125.0   25.0 2
assign (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    ) (resid 9     and name N    )    1.0  120.0   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   50.0   20.0 2
assign (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name C    ) (resid 10    and name N    )    1.0   40.0   20.0 2
assign (resid 9     and name C    ) (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    )    1.0   80.0   20.0 2
assign (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    ) (resid 11    and name N    )    1.0   -0.0   30.0 2
assign (resid 10    and name C    ) (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    )    1.0 -110.0   30.0 2
assign (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    ) (resid 12    and name N    )    1.0  130.0   30.0 2
assign (resid 11    and name C    ) (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name C    )    1.0 -120.0   30.0 2
assign (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name C    ) (resid 13    and name N    )    1.0  140.0   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 -120.0   30.0 2
assign (resid 13    and name N    ) (resid 13    and name CA   ) (resid 13    and name C    ) (resid 14    and name N    )    1.0  140.0   30.0 2
assign (resid 13    and name C    ) (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name C    )    1.0 -100.0   30.0 2
assign (resid 14    and name N    ) (resid 14    and name CA   ) (resid 14    and name C    ) (resid 15    and name N    )    1.0  120.0   30.0 2
assign (resid 14    and name C    ) (resid 15    and name N    ) (resid 15    and name CA   ) (resid 15    and name C    )    1.0 -110.0   30.0 2
assign (resid 15    and name N    ) (resid 15    and name CA   ) (resid 15    and name C    ) (resid 16    and name N    )    1.0  140.0   30.0 2
assign (resid 15    and name C    ) (resid 16    and name N    ) (resid 16    and name CA   ) (resid 16    and name C    )    1.0 -130.0   20.0 2
assign (resid 16    and name N    ) (resid 16    and name CA   ) (resid 16    and name C    ) (resid 17    and name N    )    1.0  140.0   30.0 2
assign (resid 16    and name C    ) (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name C    )    1.0  -90.0   40.0 2
assign (resid 17    and name N    ) (resid 17    and name CA   ) (resid 17    and name C    ) (resid 18    and name N    )    1.0  130.0   40.0 2
assign (resid 3     and name N    ) (resid 3     and name CA   ) (resid 3     and name CB   ) (resid 3     and name SG   )    1.0  -60.0   30.0 2
assign (resid 7     and name N    ) (resid 7     and name CA   ) (resid 7     and name CB   ) (resid 7     and name SG   )    1.0  -60.0   30.0 2
assign (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name CB   ) (resid 9     and name CG   )    1.0  -60.0   30.0 2
assign (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name CB   ) (resid 12    and name SG   )    1.0  -60.0   30.0 2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           HN       LYS   1 -11.922   1.124   0.962
    2    HA   LYS   1           HA       LYS   1 -11.624  -1.408   2.396
    3    HB2  LYS   1          2HB       LYS   1 -13.508  -2.370   1.132
    4    HB3  LYS   1          1HB       LYS   1 -14.020  -1.044   2.157
    5    HG2  LYS   1          2HG       LYS   1 -14.165   0.422   0.221
    6    HG3  LYS   1          1HG       LYS   1 -13.563  -0.870  -0.819
    7    HD2  LYS   1          2HD       LYS   1 -15.500  -2.212  -0.392
    8    HD3  LYS   1          1HD       LYS   1 -16.076  -1.097   0.841
    9    HE2  LYS   1          2HE       LYS   1 -17.345  -0.782  -1.189
   10    HE3  LYS   1          1HE       LYS   1 -16.341   0.632  -0.901
   11    HZ1  LYS   1          1HZ       LYS   1 -14.765  -0.235  -2.580
   12    HZ2  LYS   1          2HZ       LYS   1 -16.282   0.018  -3.209
   13    HZ3  LYS   1          3HZ       LYS   1 -15.794  -1.542  -2.862
   14    H    TRP   2           HN       TRP   2 -10.214   0.426   0.275
   15    HA   TRP   2           HA       TRP   2  -9.865  -1.598  -1.818
   16    HB2  TRP   2          2HB       TRP   2 -10.398   0.845  -2.368
   17    HB3  TRP   2          1HB       TRP   2  -8.813   1.217  -1.713
   18    HD1  TRP   2          1HD       TRP   2  -6.707  -0.246  -3.091
   19    HE1  TRP   2          1HE       TRP   2  -6.440  -0.513  -5.639
   20    HE3  TRP   2          3HE       TRP   2 -11.499   0.835  -4.514
   21    HZ2  TRP   2          2HZ       TRP   2  -8.052  -0.250  -7.951
   22    HZ3  TRP   2          3HZ       TRP   2 -12.048   0.816  -6.915
   23    HH2  TRP   2          2HH       TRP   2 -10.362   0.287  -8.590
   24    H    CYS   3           HN       CYS   3  -8.077  -2.829  -1.672
   25    HA   CYS   3           HA       CYS   3  -5.905  -1.844   0.012
   26    HB2  CYS   3          2HB       CYS   3  -6.628  -4.671  -0.777
   27    HB3  CYS   3          1HB       CYS   3  -5.222  -4.217   0.172
   28    H    PHE   4           HN       PHE   4  -4.128  -1.278  -0.932
   29    HA   PHE   4           HA       PHE   4  -3.551  -2.423  -3.510
   30    HB2  PHE   4          2HB       PHE   4  -2.772  -0.207  -4.352
   31    HB3  PHE   4          1HB       PHE   4  -4.493  -0.268  -4.048
   32    HD1  PHE   4          1HD       PHE   4  -5.403   0.909  -2.001
   33    HD2  PHE   4          2HD       PHE   4  -1.384   1.378  -3.321
   34    HE1  PHE   4          1HE       PHE   4  -5.233   2.995  -0.726
   35    HE2  PHE   4          2HE       PHE   4  -1.208   3.465  -2.029
   36    HZ   PHE   4           HZ       PHE   4  -3.131   4.276  -0.731
   37    H    ARG   5           HN       ARG   5  -1.393  -2.497  -4.048
   38    HA   ARG   5           HA       ARG   5   0.270  -2.937  -1.743
   39    HB2  ARG   5          2HB       ARG   5   0.263  -4.583  -3.527
   40    HB3  ARG   5          1HB       ARG   5   0.770  -3.365  -4.687
   41    HG2  ARG   5          2HG       ARG   5   2.895  -3.130  -3.525
   42    HG3  ARG   5          1HG       ARG   5   2.380  -4.324  -2.335
   43    HD2  ARG   5          2HD       ARG   5   2.216  -6.009  -4.061
   44    HD3  ARG   5          1HD       ARG   5   2.646  -4.813  -5.284
   45    HE   ARG   5           HE       ARG   5   4.752  -4.580  -3.913
   46   HH11  ARG   5          1HH1      ARG   5   3.059  -7.642  -4.458
   47   HH12  ARG   5          2HH1      ARG   5   4.412  -8.624  -4.217
   48   HH21  ARG   5          1HH2      ARG   5   6.653  -5.935  -3.590
   49   HH22  ARG   5          2HH2      ARG   5   6.524  -7.619  -3.694
   50    H    VAL   6           HN       VAL   6   1.603  -1.530  -0.974
   51    HA   VAL   6           HA       VAL   6   2.423   0.735  -2.644
   52    HB   VAL   6           HB       VAL   6   2.399   0.539   0.378
   53   HG11  VAL   6          1HG1      VAL   6   2.808   2.913  -1.433
   54   HG12  VAL   6          2HG1      VAL   6   4.043   2.108  -0.466
   55   HG13  VAL   6          3HG1      VAL   6   2.717   2.958   0.329
   56   HG21  VAL   6          1HG2      VAL   6   0.451   2.058   0.305
   57   HG22  VAL   6          2HG2      VAL   6   0.116   0.490  -0.411
   58   HG23  VAL   6          3HG2      VAL   6   0.412   1.886  -1.450
   59    H    CYS   7           HN       CYS   7   4.450   0.445  -3.350
   60    HA   CYS   7           HA       CYS   7   6.327  -0.840  -1.522
   61    HB2  CYS   7          2HB       CYS   7   6.429  -0.563  -4.536
   62    HB3  CYS   7          1HB       CYS   7   7.764  -1.167  -3.562
   63    H    TYR   8           HN       TYR   8   7.602   0.393  -0.533
   64    HA   TYR   8           HA       TYR   8   8.455   2.939  -1.716
   65    HB2  TYR   8          2HB       TYR   8   6.730   3.437  -0.078
   66    HB3  TYR   8          1HB       TYR   8   7.525   2.419   1.113
   67    HD1  TYR   8          1HD       TYR   8   9.088   3.349   2.588
   68    HD2  TYR   8          2HD       TYR   8   8.014   5.514  -0.910
   69    HE1  TYR   8          1HE       TYR   8  10.339   5.279   3.412
   70    HE2  TYR   8          2HE       TYR   8   9.251   7.453  -0.100
   71    HH   TYR   8           HH       TYR   8  10.117   8.377   1.927
   72    H    ARG   9           HN       ARG   9  10.492   2.629  -2.135
   73    HA   ARG   9           HA       ARG   9  12.711   2.281  -1.895
   74    HB2  ARG   9          2HB       ARG   9  12.120   2.225   1.072
   75    HB3  ARG   9          1HB       ARG   9  13.721   2.317   0.365
   76    HG2  ARG   9          2HG       ARG   9  13.018   4.514  -0.670
   77    HG3  ARG   9          1HG       ARG   9  11.547   4.383   0.282
   78    HD2  ARG   9          2HD       ARG   9  12.799   4.300   2.339
   79    HD3  ARG   9          1HD       ARG   9  14.317   4.310   1.448
   80    HE   ARG   9           HE       ARG   9  12.546   6.579   1.053
   81   HH11  ARG   9          1HH1      ARG   9  15.363   5.254   2.710
   82   HH12  ARG   9          2HH1      ARG   9  15.985   6.778   3.162
   83   HH21  ARG   9          1HH2      ARG   9  13.439   8.703   1.696
   84   HH22  ARG   9          2HH2      ARG   9  14.917   8.734   2.552
   85    H    GLY  10           HN       GLY  10  10.799   0.016  -2.050
   86    HA2  GLY  10          2HA       GLY  10  11.424  -2.250  -2.450
   87    HA3  GLY  10          1HA       GLY  10  12.682  -2.079  -1.230
   88    H    ILE  11           HN       ILE  11  10.432  -0.636   0.334
   89    HA   ILE  11           HA       ILE  11   9.590  -2.993   1.789
   90    HB   ILE  11           HB       ILE  11   8.954  -0.064   2.292
   91   HG12  ILE  11          2HG1      ILE  11  11.133  -1.697   3.597
   92   HG13  ILE  11          1HG1      ILE  11  11.413  -0.630   2.225
   93   HG21  ILE  11          1HG2      ILE  11   8.887  -2.449   4.151
   94   HG22  ILE  11          2HG2      ILE  11   7.480  -1.672   3.438
   95   HG23  ILE  11          3HG2      ILE  11   8.488  -0.784   4.585
   96   HD11  ILE  11          1HD1      ILE  11  10.370   0.195   4.929
   97   HD12  ILE  11          2HD1      ILE  11  10.646   1.264   3.552
   98   HD13  ILE  11          3HD1      ILE  11  12.011   0.451   4.322
   99    H    CYS  12           HN       CYS  12   7.898  -3.993   0.879
  100    HA   CYS  12           HA       CYS  12   5.779  -2.361  -0.328
  101    HB2  CYS  12          2HB       CYS  12   6.417  -5.286  -0.738
  102    HB3  CYS  12          1HB       CYS  12   5.095  -4.400  -1.491
  103    H    TYR  13           HN       TYR  13   3.860  -2.254   0.629
  104    HA   TYR  13           HA       TYR  13   3.075  -4.418   2.350
  105    HB2  TYR  13          2HB       TYR  13   2.212  -2.699   4.028
  106    HB3  TYR  13          1HB       TYR  13   3.930  -3.044   4.035
  107    HD1  TYR  13          1HD       TYR  13   1.347  -0.415   3.561
  108    HD2  TYR  13          2HD       TYR  13   5.506  -1.357   3.166
  109    HE1  TYR  13          1HE       TYR  13   1.892   1.935   3.519
  110    HE2  TYR  13          2HE       TYR  13   6.031   1.023   3.102
  111    HH   TYR  13           HH       TYR  13   4.875   3.179   2.571
  112    H    ARG  14           HN       ARG  14   0.938  -4.693   2.614
  113    HA   ARG  14           HA       ARG  14  -0.696  -3.640   0.489
  114    HB2  ARG  14          2HB       ARG  14  -0.878  -6.004   1.025
  115    HB3  ARG  14          1HB       ARG  14  -1.254  -5.630   2.696
  116    HG2  ARG  14          2HG       ARG  14  -3.385  -4.646   2.001
  117    HG3  ARG  14          1HG       ARG  14  -2.997  -5.001   0.315
  118    HD2  ARG  14          2HD       ARG  14  -2.931  -7.359   0.785
  119    HD3  ARG  14          1HD       ARG  14  -3.188  -7.059   2.501
  120    HE   ARG  14           HE       ARG  14  -5.392  -6.028   1.639
  121   HH11  ARG  14          1HH1      ARG  14  -3.840  -8.916   0.241
  122   HH12  ARG  14          2HH1      ARG  14  -5.297  -9.671  -0.176
  123   HH21  ARG  14          1HH2      ARG  14  -7.438  -7.116   1.028
  124   HH22  ARG  14          2HH2      ARG  14  -7.364  -8.626   0.269
  125    H    LYS  15           HN       LYS  15  -1.160  -1.607   0.878
  126    HA   LYS  15           HA       LYS  15  -2.151  -0.832   3.503
  127    HB2  LYS  15          2HB       LYS  15  -0.527   0.636   2.380
  128    HB3  LYS  15          1HB       LYS  15  -1.657   0.852   1.047
  129    HG2  LYS  15          2HG       LYS  15  -3.258   1.892   2.589
  130    HG3  LYS  15          1HG       LYS  15  -2.096   1.711   3.900
  131    HD2  LYS  15          2HD       LYS  15  -1.659   3.330   1.383
  132    HD3  LYS  15          1HD       LYS  15  -2.117   3.962   2.972
  133    HE2  LYS  15          2HE       LYS  15  -0.023   3.156   3.909
  134    HE3  LYS  15          1HE       LYS  15   0.424   2.499   2.331
  135    HZ1  LYS  15          1HZ       LYS  15   1.448   4.684   2.796
  136    HZ2  LYS  15          2HZ       LYS  15  -0.078   5.380   2.842
  137    HZ3  LYS  15          3HZ       LYS  15   0.495   4.690   1.428
  138    H    CYS  16           HN       CYS  16  -4.181  -0.667   3.904
  139    HA   CYS  16           HA       CYS  16  -6.050  -0.834   1.658
  140    HB2  CYS  16          2HB       CYS  16  -6.406  -1.764   4.507
  141    HB3  CYS  16          1HB       CYS  16  -7.654  -1.846   3.263
  142    H    ARG  17           HN       ARG  17  -6.953   0.949   1.175
  143    HA   ARG  17           HA       ARG  17  -7.378   2.993   3.233
  144    HB2  ARG  17          2HB       ARG  17  -5.833   3.559   1.348
  145    HB3  ARG  17          1HB       ARG  17  -7.154   3.281   0.230
  146    HG2  ARG  17          2HG       ARG  17  -8.392   5.148   1.186
  147    HG3  ARG  17          1HG       ARG  17  -7.104   5.410   2.360
  148    HD2  ARG  17          2HD       ARG  17  -6.924   6.982   0.489
  149    HD3  ARG  17          1HD       ARG  17  -5.529   5.906   0.556
  150    HE   ARG  17           HE       ARG  17  -7.471   4.813  -1.136
  151   HH11  ARG  17          1HH1      ARG  17  -5.203   7.517  -1.118
  152   HH12  ARG  17          2HH1      ARG  17  -5.030   7.590  -2.810
  153   HH21  ARG  17          1HH2      ARG  17  -7.237   4.871  -3.430
  154   HH22  ARG  17          2HH2      ARG  17  -6.227   6.017  -4.189
  155    H    GLY  18           HN       GLY  18  -9.402   2.852   3.903
  156    HA2  GLY  18          2HA       GLY  18 -11.714   2.916   3.807
  157    HA3  GLY  18          1HA       GLY  18 -11.610   2.938   2.044
  Start of MODEL    2
    1    H1   LYS   1           HN       LYS   1 -11.875   1.336   0.953
    2    HA   LYS   1           HA       LYS   1 -11.523  -1.128   2.498
    3    HB2  LYS   1          2HB       LYS   1 -13.802  -0.557   0.598
    4    HB3  LYS   1          1HB       LYS   1 -13.532  -2.057   1.472
    5    HG2  LYS   1          2HG       LYS   1 -13.744  -0.718   3.596
    6    HG3  LYS   1          1HG       LYS   1 -14.285   0.626   2.598
    7    HD2  LYS   1          2HD       LYS   1 -16.246  -0.474   3.406
    8    HD3  LYS   1          1HD       LYS   1 -16.083  -0.866   1.699
    9    HE2  LYS   1          2HE       LYS   1 -16.704  -2.836   3.003
   10    HE3  LYS   1          1HE       LYS   1 -15.124  -3.049   2.263
   11    HZ1  LYS   1          1HZ       LYS   1 -15.187  -3.813   4.562
   12    HZ2  LYS   1          2HZ       LYS   1 -15.607  -2.291   5.109
   13    HZ3  LYS   1          3HZ       LYS   1 -14.093  -2.549   4.416
   14    H    TRP   2           HN       TRP   2 -10.058   0.433   0.322
   15    HA   TRP   2           HA       TRP   2  -9.890  -1.723  -1.666
   16    HB2  TRP   2          2HB       TRP   2 -10.333   0.674  -2.412
   17    HB3  TRP   2          1HB       TRP   2  -8.741   1.070  -1.799
   18    HD1  TRP   2          1HD       TRP   2  -6.685  -0.584  -3.052
   19    HE1  TRP   2          1HE       TRP   2  -6.434  -1.010  -5.598
   20    HE3  TRP   2          3HE       TRP   2 -11.435   0.525  -4.536
   21    HZ2  TRP   2          2HZ       TRP   2  -8.041  -0.876  -7.900
   22    HZ3  TRP   2          3HZ       TRP   2 -11.995   0.360  -6.925
   23    HH2  TRP   2          2HH       TRP   2 -10.331  -0.326  -8.562
   24    H    CYS   3           HN       CYS   3  -8.192  -3.042  -1.385
   25    HA   CYS   3           HA       CYS   3  -5.898  -2.019   0.119
   26    HB2  CYS   3          2HB       CYS   3  -6.837  -4.842  -0.362
   27    HB3  CYS   3          1HB       CYS   3  -5.354  -4.424   0.492
   28    H    PHE   4           HN       PHE   4  -4.063  -1.727  -0.900
   29    HA   PHE   4           HA       PHE   4  -3.644  -3.095  -3.401
   30    HB2  PHE   4          2HB       PHE   4  -2.973  -0.987  -4.540
   31    HB3  PHE   4          1HB       PHE   4  -4.677  -1.048  -4.139
   32    HD1  PHE   4          1HD       PHE   4  -5.340   0.178  -1.892
   33    HD2  PHE   4          2HD       PHE   4  -1.749   0.893  -4.063
   34    HE1  PHE   4          1HE       PHE   4  -5.176   2.377  -0.874
   35    HE2  PHE   4          2HE       PHE   4  -1.577   3.108  -3.019
   36    HZ   PHE   4           HZ       PHE   4  -3.297   3.853  -1.423
   37    H    ARG   5           HN       ARG   5  -1.418  -2.496  -4.257
   38    HA   ARG   5           HA       ARG   5   0.380  -3.075  -2.063
   39    HB2  ARG   5          2HB       ARG   5   0.433  -4.585  -3.933
   40    HB3  ARG   5          1HB       ARG   5   0.686  -3.256  -5.051
   41    HG2  ARG   5          2HG       ARG   5   2.888  -2.844  -4.045
   42    HG3  ARG   5          1HG       ARG   5   2.625  -4.205  -2.950
   43    HD2  ARG   5          2HD       ARG   5   2.494  -5.731  -4.762
   44    HD3  ARG   5          1HD       ARG   5   2.526  -4.410  -5.936
   45    HE   ARG   5           HE       ARG   5   4.835  -4.042  -4.731
   46   HH11  ARG   5          1HH1      ARG   5   3.356  -7.077  -5.815
   47   HH12  ARG   5          2HH1      ARG   5   4.829  -7.834  -6.204
   48   HH21  ARG   5          1HH2      ARG   5   6.902  -5.088  -5.314
   49   HH22  ARG   5          2HH2      ARG   5   6.868  -6.700  -5.861
   50    H    VAL   6           HN       VAL   6   1.628  -1.628  -1.244
   51    HA   VAL   6           HA       VAL   6   2.380   0.742  -2.803
   52    HB   VAL   6           HB       VAL   6   1.952   0.500   0.198
   53   HG11  VAL   6          1HG1      VAL   6   2.715   2.928  -1.426
   54   HG12  VAL   6          2HG1      VAL   6   3.789   2.029  -0.359
   55   HG13  VAL   6          3HG1      VAL   6   2.403   2.889   0.308
   56   HG21  VAL   6          1HG2      VAL   6   0.389   2.027  -1.876
   57   HG22  VAL   6          2HG2      VAL   6   0.123   2.070  -0.130
   58   HG23  VAL   6          3HG2      VAL   6  -0.143   0.578  -1.020
   59    H    CYS   7           HN       CYS   7   4.514   0.748  -3.193
   60    HA   CYS   7           HA       CYS   7   6.208  -0.763  -1.356
   61    HB2  CYS   7          2HB       CYS   7   6.677  -0.077  -4.266
   62    HB3  CYS   7          1HB       CYS   7   7.798  -0.953  -3.232
   63    H    TYR   8           HN       TYR   8   7.347   0.371  -0.085
   64    HA   TYR   8           HA       TYR   8   8.154   3.078  -0.895
   65    HB2  TYR   8          2HB       TYR   8   6.523   3.165   0.921
   66    HB3  TYR   8          1HB       TYR   8   7.478   2.020   1.855
   67    HD1  TYR   8          1HD       TYR   8   8.971   2.855   3.449
   68    HD2  TYR   8          2HD       TYR   8   7.745   5.402   0.264
   69    HE1  TYR   8          1HE       TYR   8  10.187   4.711   4.477
   70    HE2  TYR   8          2HE       TYR   8   8.955   7.272   1.281
   71    HH   TYR   8           HH       TYR   8   9.831   7.966   3.415
   72    H    ARG   9           HN       ARG   9  10.152   2.931  -1.523
   73    HA   ARG   9           HA       ARG   9  12.393   2.631  -1.551
   74    HB2  ARG   9          2HB       ARG   9  12.146   2.030   1.414
   75    HB3  ARG   9          1HB       ARG   9  13.627   2.443   0.567
   76    HG2  ARG   9          2HG       ARG   9  12.649   4.664   0.050
   77    HG3  ARG   9          1HG       ARG   9  11.251   4.231   1.032
   78    HD2  ARG   9          2HD       ARG   9  12.709   5.526   2.403
   79    HD3  ARG   9          1HD       ARG   9  12.821   3.855   2.947
   80    HE   ARG   9           HE       ARG   9  14.793   4.604   0.999
   81   HH11  ARG   9          1HH1      ARG   9  14.136   4.245   4.474
   82   HH12  ARG   9          2HH1      ARG   9  15.758   4.468   4.922
   83   HH21  ARG   9          1HH2      ARG   9  17.014   4.906   1.660
   84   HH22  ARG   9          2HH2      ARG   9  17.421   4.832   3.308
   85    H    GLY  10           HN       GLY  10  10.554   0.396  -1.960
   86    HA2  GLY  10          2HA       GLY  10  11.180  -1.730  -2.811
   87    HA3  GLY  10          1HA       GLY  10  12.512  -1.761  -1.657
   88    H    ILE  11           HN       ILE  11  10.264  -0.672   0.233
   89    HA   ILE  11           HA       ILE  11   9.601  -3.289   1.279
   90    HB   ILE  11           HB       ILE  11   8.982  -0.525   2.360
   91   HG12  ILE  11          2HG1      ILE  11  11.197  -2.391   3.216
   92   HG13  ILE  11          1HG1      ILE  11  11.429  -1.062   2.084
   93   HG21  ILE  11          1HG2      ILE  11   8.937  -3.232   3.695
   94   HG22  ILE  11          2HG2      ILE  11   7.526  -2.277   3.248
   95   HG23  ILE  11          3HG2      ILE  11   8.632  -1.688   4.490
   96   HD11  ILE  11          1HD1      ILE  11  10.503  -0.811   4.936
   97   HD12  ILE  11          2HD1      ILE  11  10.747   0.518   3.799
   98   HD13  ILE  11          3HD1      ILE  11  12.124  -0.453   4.330
   99    H    CYS  12           HN       CYS  12   7.903  -4.127   0.206
  100    HA   CYS  12           HA       CYS  12   5.686  -2.374  -0.514
  101    HB2  CYS  12          2HB       CYS  12   6.137  -5.277  -1.248
  102    HB3  CYS  12          1HB       CYS  12   4.886  -4.204  -1.873
  103    H    TYR  13           HN       TYR  13   3.827  -2.378   0.539
  104    HA   TYR  13           HA       TYR  13   3.248  -4.603   2.303
  105    HB2  TYR  13          2HB       TYR  13   2.513  -2.976   4.074
  106    HB3  TYR  13          1HB       TYR  13   4.247  -3.037   3.812
  107    HD1  TYR  13          1HD       TYR  13   1.216  -0.953   3.512
  108    HD2  TYR  13          2HD       TYR  13   5.421  -1.124   2.857
  109    HE1  TYR  13          1HE       TYR  13   1.276   1.483   3.268
  110    HE2  TYR  13          2HE       TYR  13   5.484   1.302   2.603
  111    HH   TYR  13           HH       TYR  13   2.805   3.331   3.393
  112    H    ARG  14           HN       ARG  14   1.041  -4.666   2.959
  113    HA   ARG  14           HA       ARG  14  -0.717  -3.870   0.833
  114    HB2  ARG  14          2HB       ARG  14  -1.012  -6.114   1.688
  115    HB3  ARG  14          1HB       ARG  14  -1.144  -5.516   3.334
  116    HG2  ARG  14          2HG       ARG  14  -3.265  -4.450   2.804
  117    HG3  ARG  14          1HG       ARG  14  -3.128  -4.977   1.130
  118    HD2  ARG  14          2HD       ARG  14  -3.328  -7.257   1.745
  119    HD3  ARG  14          1HD       ARG  14  -3.158  -6.888   3.457
  120    HE   ARG  14           HE       ARG  14  -5.343  -5.479   2.764
  121   HH11  ARG  14          1HH1      ARG  14  -4.499  -8.882   2.304
  122   HH12  ARG  14          2HH1      ARG  14  -6.104  -9.430   2.382
  123   HH21  ARG  14          1HH2      ARG  14  -7.565  -6.270   2.874
  124   HH22  ARG  14          2HH2      ARG  14  -7.848  -7.929   2.716
  125    H    LYS  15           HN       LYS  15  -1.173  -1.808   0.889
  126    HA   LYS  15           HA       LYS  15  -2.018  -0.632   3.421
  127    HB2  LYS  15          2HB       LYS  15  -0.390   0.614   2.041
  128    HB3  LYS  15          1HB       LYS  15  -1.570   0.657   0.737
  129    HG2  LYS  15          2HG       LYS  15  -3.055   2.024   2.103
  130    HG3  LYS  15          1HG       LYS  15  -1.899   1.961   3.436
  131    HD2  LYS  15          2HD       LYS  15  -0.225   3.082   2.032
  132    HD3  LYS  15          1HD       LYS  15  -1.387   3.135   0.707
  133    HE2  LYS  15          2HE       LYS  15  -2.856   4.554   2.033
  134    HE3  LYS  15          1HE       LYS  15  -1.734   4.459   3.390
  135    HZ1  LYS  15          1HZ       LYS  15  -0.071   5.586   2.045
  136    HZ2  LYS  15          2HZ       LYS  15  -1.476   6.517   2.135
  137    HZ3  LYS  15          3HZ       LYS  15  -1.137   5.667   0.742
  138    H    CYS  16           HN       CYS  16  -4.040  -0.437   3.835
  139    HA   CYS  16           HA       CYS  16  -5.959  -0.780   1.660
  140    HB2  CYS  16          2HB       CYS  16  -6.279  -1.409   4.595
  141    HB3  CYS  16          1HB       CYS  16  -7.557  -1.562   3.391
  142    H    ARG  17           HN       ARG  17  -6.806   0.954   1.036
  143    HA   ARG  17           HA       ARG  17  -7.078   3.249   2.850
  144    HB2  ARG  17          2HB       ARG  17  -5.670   3.482   0.800
  145    HB3  ARG  17          1HB       ARG  17  -7.082   3.092  -0.170
  146    HG2  ARG  17          2HG       ARG  17  -8.173   5.130   0.664
  147    HG3  ARG  17          1HG       ARG  17  -6.705   5.517   1.574
  148    HD2  ARG  17          2HD       ARG  17  -5.441   5.395  -0.574
  149    HD3  ARG  17          1HD       ARG  17  -6.984   5.233  -1.403
  150    HE   ARG  17           HE       ARG  17  -7.059   7.509   0.210
  151   HH11  ARG  17          1HH1      ARG  17  -5.618   6.337  -2.825
  152   HH12  ARG  17          2HH1      ARG  17  -5.212   7.882  -3.382
  153   HH21  ARG  17          1HH2      ARG  17  -6.545   9.654  -0.624
  154   HH22  ARG  17          2HH2      ARG  17  -5.771   9.788  -2.135
  155    H    GLY  18           HN       GLY  18  -9.115   3.334   3.612
  156    HA2  GLY  18          2HA       GLY  18 -11.395   3.225   3.664
  157    HA3  GLY  18          1HA       GLY  18 -11.369   3.170   1.894
  Start of MODEL    3
    1    H1   LYS   1           HN       LYS   1 -12.105   1.190   1.124
    2    HA   LYS   1           HA       LYS   1 -12.033  -1.351   2.624
    3    HB2  LYS   1          2HB       LYS   1 -13.891  -2.114   1.205
    4    HB3  LYS   1          1HB       LYS   1 -14.322  -0.682   2.131
    5    HG2  LYS   1          2HG       LYS   1 -14.002   0.714   0.176
    6    HG3  LYS   1          1HG       LYS   1 -13.483  -0.685  -0.762
    7    HD2  LYS   1          2HD       LYS   1 -15.688  -1.702  -0.435
    8    HD3  LYS   1          1HD       LYS   1 -16.203  -0.282   0.479
    9    HE2  LYS   1          2HE       LYS   1 -16.984  -0.170  -1.828
   10    HE3  LYS   1          1HE       LYS   1 -15.839   1.122  -1.483
   11    HZ1  LYS   1          1HZ       LYS   1 -15.180  -1.416  -2.890
   12    HZ2  LYS   1          2HZ       LYS   1 -14.112  -0.134  -2.630
   13    HZ3  LYS   1          3HZ       LYS   1 -15.448   0.062  -3.631
   14    H    TRP   2           HN       TRP   2 -10.400   0.298   0.352
   15    HA   TRP   2           HA       TRP   2 -10.022  -1.995  -1.450
   16    HB2  TRP   2          2HB       TRP   2 -10.696   0.273  -2.360
   17    HB3  TRP   2          1HB       TRP   2  -9.127   0.861  -1.832
   18    HD1  TRP   2          1HD       TRP   2  -6.953  -0.456  -3.062
   19    HE1  TRP   2          1HE       TRP   2  -6.764  -1.217  -5.526
   20    HE3  TRP   2          3HE       TRP   2 -11.910  -0.524  -4.290
   21    HZ2  TRP   2          2HZ       TRP   2  -8.482  -1.764  -7.683
   22    HZ3  TRP   2          3HZ       TRP   2 -12.555  -1.178  -6.574
   23    HH2  TRP   2          2HH       TRP   2 -10.872  -1.782  -8.230
   24    H    CYS   3           HN       CYS   3  -7.983  -2.922  -1.576
   25    HA   CYS   3           HA       CYS   3  -5.861  -1.672   0.004
   26    HB2  CYS   3          2HB       CYS   3  -6.568  -4.589  -0.180
   27    HB3  CYS   3          1HB       CYS   3  -5.189  -3.938   0.699
   28    H    PHE   4           HN       PHE   4  -3.876  -1.636  -1.006
   29    HA   PHE   4           HA       PHE   4  -3.457  -3.343  -3.291
   30    HB2  PHE   4          2HB       PHE   4  -2.880  -1.542  -4.833
   31    HB3  PHE   4          1HB       PHE   4  -4.523  -1.325  -4.263
   32    HD1  PHE   4          1HD       PHE   4  -4.924   0.418  -2.440
   33    HD2  PHE   4          2HD       PHE   4  -1.298   0.141  -4.647
   34    HE1  PHE   4          1HE       PHE   4  -4.379   2.743  -1.841
   35    HE2  PHE   4          2HE       PHE   4  -0.750   2.454  -4.048
   36    HZ   PHE   4           HZ       PHE   4  -2.290   3.756  -2.645
   37    H    ARG   5           HN       ARG   5  -1.159  -2.950  -4.155
   38    HA   ARG   5           HA       ARG   5   0.523  -3.135  -1.832
   39    HB2  ARG   5          2HB       ARG   5   0.758  -4.832  -3.578
   40    HB3  ARG   5          1HB       ARG   5   1.152  -3.584  -4.750
   41    HG2  ARG   5          2HG       ARG   5   3.208  -3.092  -3.680
   42    HG3  ARG   5          1HG       ARG   5   2.799  -4.091  -2.291
   43    HD2  ARG   5          2HD       ARG   5   4.372  -5.295  -3.638
   44    HD3  ARG   5          1HD       ARG   5   2.803  -6.068  -3.796
   45    HE   ARG   5           HE       ARG   5   3.012  -4.320  -5.914
   46   HH11  ARG   5          1HH1      ARG   5   4.812  -7.107  -4.697
   47   HH12  ARG   5          2HH1      ARG   5   5.337  -7.630  -6.231
   48   HH21  ARG   5          1HH2      ARG   5   3.767  -5.034  -8.046
   49   HH22  ARG   5          2HH2      ARG   5   4.750  -6.427  -8.152
   50    H    VAL   6           HN       VAL   6   1.545  -1.521  -1.026
   51    HA   VAL   6           HA       VAL   6   2.304   0.726  -2.747
   52    HB   VAL   6           HB       VAL   6   1.943   0.629   0.268
   53   HG11  VAL   6          1HG1      VAL   6   2.563   2.971  -1.532
   54   HG12  VAL   6          2HG1      VAL   6   3.683   2.210  -0.404
   55   HG13  VAL   6          3HG1      VAL   6   2.257   3.051   0.203
   56   HG21  VAL   6          1HG2      VAL   6  -0.178   0.529  -0.905
   57   HG22  VAL   6          2HG2      VAL   6   0.268   1.944  -1.859
   58   HG23  VAL   6          3HG2      VAL   6   0.025   2.095  -0.119
   59    H    CYS   7           HN       CYS   7   4.405   0.913  -3.119
   60    HA   CYS   7           HA       CYS   7   6.216  -0.607  -1.398
   61    HB2  CYS   7          2HB       CYS   7   6.475   0.101  -4.315
   62    HB3  CYS   7          1HB       CYS   7   7.742  -0.678  -3.363
   63    H    TYR   8           HN       TYR   8   7.557   0.442  -0.225
   64    HA   TYR   8           HA       TYR   8   8.475   3.100  -1.046
   65    HB2  TYR   8          2HB       TYR   8   6.829   3.408   0.734
   66    HB3  TYR   8          1HB       TYR   8   7.633   2.183   1.712
   67    HD1  TYR   8          1HD       TYR   8   9.079   2.927   3.385
   68    HD2  TYR   8          2HD       TYR   8   8.421   5.408  -0.007
   69    HE1  TYR   8          1HE       TYR   8  10.523   4.646   4.362
   70    HE2  TYR   8          2HE       TYR   8   9.852   7.119   0.959
   71    HH   TYR   8           HH       TYR   8  10.679   7.819   3.152
   72    H    ARG   9           HN       ARG   9  10.570   2.851  -1.505
   73    HA   ARG   9           HA       ARG   9  12.765   2.351  -1.373
   74    HB2  ARG   9          2HB       ARG   9  12.186   1.631   1.509
   75    HB3  ARG   9          1HB       ARG   9  13.784   1.811   0.812
   76    HG2  ARG   9          2HG       ARG   9  13.237   4.194   0.350
   77    HG3  ARG   9          1HG       ARG   9  11.720   3.952   1.213
   78    HD2  ARG   9          2HD       ARG   9  12.936   3.278   3.213
   79    HD3  ARG   9          1HD       ARG   9  14.464   3.494   2.364
   80    HE   ARG   9           HE       ARG   9  12.616   5.746   2.723
   81   HH11  ARG   9          1HH1      ARG   9  15.786   4.282   3.306
   82   HH12  ARG   9          2HH1      ARG   9  16.482   5.707   3.921
   83   HH21  ARG   9          1HH2      ARG   9  13.583   7.693   3.586
   84   HH22  ARG   9          2HH2      ARG   9  15.201   7.654   4.114
   85    H    GLY  10           HN       GLY  10  10.692   0.264  -1.918
   86    HA2  GLY  10          2HA       GLY  10  11.170  -1.911  -2.815
   87    HA3  GLY  10          1HA       GLY  10  12.483  -2.041  -1.638
   88    H    ILE  11           HN       ILE  11  10.496  -0.826   0.316
   89    HA   ILE  11           HA       ILE  11   9.583  -3.322   1.421
   90    HB   ILE  11           HB       ILE  11   9.097  -0.469   2.344
   91   HG12  ILE  11          2HG1      ILE  11  11.220  -2.374   3.330
   92   HG13  ILE  11          1HG1      ILE  11  11.521  -1.135   2.119
   93   HG21  ILE  11          1HG2      ILE  11   8.701  -1.497   4.552
   94   HG22  ILE  11          2HG2      ILE  11   8.883  -3.094   3.827
   95   HG23  ILE  11          3HG2      ILE  11   7.548  -2.053   3.341
   96   HD11  ILE  11          1HD1      ILE  11  12.231  -0.400   4.335
   97   HD12  ILE  11          2HD1      ILE  11  10.598  -0.665   4.953
   98   HD13  ILE  11          3HD1      ILE  11  10.890   0.582   3.740
   99    H    CYS  12           HN       CYS  12   7.860  -4.129   0.375
  100    HA   CYS  12           HA       CYS  12   5.752  -2.294  -0.427
  101    HB2  CYS  12          2HB       CYS  12   6.281  -5.133  -1.305
  102    HB3  CYS  12          1HB       CYS  12   4.991  -4.093  -1.896
  103    H    TYR  13           HN       TYR  13   3.940  -2.251   0.623
  104    HA   TYR  13           HA       TYR  13   3.154  -4.561   2.194
  105    HB2  TYR  13          2HB       TYR  13   2.393  -2.992   4.001
  106    HB3  TYR  13          1HB       TYR  13   4.134  -3.079   3.831
  107    HD1  TYR  13          1HD       TYR  13   1.183  -0.950   3.546
  108    HD2  TYR  13          2HD       TYR  13   5.389  -1.141   2.926
  109    HE1  TYR  13          1HE       TYR  13   1.271   1.486   3.402
  110    HE2  TYR  13          2HE       TYR  13   5.492   1.296   2.780
  111    HH   TYR  13           HH       TYR  13   3.937   3.212   2.243
  112    H    ARG  14           HN       ARG  14   0.886  -4.699   2.489
  113    HA   ARG  14           HA       ARG  14  -0.545  -3.484   0.294
  114    HB2  ARG  14          2HB       ARG  14  -0.819  -5.913   0.990
  115    HB3  ARG  14          1HB       ARG  14  -1.632  -5.317   2.431
  116    HG2  ARG  14          2HG       ARG  14  -3.204  -4.112   0.901
  117    HG3  ARG  14          1HG       ARG  14  -2.506  -5.041  -0.424
  118    HD2  ARG  14          2HD       ARG  14  -4.439  -6.224   0.267
  119    HD3  ARG  14          1HD       ARG  14  -3.055  -7.113   0.907
  120    HE   ARG  14           HE       ARG  14  -3.969  -5.254   2.817
  121   HH11  ARG  14          1HH1      ARG  14  -4.760  -8.395   1.468
  122   HH12  ARG  14          2HH1      ARG  14  -5.804  -8.853   2.731
  123   HH21  ARG  14          1HH2      ARG  14  -5.357  -5.830   4.553
  124   HH22  ARG  14          2HH2      ARG  14  -6.167  -7.328   4.570
  125    H    LYS  15           HN       LYS  15  -1.027  -1.432   0.729
  126    HA   LYS  15           HA       LYS  15  -1.907  -0.690   3.413
  127    HB2  LYS  15          2HB       LYS  15  -0.251   0.686   2.049
  128    HB3  LYS  15          1HB       LYS  15  -1.598   1.092   1.005
  129    HG2  LYS  15          2HG       LYS  15  -2.754   2.129   2.901
  130    HG3  LYS  15          1HG       LYS  15  -1.378   1.738   3.936
  131    HD2  LYS  15          2HD       LYS  15   0.061   3.060   2.367
  132    HD3  LYS  15          1HD       LYS  15  -1.411   3.568   1.541
  133    HE2  LYS  15          2HE       LYS  15  -0.741   4.073   4.441
  134    HE3  LYS  15          1HE       LYS  15  -0.654   5.257   3.139
  135    HZ1  LYS  15          1HZ       LYS  15  -3.111   3.909   4.109
  136    HZ2  LYS  15          2HZ       LYS  15  -3.060   5.079   2.897
  137    HZ3  LYS  15          3HZ       LYS  15  -2.641   5.467   4.461
  138    H    CYS  16           HN       CYS  16  -3.991  -0.105   3.835
  139    HA   CYS  16           HA       CYS  16  -5.851  -0.525   1.634
  140    HB2  CYS  16          2HB       CYS  16  -6.243  -0.937   4.600
  141    HB3  CYS  16          1HB       CYS  16  -7.503  -1.114   3.382
  142    H    ARG  17           HN       ARG  17  -7.282   0.960   1.123
  143    HA   ARG  17           HA       ARG  17  -7.453   3.398   2.753
  144    HB2  ARG  17          2HB       ARG  17  -7.704   3.202  -0.264
  145    HB3  ARG  17          1HB       ARG  17  -7.807   4.663   0.700
  146    HG2  ARG  17          2HG       ARG  17  -5.415   4.288   1.350
  147    HG3  ARG  17          1HG       ARG  17  -5.378   2.977   0.173
  148    HD2  ARG  17          2HD       ARG  17  -5.970   5.880  -0.394
  149    HD3  ARG  17          1HD       ARG  17  -4.486   5.024  -0.776
  150    HE   ARG  17           HE       ARG  17  -6.805   3.837  -1.986
  151   HH11  ARG  17          1HH1      ARG  17  -4.351   6.366  -2.356
  152   HH12  ARG  17          2HH1      ARG  17  -4.566   6.519  -4.033
  153   HH21  ARG  17          1HH2      ARG  17  -7.063   4.001  -4.284
  154   HH22  ARG  17          2HH2      ARG  17  -6.145   5.123  -5.175
  155    H    GLY  18           HN       GLY  18  -9.354   3.127   3.726
  156    HA2  GLY  18          2HA       GLY  18 -11.621   2.935   3.956
  157    HA3  GLY  18          1HA       GLY  18 -11.757   3.001   2.202
  Start of MODEL    4
    1    H1   LYS   1           HN       LYS   1 -12.317   1.471   1.348
    2    HA   LYS   1           HA       LYS   1 -12.430  -1.320   2.111
    3    HB2  LYS   1          2HB       LYS   1 -13.904  -1.565   0.153
    4    HB3  LYS   1          1HB       LYS   1 -14.455  -0.356   1.300
    5    HG2  LYS   1          2HG       LYS   1 -13.964   1.425  -0.120
    6    HG3  LYS   1          1HG       LYS   1 -12.829   0.473  -1.072
    7    HD2  LYS   1          2HD       LYS   1 -15.793  -0.061  -1.005
    8    HD3  LYS   1          1HD       LYS   1 -15.029   0.986  -2.202
    9    HE2  LYS   1          2HE       LYS   1 -13.591  -0.880  -2.893
   10    HE3  LYS   1          1HE       LYS   1 -14.379  -1.923  -1.720
   11    HZ1  LYS   1          1HZ       LYS   1 -15.250  -2.242  -3.922
   12    HZ2  LYS   1          2HZ       LYS   1 -15.705  -0.625  -4.028
   13    HZ3  LYS   1          3HZ       LYS   1 -16.451  -1.630  -2.923
   14    H    TRP   2           HN       TRP   2 -10.456   0.610   0.059
   15    HA   TRP   2           HA       TRP   2  -9.983  -1.635  -1.731
   16    HB2  TRP   2          2HB       TRP   2 -10.416   0.734  -2.592
   17    HB3  TRP   2          1HB       TRP   2  -8.827   1.135  -1.970
   18    HD1  TRP   2          1HD       TRP   2  -6.757  -0.472  -3.023
   19    HE1  TRP   2          1HE       TRP   2  -6.437  -1.251  -5.478
   20    HE3  TRP   2          3HE       TRP   2 -11.520   0.182  -4.713
   21    HZ2  TRP   2          2HZ       TRP   2  -7.998  -1.529  -7.793
   22    HZ3  TRP   2          3HZ       TRP   2 -12.022  -0.360  -7.058
   23    HH2  TRP   2          2HH       TRP   2 -10.297  -1.197  -8.559
   24    H    CYS   3           HN       CYS   3  -8.314  -2.894  -1.376
   25    HA   CYS   3           HA       CYS   3  -6.055  -1.814   0.142
   26    HB2  CYS   3          2HB       CYS   3  -7.012  -4.639  -0.192
   27    HB3  CYS   3          1HB       CYS   3  -5.488  -4.219   0.591
   28    H    PHE   4           HN       PHE   4  -4.193  -1.611  -0.851
   29    HA   PHE   4           HA       PHE   4  -3.756  -3.045  -3.318
   30    HB2  PHE   4          2HB       PHE   4  -2.978  -0.954  -4.434
   31    HB3  PHE   4          1HB       PHE   4  -4.692  -0.933  -4.074
   32    HD1  PHE   4          1HD       PHE   4  -1.666   0.868  -3.893
   33    HD2  PHE   4          2HD       PHE   4  -5.357   0.330  -1.842
   34    HE1  PHE   4          1HE       PHE   4  -1.392   3.053  -2.814
   35    HE2  PHE   4          2HE       PHE   4  -5.076   2.507  -0.765
   36    HZ   PHE   4           HZ       PHE   4  -3.094   3.877  -1.249
   37    H    ARG   5           HN       ARG   5  -1.410  -2.553  -4.029
   38    HA   ARG   5           HA       ARG   5   0.160  -2.988  -1.611
   39    HB2  ARG   5          2HB       ARG   5   0.109  -4.755  -3.353
   40    HB3  ARG   5          1HB       ARG   5   0.818  -3.623  -4.486
   41    HG2  ARG   5          2HG       ARG   5   2.840  -3.505  -3.139
   42    HG3  ARG   5          1HG       ARG   5   2.122  -4.598  -1.950
   43    HD2  ARG   5          2HD       ARG   5   2.732  -5.227  -4.839
   44    HD3  ARG   5          1HD       ARG   5   3.588  -5.846  -3.424
   45    HE   ARG   5           HE       ARG   5   0.946  -6.513  -3.077
   46   HH11  ARG   5          1HH1      ARG   5   3.487  -7.303  -5.406
   47   HH12  ARG   5          2HH1      ARG   5   2.817  -8.800  -5.852
   48   HH21  ARG   5          1HH2      ARG   5  -0.003  -8.559  -3.724
   49   HH22  ARG   5          2HH2      ARG   5   0.800  -9.532  -4.869
   50    H    VAL   6           HN       VAL   6   1.616  -1.566  -1.017
   51    HA   VAL   6           HA       VAL   6   2.410   0.535  -2.915
   52    HB   VAL   6           HB       VAL   6   2.182   0.741   0.110
   53   HG11  VAL   6          1HG1      VAL   6   2.686   3.118  -0.198
   54   HG12  VAL   6          2HG1      VAL   6   2.927   2.843  -1.924
   55   HG13  VAL   6          3HG1      VAL   6   4.015   2.099  -0.753
   56   HG21  VAL   6          1HG2      VAL   6   0.007   0.738  -0.973
   57   HG22  VAL   6          2HG2      VAL   6   0.529   2.039  -2.043
   58   HG23  VAL   6          3HG2      VAL   6   0.382   2.325  -0.306
   59    H    CYS   7           HN       CYS   7   4.527   0.614  -3.298
   60    HA   CYS   7           HA       CYS   7   6.255  -0.832  -1.457
   61    HB2  CYS   7          2HB       CYS   7   6.679  -0.218  -4.395
   62    HB3  CYS   7          1HB       CYS   7   7.843  -1.025  -3.348
   63    H    TYR   8           HN       TYR   8   7.429   0.288  -0.245
   64    HA   TYR   8           HA       TYR   8   8.122   3.033  -0.990
   65    HB2  TYR   8          2HB       TYR   8   6.442   3.060   0.756
   66    HB3  TYR   8          1HB       TYR   8   7.348   1.882   1.689
   67    HD1  TYR   8          1HD       TYR   8   7.565   5.367   0.362
   68    HD2  TYR   8          2HD       TYR   8   8.834   2.583   3.314
   69    HE1  TYR   8          1HE       TYR   8   8.673   7.182   1.594
   70    HE2  TYR   8          2HE       TYR   8   9.936   4.375   4.550
   71    HH   TYR   8           HH       TYR   8   9.452   7.675   3.884
   72    H    ARG   9           HN       ARG   9  10.130   2.828  -1.651
   73    HA   ARG   9           HA       ARG   9  12.369   2.657  -1.610
   74    HB2  ARG   9          2HB       ARG   9  12.062   2.377   1.390
   75    HB3  ARG   9          1HB       ARG   9  13.538   2.813   0.540
   76    HG2  ARG   9          2HG       ARG   9  12.352   4.866  -0.287
   77    HG3  ARG   9          1HG       ARG   9  11.012   4.436   0.772
   78    HD2  ARG   9          2HD       ARG   9  12.372   6.040   1.915
   79    HD3  ARG   9          1HD       ARG   9  12.606   4.473   2.691
   80    HE   ARG   9           HE       ARG   9  14.517   4.998   0.642
   81   HH11  ARG   9          1HH1      ARG   9  13.837   5.580   4.067
   82   HH12  ARG   9          2HH1      ARG   9  15.460   5.886   4.459
   83   HH21  ARG   9          1HH2      ARG   9  16.716   5.469   1.193
   84   HH22  ARG   9          2HH2      ARG   9  17.138   5.836   2.793
   85    H    GLY  10           HN       GLY  10  10.762   0.308  -1.914
   86    HA2  GLY  10          2HA       GLY  10  11.595  -1.803  -2.607
   87    HA3  GLY  10          1HA       GLY  10  12.831  -1.700  -1.362
   88    H    ILE  11           HN       ILE  11  10.319  -0.689   0.275
   89    HA   ILE  11           HA       ILE  11   9.702  -3.333   1.345
   90    HB   ILE  11           HB       ILE  11   8.914  -0.600   2.398
   91   HG12  ILE  11          2HG1      ILE  11  11.225  -2.295   3.347
   92   HG13  ILE  11          1HG1      ILE  11  11.404  -0.979   2.190
   93   HG21  ILE  11          1HG2      ILE  11   7.562  -2.450   3.258
   94   HG22  ILE  11          2HG2      ILE  11   8.594  -1.795   4.528
   95   HG23  ILE  11          3HG2      ILE  11   9.025  -3.311   3.738
   96   HD11  ILE  11          1HD1      ILE  11  10.384  -0.740   5.013
   97   HD12  ILE  11          2HD1      ILE  11  10.525   0.579   3.850
   98   HD13  ILE  11          3HD1      ILE  11  11.976  -0.236   4.431
   99    H    CYS  12           HN       CYS  12   8.012  -4.222   0.311
  100    HA   CYS  12           HA       CYS  12   5.824  -2.482  -0.553
  101    HB2  CYS  12          2HB       CYS  12   6.345  -5.376  -1.267
  102    HB3  CYS  12          1HB       CYS  12   5.053  -4.364  -1.901
  103    H    TYR  13           HN       TYR  13   3.915  -2.455   0.438
  104    HA   TYR  13           HA       TYR  13   3.272  -4.656   2.177
  105    HB2  TYR  13          2HB       TYR  13   2.585  -3.063   3.967
  106    HB3  TYR  13          1HB       TYR  13   4.318  -3.114   3.693
  107    HD1  TYR  13          1HD       TYR  13   1.253  -1.062   3.294
  108    HD2  TYR  13          2HD       TYR  13   5.500  -1.163   2.923
  109    HE1  TYR  13          1HE       TYR  13   1.297   1.368   3.100
  110    HE2  TYR  13          2HE       TYR  13   5.541   1.270   2.721
  111    HH   TYR  13           HH       TYR  13   3.976   3.111   2.048
  112    H    ARG  14           HN       ARG  14   1.092  -4.514   2.890
  113    HA   ARG  14           HA       ARG  14  -0.663  -3.806   0.719
  114    HB2  ARG  14          2HB       ARG  14  -0.956  -5.969   1.694
  115    HB3  ARG  14          1HB       ARG  14  -0.999  -5.293   3.312
  116    HG2  ARG  14          2HG       ARG  14  -3.125  -4.153   2.712
  117    HG3  ARG  14          1HG       ARG  14  -3.094  -5.018   1.172
  118    HD2  ARG  14          2HD       ARG  14  -3.207  -7.118   2.258
  119    HD3  ARG  14          1HD       ARG  14  -2.938  -6.385   3.838
  120    HE   ARG  14           HE       ARG  14  -5.261  -5.396   2.532
  121   HH11  ARG  14          1HH1      ARG  14  -4.000  -8.016   4.536
  122   HH12  ARG  14          2HH1      ARG  14  -5.515  -8.428   5.198
  123   HH21  ARG  14          1HH2      ARG  14  -7.359  -5.979   3.435
  124   HH22  ARG  14          2HH2      ARG  14  -7.464  -7.250   4.547
  125    H    LYS  15           HN       LYS  15  -1.119  -1.705   0.731
  126    HA   LYS  15           HA       LYS  15  -1.869  -0.460   3.267
  127    HB2  LYS  15          2HB       LYS  15  -0.286   0.769   1.797
  128    HB3  LYS  15          1HB       LYS  15  -1.526   0.822   0.556
  129    HG2  LYS  15          2HG       LYS  15  -1.487   2.952   1.659
  130    HG3  LYS  15          1HG       LYS  15  -2.964   2.117   2.144
  131    HD2  LYS  15          2HD       LYS  15  -1.772   1.371   4.215
  132    HD3  LYS  15          1HD       LYS  15  -0.414   2.370   3.733
  133    HE2  LYS  15          2HE       LYS  15  -1.755   3.557   5.351
  134    HE3  LYS  15          1HE       LYS  15  -1.870   4.355   3.786
  135    HZ1  LYS  15          1HZ       LYS  15  -3.911   2.514   4.940
  136    HZ2  LYS  15          2HZ       LYS  15  -4.030   3.323   3.454
  137    HZ3  LYS  15          3HZ       LYS  15  -4.013   4.196   4.876
  138    H    CYS  16           HN       CYS  16  -3.904  -0.140   3.729
  139    HA   CYS  16           HA       CYS  16  -5.866  -0.580   1.616
  140    HB2  CYS  16          2HB       CYS  16  -6.144  -1.055   4.591
  141    HB3  CYS  16          1HB       CYS  16  -7.460  -1.190   3.429
  142    H    ARG  17           HN       ARG  17  -7.026   1.001   1.011
  143    HA   ARG  17           HA       ARG  17  -7.233   3.401   2.675
  144    HB2  ARG  17          2HB       ARG  17  -6.107   3.787   0.518
  145    HB3  ARG  17          1HB       ARG  17  -7.438   3.018  -0.329
  146    HG2  ARG  17          2HG       ARG  17  -8.919   4.830   0.393
  147    HG3  ARG  17          1HG       ARG  17  -7.561   5.610   1.204
  148    HD2  ARG  17          2HD       ARG  17  -7.685   4.974  -1.739
  149    HD3  ARG  17          1HD       ARG  17  -8.045   6.549  -1.041
  150    HE   ARG  17           HE       ARG  17  -5.694   6.419  -0.154
  151   HH11  ARG  17          1HH1      ARG  17  -6.586   4.834  -3.194
  152   HH12  ARG  17          2HH1      ARG  17  -5.095   5.105  -3.956
  153   HH21  ARG  17          1HH2      ARG  17  -3.614   6.823  -1.220
  154   HH22  ARG  17          2HH2      ARG  17  -3.377   6.293  -2.809
  155    H    GLY  18           HN       GLY  18  -8.984   2.714   3.839
  156    HA2  GLY  18          2HA       GLY  18 -11.178   2.369   4.305
  157    HA3  GLY  18          1HA       GLY  18 -11.526   2.901   2.661
  Start of MODEL    5
    1    H1   LYS   1           HN       LYS   1 -11.999   0.886   0.883
    2    HA   LYS   1           HA       LYS   1 -12.078  -1.611   2.450
    3    HB2  LYS   1          2HB       LYS   1 -13.772  -2.485   0.922
    4    HB3  LYS   1          1HB       LYS   1 -14.363  -1.039   1.730
    5    HG2  LYS   1          2HG       LYS   1 -13.987   0.286  -0.235
    6    HG3  LYS   1          1HG       LYS   1 -13.188  -1.062  -1.043
    7    HD2  LYS   1          2HD       LYS   1 -15.303  -2.314  -0.988
    8    HD3  LYS   1          1HD       LYS   1 -16.083  -0.931  -0.212
    9    HE2  LYS   1          2HE       LYS   1 -15.594   0.454  -2.131
   10    HE3  LYS   1          1HE       LYS   1 -14.740  -0.872  -2.912
   11    HZ1  LYS   1          1HZ       LYS   1 -16.814  -2.099  -2.986
   12    HZ2  LYS   1          2HZ       LYS   1 -16.972  -0.619  -3.767
   13    HZ3  LYS   1          3HZ       LYS   1 -17.623  -0.825  -2.225
   14    H    TRP   2           HN       TRP   2 -10.393   0.166   0.218
   15    HA   TRP   2           HA       TRP   2  -9.944  -2.097  -1.553
   16    HB2  TRP   2          2HB       TRP   2 -10.693   0.240  -2.367
   17    HB3  TRP   2          1HB       TRP   2  -9.038   0.726  -2.016
   18    HD1  TRP   2          1HD       TRP   2  -7.118  -0.752  -3.386
   19    HE1  TRP   2          1HE       TRP   2  -7.211  -1.616  -5.846
   20    HE3  TRP   2          3HE       TRP   2 -12.144  -0.523  -4.109
   21    HZ2  TRP   2          2HZ       TRP   2  -9.196  -2.116  -7.792
   22    HZ3  TRP   2          3HZ       TRP   2 -13.070  -1.204  -6.281
   23    HH2  TRP   2          2HH       TRP   2 -11.625  -1.980  -8.075
   24    H    CYS   3           HN       CYS   3  -8.071  -3.098  -1.437
   25    HA   CYS   3           HA       CYS   3  -5.915  -1.860   0.100
   26    HB2  CYS   3          2HB       CYS   3  -6.564  -4.758  -0.378
   27    HB3  CYS   3          1HB       CYS   3  -5.099  -4.200   0.424
   28    H    PHE   4           HN       PHE   4  -4.108  -1.417  -0.872
   29    HA   PHE   4           HA       PHE   4  -3.524  -2.624  -3.452
   30    HB2  PHE   4          2HB       PHE   4  -2.691  -0.266  -4.131
   31    HB3  PHE   4          1HB       PHE   4  -4.421  -0.570  -4.171
   32    HD1  PHE   4          1HD       PHE   4  -5.912   0.671  -2.808
   33    HD2  PHE   4          2HD       PHE   4  -1.715   1.064  -2.240
   34    HE1  PHE   4          1HE       PHE   4  -6.304   2.587  -1.347
   35    HE2  PHE   4          2HE       PHE   4  -2.108   2.994  -0.764
   36    HZ   PHE   4           HZ       PHE   4  -4.405   3.755  -0.319
   37    H    ARG   5           HN       ARG   5  -1.242  -2.310  -4.059
   38    HA   ARG   5           HA       ARG   5   0.386  -2.727  -1.687
   39    HB2  ARG   5          2HB       ARG   5   0.500  -4.421  -3.450
   40    HB3  ARG   5          1HB       ARG   5   1.003  -3.200  -4.608
   41    HG2  ARG   5          2HG       ARG   5   3.048  -2.819  -3.293
   42    HG3  ARG   5          1HG       ARG   5   2.549  -4.089  -2.178
   43    HD2  ARG   5          2HD       ARG   5   4.140  -5.002  -3.740
   44    HD3  ARG   5          1HD       ARG   5   2.549  -5.679  -4.079
   45    HE   ARG   5           HE       ARG   5   3.193  -3.362  -5.642
   46   HH11  ARG   5          1HH1      ARG   5   3.477  -6.879  -5.450
   47   HH12  ARG   5          2HH1      ARG   5   3.629  -7.099  -7.125
   48   HH21  ARG   5          1HH2      ARG   5   3.467  -3.663  -7.953
   49   HH22  ARG   5          2HH2      ARG   5   3.600  -5.212  -8.597
   50    H    VAL   6           HN       VAL   6   1.703  -1.234  -0.957
   51    HA   VAL   6           HA       VAL   6   2.526   0.908  -2.779
   52    HB   VAL   6           HB       VAL   6   2.392   1.033   0.253
   53   HG11  VAL   6          1HG1      VAL   6   2.840   3.188  -1.805
   54   HG12  VAL   6          2HG1      VAL   6   4.050   2.511  -0.717
   55   HG13  VAL   6          3HG1      VAL   6   2.702   3.443  -0.065
   56   HG21  VAL   6          1HG2      VAL   6   0.471   2.236  -1.742
   57   HG22  VAL   6          2HG2      VAL   6   0.440   2.482   0.005
   58   HG23  VAL   6          3HG2      VAL   6   0.132   0.885  -0.663
   59    H    CYS   7           HN       CYS   7   4.629   0.805  -3.242
   60    HA   CYS   7           HA       CYS   7   6.342  -0.696  -1.415
   61    HB2  CYS   7          2HB       CYS   7   6.675  -0.178  -4.374
   62    HB3  CYS   7          1HB       CYS   7   7.843  -1.014  -3.357
   63    H    TYR   8           HN       TYR   8   7.634   0.394  -0.273
   64    HA   TYR   8           HA       TYR   8   8.650   2.973  -1.246
   65    HB2  TYR   8          2HB       TYR   8   6.999   3.278   0.560
   66    HB3  TYR   8          1HB       TYR   8   7.879   2.138   1.563
   67    HD1  TYR   8          1HD       TYR   8   9.868   2.819   2.749
   68    HD2  TYR   8          2HD       TYR   8   7.895   5.538   0.145
   69    HE1  TYR   8          1HE       TYR   8  11.122   4.653   3.735
   70    HE2  TYR   8          2HE       TYR   8   9.165   7.389   1.111
   71    HH   TYR   8           HH       TYR   8  10.332   7.890   3.217
   72    H    ARG   9           HN       ARG   9  10.700   2.569  -1.759
   73    HA   ARG   9           HA       ARG   9  12.890   1.973  -1.633
   74    HB2  ARG   9          2HB       ARG   9  12.260   1.592   1.294
   75    HB3  ARG   9          1HB       ARG   9  13.876   1.525   0.617
   76    HG2  ARG   9          2HG       ARG   9  13.590   3.878  -0.140
   77    HG3  ARG   9          1HG       ARG   9  12.028   3.884   0.657
   78    HD2  ARG   9          2HD       ARG   9  13.833   4.869   2.040
   79    HD3  ARG   9          1HD       ARG   9  13.008   3.511   2.798
   80    HE   ARG   9           HE       ARG   9  15.201   2.468   1.489
   81   HH11  ARG   9          1HH1      ARG   9  14.733   4.876   4.044
   82   HH12  ARG   9          2HH1      ARG   9  16.116   4.403   4.917
   83   HH21  ARG   9          1HH2      ARG   9  17.101   1.840   2.692
   84   HH22  ARG   9          2HH2      ARG   9  17.485   2.647   4.139
   85    H    GLY  10           HN       GLY  10  10.797  -0.022  -2.107
   86    HA2  GLY  10          2HA       GLY  10  11.104  -2.258  -2.830
   87    HA3  GLY  10          1HA       GLY  10  12.472  -2.386  -1.725
   88    H    ILE  11           HN       ILE  11  10.509  -0.983   0.213
   89    HA   ILE  11           HA       ILE  11   9.599  -3.415   1.469
   90    HB   ILE  11           HB       ILE  11   9.231  -0.516   2.310
   91   HG12  ILE  11          2HG1      ILE  11  11.399  -2.404   3.231
   92   HG13  ILE  11          1HG1      ILE  11  11.629  -1.207   1.961
   93   HG21  ILE  11          1HG2      ILE  11   7.748  -2.060   3.459
   94   HG22  ILE  11          2HG2      ILE  11   8.985  -1.467   4.570
   95   HG23  ILE  11          3HG2      ILE  11   9.116  -3.088   3.888
   96   HD11  ILE  11          1HD1      ILE  11  12.478  -0.405   4.087
   97   HD12  ILE  11          2HD1      ILE  11  10.893  -0.648   4.828
   98   HD13  ILE  11          3HD1      ILE  11  11.102   0.566   3.564
   99    H    CYS  12           HN       CYS  12   7.864  -4.166   0.384
  100    HA   CYS  12           HA       CYS  12   5.803  -2.289  -0.443
  101    HB2  CYS  12          2HB       CYS  12   6.122  -5.219  -1.093
  102    HB3  CYS  12          1HB       CYS  12   4.892  -4.132  -1.729
  103    H    TYR  13           HN       TYR  13   4.053  -2.036   0.663
  104    HA   TYR  13           HA       TYR  13   3.245  -4.171   2.435
  105    HB2  TYR  13          2HB       TYR  13   2.544  -2.429   4.096
  106    HB3  TYR  13          1HB       TYR  13   4.280  -2.524   3.865
  107    HD1  TYR  13          1HD       TYR  13   1.304  -0.448   3.539
  108    HD2  TYR  13          2HD       TYR  13   5.472  -0.674   2.711
  109    HE1  TYR  13          1HE       TYR  13   1.359   1.977   3.175
  110    HE2  TYR  13          2HE       TYR  13   5.543   1.740   2.344
  111    HH   TYR  13           HH       TYR  13   3.941   3.558   1.699
  112    H    ARG  14           HN       ARG  14   1.048  -4.319   2.710
  113    HA   ARG  14           HA       ARG  14  -0.431  -3.257   0.464
  114    HB2  ARG  14          2HB       ARG  14  -0.617  -5.646   0.967
  115    HB3  ARG  14          1HB       ARG  14  -1.242  -5.271   2.566
  116    HG2  ARG  14          2HG       ARG  14  -3.200  -4.236   1.568
  117    HG3  ARG  14          1HG       ARG  14  -2.574  -4.584  -0.045
  118    HD2  ARG  14          2HD       ARG  14  -4.209  -6.259   0.556
  119    HD3  ARG  14          1HD       ARG  14  -2.600  -6.978   0.505
  120    HE   ARG  14           HE       ARG  14  -3.061  -6.199   3.114
  121   HH11  ARG  14          1HH1      ARG  14  -4.365  -8.551   0.817
  122   HH12  ARG  14          2HH1      ARG  14  -4.942  -9.624   2.013
  123   HH21  ARG  14          1HH2      ARG  14  -3.829  -7.683   4.759
  124   HH22  ARG  14          2HH2      ARG  14  -4.617  -9.111   4.313
  125    H    LYS  15           HN       LYS  15  -0.949  -1.284   0.827
  126    HA   LYS  15           HA       LYS  15  -1.954  -0.386   3.393
  127    HB2  LYS  15          2HB       LYS  15  -0.408   1.036   2.103
  128    HB3  LYS  15          1HB       LYS  15  -1.553   1.058   0.773
  129    HG2  LYS  15          2HG       LYS  15  -1.651   3.141   1.976
  130    HG3  LYS  15          1HG       LYS  15  -3.158   2.253   2.196
  131    HD2  LYS  15          2HD       LYS  15  -2.413   1.508   4.394
  132    HD3  LYS  15          1HD       LYS  15  -0.876   2.349   4.170
  133    HE2  LYS  15          2HE       LYS  15  -2.354   3.687   5.542
  134    HE3  LYS  15          1HE       LYS  15  -2.085   4.469   3.991
  135    HZ1  LYS  15          1HZ       LYS  15  -4.250   3.643   3.241
  136    HZ2  LYS  15          2HZ       LYS  15  -4.391   4.601   4.579
  137    HZ3  LYS  15          3HZ       LYS  15  -4.540   2.937   4.750
  138    H    CYS  16           HN       CYS  16  -4.061  -0.094   3.783
  139    HA   CYS  16           HA       CYS  16  -5.899  -0.521   1.550
  140    HB2  CYS  16          2HB       CYS  16  -6.317  -1.215   4.465
  141    HB3  CYS  16          1HB       CYS  16  -7.466  -1.476   3.157
  142    H    ARG  17           HN       ARG  17  -7.434   0.929   1.230
  143    HA   ARG  17           HA       ARG  17  -7.809   3.029   3.233
  144    HB2  ARG  17          2HB       ARG  17  -6.350   3.741   1.281
  145    HB3  ARG  17          1HB       ARG  17  -7.741   3.475   0.250
  146    HG2  ARG  17          2HG       ARG  17  -9.011   5.152   1.451
  147    HG3  ARG  17          1HG       ARG  17  -7.659   5.418   2.545
  148    HD2  ARG  17          2HD       ARG  17  -6.287   6.106   0.588
  149    HD3  ARG  17          1HD       ARG  17  -7.728   5.937  -0.414
  150    HE   ARG  17           HE       ARG  17  -8.383   7.575   1.703
  151   HH11  ARG  17          1HH1      ARG  17  -6.207   7.715  -1.101
  152   HH12  ARG  17          2HH1      ARG  17  -6.275   9.406  -1.232
  153   HH21  ARG  17          1HH2      ARG  17  -8.453   9.903   1.518
  154   HH22  ARG  17          2HH2      ARG  17  -7.561  10.654   0.273
  155    H    GLY  18           HN       GLY  18  -9.851   2.834   3.864
  156    HA2  GLY  18          2HA       GLY  18 -12.145   2.781   3.713
  157    HA3  GLY  18          1HA       GLY  18 -12.001   2.771   1.956
  Start of MODEL    6
    1    H1   LYS   1           HN       LYS   1 -12.014   1.164   1.548
    2    HA   LYS   1           HA       LYS   1 -11.618  -1.425   2.911
    3    HB2  LYS   1          2HB       LYS   1 -13.662  -0.639   0.846
    4    HB3  LYS   1          1HB       LYS   1 -13.554  -2.191   1.655
    5    HG2  LYS   1          2HG       LYS   1 -14.084  -1.151   3.774
    6    HG3  LYS   1          1HG       LYS   1 -14.126   0.435   3.000
    7    HD2  LYS   1          2HD       LYS   1 -15.929  -0.334   1.542
    8    HD3  LYS   1          1HD       LYS   1 -15.898  -1.900   2.345
    9    HE2  LYS   1          2HE       LYS   1 -16.475  -0.824   4.454
   10    HE3  LYS   1          1HE       LYS   1 -16.521   0.741   3.640
   11    HZ1  LYS   1          1HZ       LYS   1 -18.744  -0.184   3.843
   12    HZ2  LYS   1          2HZ       LYS   1 -18.263  -1.581   3.039
   13    HZ3  LYS   1          3HZ       LYS   1 -18.285  -0.100   2.229
   14    H    TRP   2           HN       TRP   2 -10.257   0.389   0.578
   15    HA   TRP   2           HA       TRP   2 -10.063  -1.773  -1.395
   16    HB2  TRP   2          2HB       TRP   2 -10.794   0.608  -2.024
   17    HB3  TRP   2          1HB       TRP   2  -9.133   1.077  -1.700
   18    HD1  TRP   2          1HD       TRP   2  -7.281  -0.546  -3.229
   19    HE1  TRP   2          1HE       TRP   2  -7.457  -1.054  -5.761
   20    HE3  TRP   2          3HE       TRP   2 -12.250   0.401  -3.907
   21    HZ2  TRP   2          2HZ       TRP   2  -9.432  -1.032  -7.764
   22    HZ3  TRP   2          3HZ       TRP   2 -13.207   0.141  -6.160
   23    HH2  TRP   2          2HH       TRP   2 -11.822  -0.558  -8.045
   24    H    CYS   3           HN       CYS   3  -8.254  -2.968  -1.248
   25    HA   CYS   3           HA       CYS   3  -5.912  -1.763   0.029
   26    HB2  CYS   3          2HB       CYS   3  -6.673  -4.637  -0.332
   27    HB3  CYS   3          1HB       CYS   3  -5.244  -4.065   0.520
   28    H    PHE   4           HN       PHE   4  -4.012  -1.675  -1.005
   29    HA   PHE   4           HA       PHE   4  -3.603  -3.130  -3.462
   30    HB2  PHE   4          2HB       PHE   4  -2.960  -1.042  -4.705
   31    HB3  PHE   4          1HB       PHE   4  -4.671  -1.139  -4.335
   32    HD1  PHE   4          1HD       PHE   4  -5.569   0.249  -2.411
   33    HD2  PHE   4          2HD       PHE   4  -1.660   0.790  -4.005
   34    HE1  PHE   4          1HE       PHE   4  -5.481   2.482  -1.414
   35    HE2  PHE   4          2HE       PHE   4  -1.569   3.031  -2.994
   36    HZ   PHE   4           HZ       PHE   4  -3.473   3.876  -1.697
   37    H    ARG   5           HN       ARG   5  -1.372  -3.076  -4.140
   38    HA   ARG   5           HA       ARG   5   0.366  -3.092  -1.832
   39    HB2  ARG   5          2HB       ARG   5   0.488  -4.971  -3.343
   40    HB3  ARG   5          1HB       ARG   5   0.813  -3.909  -4.700
   41    HG2  ARG   5          2HG       ARG   5   2.977  -3.323  -3.735
   42    HG3  ARG   5          1HG       ARG   5   2.649  -4.376  -2.357
   43    HD2  ARG   5          2HD       ARG   5   2.564  -6.310  -3.795
   44    HD3  ARG   5          1HD       ARG   5   2.696  -5.271  -5.215
   45    HE   ARG   5           HE       ARG   5   4.928  -4.641  -4.226
   46   HH11  ARG   5          1HH1      ARG   5   3.544  -7.893  -3.778
   47   HH12  ARG   5          2HH1      ARG   5   5.044  -8.678  -3.768
   48   HH21  ARG   5          1HH2      ARG   5   7.023  -5.787  -4.217
   49   HH22  ARG   5          2HH2      ARG   5   7.046  -7.465  -4.005
   50    H    VAL   6           HN       VAL   6   1.628  -1.553  -1.261
   51    HA   VAL   6           HA       VAL   6   2.404   0.545  -3.175
   52    HB   VAL   6           HB       VAL   6   2.263   0.730  -0.146
   53   HG11  VAL   6          1HG1      VAL   6   2.657   2.880  -2.224
   54   HG12  VAL   6          2HG1      VAL   6   3.882   2.246  -1.127
   55   HG13  VAL   6          3HG1      VAL   6   2.507   3.144  -0.486
   56   HG21  VAL   6          1HG2      VAL   6   0.007   0.498  -1.024
   57   HG22  VAL   6          2HG2      VAL   6   0.297   1.806  -2.170
   58   HG23  VAL   6          3HG2      VAL   6   0.269   2.137  -0.438
   59    H    CYS   7           HN       CYS   7   4.545   0.552  -3.590
   60    HA   CYS   7           HA       CYS   7   6.294  -0.803  -1.687
   61    HB2  CYS   7          2HB       CYS   7   6.595  -0.395  -4.667
   62    HB3  CYS   7          1HB       CYS   7   7.878  -1.003  -3.626
   63    H    TYR   8           HN       TYR   8   7.466   0.410  -0.546
   64    HA   TYR   8           HA       TYR   8   8.333   3.021  -1.564
   65    HB2  TYR   8          2HB       TYR   8   6.379   3.261  -0.081
   66    HB3  TYR   8          1HB       TYR   8   7.241   2.386   1.175
   67    HD1  TYR   8          1HD       TYR   8   9.047   3.522   2.435
   68    HD2  TYR   8          2HD       TYR   8   6.931   5.547  -0.646
   69    HE1  TYR   8          1HE       TYR   8   9.926   5.638   3.239
   70    HE2  TYR   8          2HE       TYR   8   7.821   7.683   0.139
   71    HH   TYR   8           HH       TYR   8   8.728   8.633   2.270
   72    H    ARG   9           HN       ARG   9  10.489   2.728  -1.734
   73    HA   ARG   9           HA       ARG   9  12.681   2.394  -1.167
   74    HB2  ARG   9          2HB       ARG   9  11.563   2.435   1.639
   75    HB3  ARG   9          1HB       ARG   9  13.276   2.395   1.261
   76    HG2  ARG   9          2HG       ARG   9  13.063   4.554   0.120
   77    HG3  ARG   9          1HG       ARG   9  11.346   4.569   0.503
   78    HD2  ARG   9          2HD       ARG   9  12.730   5.930   2.057
   79    HD3  ARG   9          1HD       ARG   9  11.785   4.669   2.848
   80    HE   ARG   9           HE       ARG   9  14.128   3.452   2.474
   81   HH11  ARG   9          1HH1      ARG   9  13.435   6.651   3.777
   82   HH12  ARG   9          2HH1      ARG   9  14.697   6.638   4.905
   83   HH21  ARG   9          1HH2      ARG   9  15.884   3.409   4.021
   84   HH22  ARG   9          2HH2      ARG   9  16.137   4.751   5.028
   85    H    GLY  10           HN       GLY  10  10.894   0.100  -1.614
   86    HA2  GLY  10          2HA       GLY  10  11.644  -2.144  -1.909
   87    HA3  GLY  10          1HA       GLY  10  12.661  -1.945  -0.482
   88    H    ILE  11           HN       ILE  11  10.174  -0.547   0.675
   89    HA   ILE  11           HA       ILE  11   9.188  -2.909   2.006
   90    HB   ILE  11           HB       ILE  11   8.348  -0.017   2.376
   91   HG12  ILE  11          2HG1      ILE  11  10.404  -1.540   3.971
   92   HG13  ILE  11          1HG1      ILE  11  10.818  -0.421   2.678
   93   HG21  ILE  11          1HG2      ILE  11   6.812  -1.695   3.313
   94   HG22  ILE  11          2HG2      ILE  11   7.617  -0.784   4.589
   95   HG23  ILE  11          3HG2      ILE  11   8.152  -2.419   4.202
   96   HD11  ILE  11          1HD1      ILE  11   9.777   1.400   3.938
   97   HD12  ILE  11          2HD1      ILE  11  11.033   0.600   4.885
   98   HD13  ILE  11          3HD1      ILE  11   9.333   0.263   5.213
   99    H    CYS  12           HN       CYS  12   7.825  -3.976   0.704
  100    HA   CYS  12           HA       CYS  12   5.738  -2.416  -0.586
  101    HB2  CYS  12          2HB       CYS  12   6.560  -5.284  -1.075
  102    HB3  CYS  12          1HB       CYS  12   5.234  -4.430  -1.864
  103    H    TYR  13           HN       TYR  13   3.976  -2.252   0.495
  104    HA   TYR  13           HA       TYR  13   3.071  -4.522   2.085
  105    HB2  TYR  13          2HB       TYR  13   2.254  -2.920   3.810
  106    HB3  TYR  13          1HB       TYR  13   4.002  -2.915   3.660
  107    HD1  TYR  13          1HD       TYR  13   1.001  -0.930   3.572
  108    HD2  TYR  13          2HD       TYR  13   5.087  -0.975   2.380
  109    HE1  TYR  13          1HE       TYR  13   0.958   1.502   3.322
  110    HE2  TYR  13          2HE       TYR  13   5.047   1.449   2.122
  111    HH   TYR  13           HH       TYR  13   3.440   3.252   1.771
  112    H    ARG  14           HN       ARG  14   0.788  -4.591   2.319
  113    HA   ARG  14           HA       ARG  14  -0.510  -3.351   0.041
  114    HB2  ARG  14          2HB       ARG  14  -0.809  -5.794   0.328
  115    HB3  ARG  14          1HB       ARG  14  -1.504  -5.507   1.912
  116    HG2  ARG  14          2HG       ARG  14  -3.346  -4.318   0.926
  117    HG3  ARG  14          1HG       ARG  14  -2.670  -4.549  -0.687
  118    HD2  ARG  14          2HD       ARG  14  -3.427  -6.801   1.169
  119    HD3  ARG  14          1HD       ARG  14  -4.512  -6.155  -0.061
  120    HE   ARG  14           HE       ARG  14  -2.118  -6.876  -1.302
  121   HH11  ARG  14          1HH1      ARG  14  -4.783  -8.502   0.407
  122   HH12  ARG  14          2HH1      ARG  14  -4.666  -9.940  -0.492
  123   HH21  ARG  14          1HH2      ARG  14  -1.964  -8.895  -2.538
  124   HH22  ARG  14          2HH2      ARG  14  -3.038 -10.166  -2.175
  125    H    LYS  15           HN       LYS  15  -0.988  -1.388   0.545
  126    HA   LYS  15           HA       LYS  15  -1.936  -0.668   3.160
  127    HB2  LYS  15          2HB       LYS  15  -0.426   0.853   1.975
  128    HB3  LYS  15          1HB       LYS  15  -1.555   0.964   0.645
  129    HG2  LYS  15          2HG       LYS  15  -1.619   2.965   2.053
  130    HG3  LYS  15          1HG       LYS  15  -3.165   2.120   2.057
  131    HD2  LYS  15          2HD       LYS  15  -2.587   1.101   4.225
  132    HD3  LYS  15          1HD       LYS  15  -1.054   1.975   4.221
  133    HE2  LYS  15          2HE       LYS  15  -3.786   3.258   4.158
  134    HE3  LYS  15          1HE       LYS  15  -2.805   3.055   5.606
  135    HZ1  LYS  15          1HZ       LYS  15  -1.142   4.468   4.684
  136    HZ2  LYS  15          2HZ       LYS  15  -2.627   5.276   4.581
  137    HZ3  LYS  15          3HZ       LYS  15  -1.943   4.587   3.214
  138    H    CYS  16           HN       CYS  16  -3.966  -0.318   3.678
  139    HA   CYS  16           HA       CYS  16  -5.964  -0.654   1.590
  140    HB2  CYS  16          2HB       CYS  16  -6.156  -1.157   4.561
  141    HB3  CYS  16          1HB       CYS  16  -7.480  -1.341   3.416
  142    H    ARG  17           HN       ARG  17  -6.907   1.039   0.979
  143    HA   ARG  17           HA       ARG  17  -7.095   3.390   2.716
  144    HB2  ARG  17          2HB       ARG  17  -5.989   3.694   0.525
  145    HB3  ARG  17          1HB       ARG  17  -7.404   3.038  -0.276
  146    HG2  ARG  17          2HG       ARG  17  -8.718   4.951   0.486
  147    HG3  ARG  17          1HG       ARG  17  -7.282   5.615   1.277
  148    HD2  ARG  17          2HD       ARG  17  -6.130   5.689  -0.873
  149    HD3  ARG  17          1HD       ARG  17  -7.546   4.999  -1.650
  150    HE   ARG  17           HE       ARG  17  -8.310   7.325  -0.317
  151   HH11  ARG  17          1HH1      ARG  17  -6.432   6.319  -3.154
  152   HH12  ARG  17          2HH1      ARG  17  -6.615   7.795  -3.970
  153   HH21  ARG  17          1HH2      ARG  17  -8.614   9.318  -1.468
  154   HH22  ARG  17          2HH2      ARG  17  -7.928   9.549  -3.010
  155    H    GLY  18           HN       GLY  18  -8.924   3.108   3.849
  156    HA2  GLY  18          2HA       GLY  18 -11.152   2.861   4.283
  157    HA3  GLY  18          1HA       GLY  18 -11.449   2.944   2.546
  Start of MODEL    7
    1    H1   LYS   1           HN       LYS   1 -11.520   1.526   1.005
    2    HA   LYS   1           HA       LYS   1 -11.308  -1.055   2.355
    3    HB2  LYS   1          2HB       LYS   1 -13.196  -1.919   1.019
    4    HB3  LYS   1          1HB       LYS   1 -13.688  -0.614   2.081
    5    HG2  LYS   1          2HG       LYS   1 -13.711   0.926   0.193
    6    HG3  LYS   1          1HG       LYS   1 -13.165  -0.370  -0.874
    7    HD2  LYS   1          2HD       LYS   1 -15.201  -1.636  -0.378
    8    HD3  LYS   1          1HD       LYS   1 -15.745  -0.350   0.698
    9    HE2  LYS   1          2HE       LYS   1 -16.853  -0.178  -1.456
   10    HE3  LYS   1          1HE       LYS   1 -15.790   1.203  -1.206
   11    HZ1  LYS   1          1HZ       LYS   1 -15.602   0.359  -3.437
   12    HZ2  LYS   1          2HZ       LYS   1 -15.210  -1.183  -2.876
   13    HZ3  LYS   1          3HZ       LYS   1 -14.145   0.100  -2.628
   14    H    TRP   2           HN       TRP   2 -10.041   0.916   0.097
   15    HA   TRP   2           HA       TRP   2  -9.590  -1.006  -2.007
   16    HB2  TRP   2          2HB       TRP   2  -9.810   1.515  -2.378
   17    HB3  TRP   2          1HB       TRP   2  -8.252   1.682  -1.590
   18    HD1  TRP   2          1HD       TRP   2  -6.333  -0.152  -2.956
   19    HE1  TRP   2          1HE       TRP   2  -5.879  -0.147  -5.515
   20    HE3  TRP   2          3HE       TRP   2 -10.606   2.145  -4.531
   21    HZ2  TRP   2          2HZ       TRP   2  -7.153   0.760  -7.842
   22    HZ3  TRP   2          3HZ       TRP   2 -10.909   2.556  -6.934
   23    HH2  TRP   2          2HH       TRP   2  -9.218   1.880  -8.547
   24    H    CYS   3           HN       CYS   3  -8.163  -2.564  -1.605
   25    HA   CYS   3           HA       CYS   3  -5.784  -1.924  -0.001
   26    HB2  CYS   3          2HB       CYS   3  -6.980  -4.600  -0.707
   27    HB3  CYS   3          1HB       CYS   3  -5.558  -4.343   0.292
   28    H    PHE   4           HN       PHE   4  -3.875  -1.874  -1.009
   29    HA   PHE   4           HA       PHE   4  -3.547  -3.394  -3.420
   30    HB2  PHE   4          2HB       PHE   4  -2.824  -1.529  -4.798
   31    HB3  PHE   4          1HB       PHE   4  -4.465  -1.259  -4.250
   32    HD1  PHE   4          1HD       PHE   4  -1.356   0.203  -4.752
   33    HD2  PHE   4          2HD       PHE   4  -4.607   0.249  -2.009
   34    HE1  PHE   4          1HE       PHE   4  -0.703   2.462  -4.008
   35    HE2  PHE   4          2HE       PHE   4  -3.956   2.497  -1.268
   36    HZ   PHE   4           HZ       PHE   4  -2.002   3.603  -2.272
   37    H    ARG   5           HN       ARG   5  -1.305  -3.285  -4.176
   38    HA   ARG   5           HA       ARG   5   0.454  -3.513  -1.937
   39    HB2  ARG   5          2HB       ARG   5   0.630  -5.157  -3.699
   40    HB3  ARG   5          1HB       ARG   5   0.850  -3.902  -4.903
   41    HG2  ARG   5          2HG       ARG   5   3.003  -3.317  -3.896
   42    HG3  ARG   5          1HG       ARG   5   2.784  -4.599  -2.706
   43    HD2  ARG   5          2HD       ARG   5   2.809  -6.276  -4.415
   44    HD3  ARG   5          1HD       ARG   5   2.771  -5.031  -5.667
   45    HE   ARG   5           HE       ARG   5   5.005  -4.478  -4.227
   46   HH11  ARG   5          1HH1      ARG   5   3.905  -7.372  -5.980
   47   HH12  ARG   5          2HH1      ARG   5   5.461  -7.840  -6.449
   48   HH21  ARG   5          1HH2      ARG   5   7.143  -5.132  -4.886
   49   HH22  ARG   5          2HH2      ARG   5   7.349  -6.537  -5.817
   50    H    VAL   6           HN       VAL   6   1.626  -1.975  -1.193
   51    HA   VAL   6           HA       VAL   6   2.244   0.344  -2.886
   52    HB   VAL   6           HB       VAL   6   2.122   0.258   0.138
   53   HG11  VAL   6          1HG1      VAL   6   2.157   2.689  -0.006
   54   HG12  VAL   6          2HG1      VAL   6   2.259   2.586  -1.761
   55   HG13  VAL   6          3HG1      VAL   6   3.581   1.976  -0.765
   56   HG21  VAL   6          1HG2      VAL   6   0.041   1.291  -1.779
   57   HG22  VAL   6          2HG2      VAL   6   0.029   1.531  -0.034
   58   HG23  VAL   6          3HG2      VAL   6  -0.120  -0.098  -0.701
   59    H    CYS   7           HN       CYS   7   4.358   0.374  -3.394
   60    HA   CYS   7           HA       CYS   7   6.174  -0.853  -1.473
   61    HB2  CYS   7          2HB       CYS   7   6.550  -0.396  -4.443
   62    HB3  CYS   7          1HB       CYS   7   7.774  -1.056  -3.362
   63    H    TYR   8           HN       TYR   8   7.270   0.414  -0.335
   64    HA   TYR   8           HA       TYR   8   7.881   3.147  -1.247
   65    HB2  TYR   8          2HB       TYR   8   6.042   3.062   0.419
   66    HB3  TYR   8          1HB       TYR   8   7.080   2.142   1.490
   67    HD1  TYR   8          1HD       TYR   8   8.678   3.231   2.886
   68    HD2  TYR   8          2HD       TYR   8   6.526   5.446  -0.026
   69    HE1  TYR   8          1HE       TYR   8   9.415   5.288   3.929
   70    HE2  TYR   8          2HE       TYR   8   7.260   7.534   1.001
   71    HH   TYR   8           HH       TYR   8   8.057   8.333   3.156
   72    H    ARG   9           HN       ARG   9  10.050   3.191  -1.492
   73    HA   ARG   9           HA       ARG   9  12.299   2.909  -1.165
   74    HB2  ARG   9          2HB       ARG   9  11.467   2.093   1.634
   75    HB3  ARG   9          1HB       ARG   9  13.121   2.374   1.133
   76    HG2  ARG   9          2HG       ARG   9  12.603   4.728   0.737
   77    HG3  ARG   9          1HG       ARG   9  10.924   4.430   1.185
   78    HD2  ARG   9          2HD       ARG   9  12.224   5.384   3.055
   79    HD3  ARG   9          1HD       ARG   9  11.578   3.787   3.419
   80    HE   ARG   9           HE       ARG   9  14.254   3.755   2.377
   81   HH11  ARG   9          1HH1      ARG   9  12.311   3.933   5.350
   82   HH12  ARG   9          2HH1      ARG   9  13.577   3.450   6.368
   83   HH21  ARG   9          1HH2      ARG   9  15.998   3.035   3.809
   84   HH22  ARG   9          2HH2      ARG   9  15.700   2.935   5.475
   85    H    GLY  10           HN       GLY  10  10.446   0.660  -1.921
   86    HA2  GLY  10          2HA       GLY  10  11.017  -1.477  -2.755
   87    HA3  GLY  10          1HA       GLY  10  12.386  -1.494  -1.645
   88    H    ILE  11           HN       ILE  11  10.155  -0.448   0.305
   89    HA   ILE  11           HA       ILE  11   9.630  -3.054   1.444
   90    HB   ILE  11           HB       ILE  11   8.737  -0.326   2.432
   91   HG12  ILE  11          2HG1      ILE  11  11.240  -1.781   3.291
   92   HG13  ILE  11          1HG1      ILE  11  11.247  -0.541   2.043
   93   HG21  ILE  11          1HG2      ILE  11   9.183  -2.963   3.841
   94   HG22  ILE  11          2HG2      ILE  11   7.621  -2.240   3.456
   95   HG23  ILE  11          3HG2      ILE  11   8.693  -1.459   4.620
   96   HD11  ILE  11          1HD1      ILE  11  10.399  -0.169   4.921
   97   HD12  ILE  11          2HD1      ILE  11  10.401   1.091   3.686
   98   HD13  ILE  11          3HD1      ILE  11  11.920   0.371   4.211
   99    H    CYS  12           HN       CYS  12   7.915  -4.062   0.608
  100    HA   CYS  12           HA       CYS  12   5.699  -2.445  -0.377
  101    HB2  CYS  12          2HB       CYS  12   6.318  -5.351  -0.940
  102    HB3  CYS  12          1HB       CYS  12   5.035  -4.397  -1.671
  103    H    TYR  13           HN       TYR  13   3.791  -2.487   0.540
  104    HA   TYR  13           HA       TYR  13   3.150  -4.583   2.410
  105    HB2  TYR  13          2HB       TYR  13   2.396  -2.867   4.083
  106    HB3  TYR  13          1HB       TYR  13   4.136  -2.913   3.864
  107    HD1  TYR  13          1HD       TYR  13   5.258  -1.047   2.620
  108    HD2  TYR  13          2HD       TYR  13   1.127  -0.898   3.620
  109    HE1  TYR  13          1HE       TYR  13   5.269   1.360   2.250
  110    HE2  TYR  13          2HE       TYR  13   1.127   1.530   3.246
  111    HH   TYR  13           HH       TYR  13   3.633   3.175   1.691
  112    H    ARG  14           HN       ARG  14   0.941  -4.797   2.694
  113    HA   ARG  14           HA       ARG  14  -0.631  -3.731   0.524
  114    HB2  ARG  14          2HB       ARG  14  -0.855  -6.108   1.056
  115    HB3  ARG  14          1HB       ARG  14  -1.279  -5.712   2.709
  116    HG2  ARG  14          2HG       ARG  14  -3.363  -4.746   2.010
  117    HG3  ARG  14          1HG       ARG  14  -2.932  -4.944   0.310
  118    HD2  ARG  14          2HD       ARG  14  -2.890  -7.352   0.583
  119    HD3  ARG  14          1HD       ARG  14  -3.240  -7.186   2.299
  120    HE   ARG  14           HE       ARG  14  -5.421  -6.393   1.730
  121   HH11  ARG  14          1HH1      ARG  14  -3.651  -7.758  -1.001
  122   HH12  ARG  14          2HH1      ARG  14  -5.022  -8.230  -1.867
  123   HH21  ARG  14          1HH2      ARG  14  -7.333  -7.072   0.571
  124   HH22  ARG  14          2HH2      ARG  14  -7.178  -7.826  -0.953
  125    H    LYS  15           HN       LYS  15  -1.195  -1.733   0.872
  126    HA   LYS  15           HA       LYS  15  -2.184  -0.998   3.507
  127    HB2  LYS  15          2HB       LYS  15  -0.588   0.565   2.559
  128    HB3  LYS  15          1HB       LYS  15  -1.543   0.689   1.092
  129    HG2  LYS  15          2HG       LYS  15  -1.805   2.687   2.472
  130    HG3  LYS  15          1HG       LYS  15  -3.325   1.820   2.319
  131    HD2  LYS  15          2HD       LYS  15  -3.068   2.596   4.596
  132    HD3  LYS  15          1HD       LYS  15  -2.952   0.842   4.572
  133    HE2  LYS  15          2HE       LYS  15  -0.522   0.997   4.738
  134    HE3  LYS  15          1HE       LYS  15  -0.614   2.757   4.680
  135    HZ1  LYS  15          1HZ       LYS  15  -1.821   2.726   6.782
  136    HZ2  LYS  15          2HZ       LYS  15  -0.362   1.898   6.963
  137    HZ3  LYS  15          3HZ       LYS  15  -1.792   1.050   6.816
  138    H    CYS  16           HN       CYS  16  -4.226  -0.798   3.902
  139    HA   CYS  16           HA       CYS  16  -6.092  -0.846   1.665
  140    HB2  CYS  16          2HB       CYS  16  -6.463  -1.698   4.548
  141    HB3  CYS  16          1HB       CYS  16  -7.744  -1.653   3.340
  142    H    ARG  17           HN       ARG  17  -6.710   1.039   1.194
  143    HA   ARG  17           HA       ARG  17  -6.947   3.102   3.258
  144    HB2  ARG  17          2HB       ARG  17  -5.394   3.520   1.357
  145    HB3  ARG  17          1HB       ARG  17  -6.744   3.343   0.249
  146    HG2  ARG  17          2HG       ARG  17  -7.814   5.288   1.256
  147    HG3  ARG  17          1HG       ARG  17  -6.446   5.468   2.350
  148    HD2  ARG  17          2HD       ARG  17  -4.946   5.776   0.461
  149    HD3  ARG  17          1HD       ARG  17  -6.291   5.570  -0.660
  150    HE   ARG  17           HE       ARG  17  -7.176   7.582   0.783
  151   HH11  ARG  17          1HH1      ARG  17  -3.984   7.086  -0.638
  152   HH12  ARG  17          2HH1      ARG  17  -3.638   8.735  -0.826
  153   HH21  ARG  17          1HH2      ARG  17  -6.711   9.839   0.537
  154   HH22  ARG  17          2HH2      ARG  17  -5.240  10.351  -0.159
  155    H    GLY  18           HN       GLY  18  -8.981   3.085   3.986
  156    HA2  GLY  18          2HA       GLY  18 -11.284   3.188   3.953
  157    HA3  GLY  18          1HA       GLY  18 -11.221   3.294   2.187
  Start of MODEL    8
    1    H1   LYS   1           HN       LYS   1 -11.664   1.242   0.965
    2    HA   LYS   1           HA       LYS   1 -11.889  -1.218   2.530
    3    HB2  LYS   1          2HB       LYS   1 -13.944  -1.818   1.290
    4    HB3  LYS   1          1HB       LYS   1 -14.161  -0.376   2.272
    5    HG2  LYS   1          2HG       LYS   1 -13.784   0.988   0.229
    6    HG3  LYS   1          1HG       LYS   1 -13.785  -0.504  -0.712
    7    HD2  LYS   1          2HD       LYS   1 -16.051  -0.979   0.092
    8    HD3  LYS   1          1HD       LYS   1 -16.035   0.525   1.012
    9    HE2  LYS   1          2HE       LYS   1 -15.842   0.256  -1.987
   10    HE3  LYS   1          1HE       LYS   1 -17.237   0.823  -1.074
   11    HZ1  LYS   1          1HZ       LYS   1 -15.856   2.718  -0.301
   12    HZ2  LYS   1          2HZ       LYS   1 -16.024   2.683  -1.973
   13    HZ3  LYS   1          3HZ       LYS   1 -14.599   2.176  -1.287
   14    H    TRP   2           HN       TRP   2 -10.167   0.278   0.397
   15    HA   TRP   2           HA       TRP   2 -10.005  -1.940  -1.527
   16    HB2  TRP   2          2HB       TRP   2 -10.607   0.390  -2.372
   17    HB3  TRP   2          1HB       TRP   2  -8.993   0.883  -1.882
   18    HD1  TRP   2          1HD       TRP   2  -6.938  -0.638  -3.163
   19    HE1  TRP   2          1HE       TRP   2  -6.852  -1.359  -5.628
   20    HE3  TRP   2          3HE       TRP   2 -11.878  -0.157  -4.290
   21    HZ2  TRP   2          2HZ       TRP   2  -8.664  -1.668  -7.776
   22    HZ3  TRP   2          3HZ       TRP   2 -12.617  -0.669  -6.556
   23    HH2  TRP   2          2HH       TRP   2 -11.053  -1.410  -8.265
   24    H    CYS   3           HN       CYS   3  -8.086  -3.054  -1.485
   25    HA   CYS   3           HA       CYS   3  -5.893  -1.834   0.024
   26    HB2  CYS   3          2HB       CYS   3  -6.536  -4.761  -0.320
   27    HB3  CYS   3          1HB       CYS   3  -5.168  -4.100   0.562
   28    H    PHE   4           HN       PHE   4  -3.952  -1.689  -0.946
   29    HA   PHE   4           HA       PHE   4  -3.481  -3.237  -3.307
   30    HB2  PHE   4          2HB       PHE   4  -2.884  -1.286  -4.701
   31    HB3  PHE   4          1HB       PHE   4  -4.583  -1.306  -4.275
   32    HD1  PHE   4          1HD       PHE   4  -5.325   0.243  -2.346
   33    HD2  PHE   4          2HD       PHE   4  -1.590   0.591  -4.344
   34    HE1  PHE   4          1HE       PHE   4  -5.165   2.578  -1.626
   35    HE2  PHE   4          2HE       PHE   4  -1.415   2.927  -3.613
   36    HZ   PHE   4           HZ       PHE   4  -3.211   3.928  -2.249
   37    H    ARG   5           HN       ARG   5  -1.268  -2.868  -4.110
   38    HA   ARG   5           HA       ARG   5   0.468  -3.086  -1.842
   39    HB2  ARG   5          2HB       ARG   5   0.621  -4.639  -3.760
   40    HB3  ARG   5          1HB       ARG   5   1.072  -3.293  -4.792
   41    HG2  ARG   5          2HG       ARG   5   3.073  -2.942  -3.352
   42    HG3  ARG   5          1HG       ARG   5   2.641  -4.417  -2.485
   43    HD2  ARG   5          2HD       ARG   5   4.301  -4.919  -4.165
   44    HD3  ARG   5          1HD       ARG   5   2.756  -5.659  -4.600
   45    HE   ARG   5           HE       ARG   5   2.674  -3.301  -5.893
   46   HH11  ARG   5          1HH1      ARG   5   5.083  -5.867  -5.859
   47   HH12  ARG   5          2HH1      ARG   5   5.681  -5.537  -7.416
   48   HH21  ARG   5          1HH2      ARG   5   3.458  -2.821  -8.006
   49   HH22  ARG   5          2HH2      ARG   5   4.710  -3.757  -8.684
   50    H    VAL   6           HN       VAL   6   1.650  -1.543  -1.090
   51    HA   VAL   6           HA       VAL   6   2.332   0.746  -2.795
   52    HB   VAL   6           HB       VAL   6   1.874   0.755   0.219
   53   HG11  VAL   6          1HG1      VAL   6   2.538   3.030  -1.648
   54   HG12  VAL   6          2HG1      VAL   6   3.619   2.324  -0.446
   55   HG13  VAL   6          3HG1      VAL   6   2.169   3.186   0.070
   56   HG21  VAL   6          1HG2      VAL   6  -0.045   2.201  -0.258
   57   HG22  VAL   6          2HG2      VAL   6  -0.225   0.614  -1.007
   58   HG23  VAL   6          3HG2      VAL   6   0.241   2.004  -1.987
   59    H    CYS   7           HN       CYS   7   4.461   0.967  -3.061
   60    HA   CYS   7           HA       CYS   7   6.199  -0.538  -1.257
   61    HB2  CYS   7          2HB       CYS   7   6.643   0.199  -4.147
   62    HB3  CYS   7          1HB       CYS   7   7.802  -0.622  -3.108
   63    H    TYR   8           HN       TYR   8   7.564   0.480  -0.098
   64    HA   TYR   8           HA       TYR   8   8.369   3.189  -0.850
   65    HB2  TYR   8          2HB       TYR   8   7.003   3.393   1.111
   66    HB3  TYR   8          1HB       TYR   8   7.792   2.024   1.880
   67    HD1  TYR   8          1HD       TYR   8   9.263   2.519   3.570
   68    HD2  TYR   8          2HD       TYR   8   8.775   5.338   0.434
   69    HE1  TYR   8          1HE       TYR   8  10.843   4.020   4.690
   70    HE2  TYR   8          2HE       TYR   8  10.339   6.853   1.539
   71    HH   TYR   8           HH       TYR   8  11.246   7.275   3.717
   72    H    ARG   9           HN       ARG   9  10.311   2.864  -1.734
   73    HA   ARG   9           HA       ARG   9  12.470   2.262  -2.041
   74    HB2  ARG   9          2HB       ARG   9  12.453   2.262   0.980
   75    HB3  ARG   9          1HB       ARG   9  13.903   2.260  -0.012
   76    HG2  ARG   9          2HG       ARG   9  13.174   4.434  -0.986
   77    HG3  ARG   9          1HG       ARG   9  11.807   4.404   0.115
   78    HD2  ARG   9          2HD       ARG   9  13.262   4.414   2.026
   79    HD3  ARG   9          1HD       ARG   9  14.686   4.336   0.990
   80    HE   ARG   9           HE       ARG   9  13.192   6.535   0.213
   81   HH11  ARG   9          1HH1      ARG   9  15.028   5.502   3.046
   82   HH12  ARG   9          2HH1      ARG   9  15.466   7.071   3.530
   83   HH21  ARG   9          1HH2      ARG   9  13.753   8.728   0.910
   84   HH22  ARG   9          2HH2      ARG   9  14.705   8.950   2.294
   85    H    GLY  10           HN       GLY  10  10.638   0.127  -2.125
   86    HA2  GLY  10          2HA       GLY  10  11.199  -2.128  -2.716
   87    HA3  GLY  10          1HA       GLY  10  12.475  -2.070  -1.503
   88    H    ILE  11           HN       ILE  11  10.504  -0.767   0.354
   89    HA   ILE  11           HA       ILE  11   9.572  -3.206   1.557
   90    HB   ILE  11           HB       ILE  11   9.083  -0.319   2.375
   91   HG12  ILE  11          2HG1      ILE  11  11.202  -2.201   3.418
   92   HG13  ILE  11          1HG1      ILE  11  11.504  -0.983   2.185
   93   HG21  ILE  11          1HG2      ILE  11   8.914  -2.881   3.970
   94   HG22  ILE  11          2HG2      ILE  11   7.541  -1.930   3.406
   95   HG23  ILE  11          3HG2      ILE  11   8.652  -1.254   4.598
   96   HD11  ILE  11          1HD1      ILE  11  12.204  -0.255   4.421
   97   HD12  ILE  11          2HD1      ILE  11  10.540  -0.423   4.991
   98   HD13  ILE  11          3HD1      ILE  11  10.940   0.774   3.759
   99    H    CYS  12           HN       CYS  12   7.924  -4.045   0.394
  100    HA   CYS  12           HA       CYS  12   5.751  -2.260  -0.390
  101    HB2  CYS  12          2HB       CYS  12   6.330  -5.087  -1.277
  102    HB3  CYS  12          1HB       CYS  12   5.047  -4.044  -1.885
  103    H    TYR  13           HN       TYR  13   3.820  -2.368   0.506
  104    HA   TYR  13           HA       TYR  13   3.196  -4.657   2.159
  105    HB2  TYR  13          2HB       TYR  13   2.350  -3.036   3.921
  106    HB3  TYR  13          1HB       TYR  13   4.095  -3.165   3.781
  107    HD1  TYR  13          1HD       TYR  13   5.427  -1.275   3.221
  108    HD2  TYR  13          2HD       TYR  13   1.191  -1.005   3.012
  109    HE1  TYR  13          1HE       TYR  13   5.602   1.156   2.985
  110    HE2  TYR  13          2HE       TYR  13   1.368   1.432   2.766
  111    HH   TYR  13           HH       TYR  13   4.237   3.041   2.098
  112    H    ARG  14           HN       ARG  14   0.956  -4.758   2.679
  113    HA   ARG  14           HA       ARG  14  -0.730  -3.810   0.546
  114    HB2  ARG  14          2HB       ARG  14  -1.068  -6.074   1.289
  115    HB3  ARG  14          1HB       ARG  14  -1.190  -5.563   2.964
  116    HG2  ARG  14          2HG       ARG  14  -3.302  -4.426   2.446
  117    HG3  ARG  14          1HG       ARG  14  -3.167  -4.973   0.772
  118    HD2  ARG  14          2HD       ARG  14  -3.285  -7.268   1.456
  119    HD3  ARG  14          1HD       ARG  14  -3.219  -6.818   3.154
  120    HE   ARG  14           HE       ARG  14  -5.399  -5.617   2.608
  121   HH11  ARG  14          1HH1      ARG  14  -4.427  -8.622   1.002
  122   HH12  ARG  14          2HH1      ARG  14  -6.005  -9.247   0.888
  123   HH21  ARG  14          1HH2      ARG  14  -7.590  -6.515   2.495
  124   HH22  ARG  14          2HH2      ARG  14  -7.842  -8.015   1.763
  125    H    LYS  15           HN       LYS  15  -1.195  -1.721   0.755
  126    HA   LYS  15           HA       LYS  15  -1.941  -0.769   3.418
  127    HB2  LYS  15          2HB       LYS  15  -0.262   0.499   1.948
  128    HB3  LYS  15          1HB       LYS  15  -1.635   0.906   0.936
  129    HG2  LYS  15          2HG       LYS  15  -1.177   2.745   2.422
  130    HG3  LYS  15          1HG       LYS  15  -2.714   2.002   2.877
  131    HD2  LYS  15          2HD       LYS  15  -1.647   0.816   4.703
  132    HD3  LYS  15          1HD       LYS  15  -0.062   1.409   4.220
  133    HE2  LYS  15          2HE       LYS  15  -0.905   3.729   4.643
  134    HE3  LYS  15          1HE       LYS  15  -2.381   3.010   5.269
  135    HZ1  LYS  15          1HZ       LYS  15  -1.130   1.912   6.977
  136    HZ2  LYS  15          2HZ       LYS  15  -0.807   3.560   7.027
  137    HZ3  LYS  15          3HZ       LYS  15   0.331   2.500   6.371
  138    H    CYS  16           HN       CYS  16  -4.034  -0.330   3.842
  139    HA   CYS  16           HA       CYS  16  -5.833  -0.640   1.584
  140    HB2  CYS  16          2HB       CYS  16  -6.334  -1.196   4.511
  141    HB3  CYS  16          1HB       CYS  16  -7.521  -1.366   3.223
  142    H    ARG  17           HN       ARG  17  -7.132   0.893   1.079
  143    HA   ARG  17           HA       ARG  17  -7.301   3.250   2.823
  144    HB2  ARG  17          2HB       ARG  17  -7.301   3.135  -0.200
  145    HB3  ARG  17          1HB       ARG  17  -7.531   4.583   0.758
  146    HG2  ARG  17          2HG       ARG  17  -5.052   2.915   0.873
  147    HG3  ARG  17          1HG       ARG  17  -5.245   4.261  -0.259
  148    HD2  ARG  17          2HD       ARG  17  -4.004   5.065   1.613
  149    HD3  ARG  17          1HD       ARG  17  -5.625   5.727   1.757
  150    HE   ARG  17           HE       ARG  17  -5.447   3.342   3.246
  151   HH11  ARG  17          1HH1      ARG  17  -4.282   6.695   3.324
  152   HH12  ARG  17          2HH1      ARG  17  -4.097   6.735   5.012
  153   HH21  ARG  17          1HH2      ARG  17  -5.182   3.410   5.593
  154   HH22  ARG  17          2HH2      ARG  17  -4.620   4.833   6.318
  155    H    GLY  18           HN       GLY  18  -9.186   3.074   3.671
  156    HA2  GLY  18          2HA       GLY  18 -11.500   3.178   3.819
  157    HA3  GLY  18          1HA       GLY  18 -11.564   3.173   2.060
  Start of MODEL    9
    1    H1   LYS   1           HN       LYS   1 -11.805   1.094   1.391
    2    HA   LYS   1           HA       LYS   1 -11.594  -1.545   2.660
    3    HB2  LYS   1          2HB       LYS   1 -13.581  -2.279   1.352
    4    HB3  LYS   1          1HB       LYS   1 -13.934  -1.051   2.549
    5    HG2  LYS   1          2HG       LYS   1 -13.895   0.640   0.727
    6    HG3  LYS   1          1HG       LYS   1 -13.739  -0.688  -0.432
    7    HD2  LYS   1          2HD       LYS   1 -15.838  -1.635   0.367
    8    HD3  LYS   1          1HD       LYS   1 -15.981  -0.351   1.564
    9    HE2  LYS   1          2HE       LYS   1 -17.401   0.160  -0.315
   10    HE3  LYS   1          1HE       LYS   1 -16.056   1.295  -0.282
   11    HZ1  LYS   1          1HZ       LYS   1 -16.205  -1.113  -2.005
   12    HZ2  LYS   1          2HZ       LYS   1 -14.982   0.036  -2.036
   13    HZ3  LYS   1          3HZ       LYS   1 -16.538   0.448  -2.508
   14    H    TRP   2           HN       TRP   2 -10.223   0.306   0.404
   15    HA   TRP   2           HA       TRP   2  -9.884  -1.916  -1.481
   16    HB2  TRP   2          2HB       TRP   2 -10.601   0.439  -2.279
   17    HB3  TRP   2          1HB       TRP   2  -8.958   0.915  -1.893
   18    HD1  TRP   2          1HD       TRP   2  -7.097  -1.083  -3.133
   19    HE1  TRP   2          1HE       TRP   2  -7.073  -1.659  -5.634
   20    HE3  TRP   2          3HE       TRP   2 -11.767   0.484  -4.363
   21    HZ2  TRP   2          2HZ       TRP   2  -8.802  -1.456  -7.851
   22    HZ3  TRP   2          3HZ       TRP   2 -12.519   0.270  -6.706
   23    HH2  TRP   2          2HH       TRP   2 -11.050  -0.682  -8.409
   24    H    CYS   3           HN       CYS   3  -8.079  -3.046  -1.193
   25    HA   CYS   3           HA       CYS   3  -5.799  -1.707   0.052
   26    HB2  CYS   3          2HB       CYS   3  -6.445  -4.650  -0.080
   27    HB3  CYS   3          1HB       CYS   3  -5.027  -3.947   0.681
   28    H    PHE   4           HN       PHE   4  -4.069  -1.439  -1.096
   29    HA   PHE   4           HA       PHE   4  -3.650  -3.063  -3.458
   30    HB2  PHE   4          2HB       PHE   4  -2.952  -0.982  -4.715
   31    HB3  PHE   4          1HB       PHE   4  -4.669  -1.109  -4.395
   32    HD1  PHE   4          1HD       PHE   4  -1.639   0.806  -3.809
   33    HD2  PHE   4          2HD       PHE   4  -5.726   0.370  -2.709
   34    HE1  PHE   4          1HE       PHE   4  -1.631   3.072  -2.845
   35    HE2  PHE   4          2HE       PHE   4  -5.717   2.620  -1.746
   36    HZ   PHE   4           HZ       PHE   4  -3.673   3.980  -1.814
   37    H    ARG   5           HN       ARG   5  -1.398  -2.858  -4.250
   38    HA   ARG   5           HA       ARG   5   0.327  -3.064  -1.933
   39    HB2  ARG   5          2HB       ARG   5   0.337  -4.815  -3.649
   40    HB3  ARG   5          1HB       ARG   5   0.853  -3.635  -4.842
   41    HG2  ARG   5          2HG       ARG   5   2.900  -3.251  -3.457
   42    HG3  ARG   5          1HG       ARG   5   2.399  -4.618  -2.460
   43    HD2  ARG   5          2HD       ARG   5   2.925  -4.679  -5.417
   44    HD3  ARG   5          1HD       ARG   5   4.014  -5.283  -4.172
   45    HE   ARG   5           HE       ARG   5   1.737  -6.636  -3.710
   46   HH11  ARG   5          1HH1      ARG   5   3.577  -6.089  -6.698
   47   HH12  ARG   5          2HH1      ARG   5   3.252  -7.624  -7.350
   48   HH21  ARG   5          1HH2      ARG   5   1.274  -8.789  -4.641
   49   HH22  ARG   5          2HH2      ARG   5   1.917  -9.162  -6.162
   50    H    VAL   6           HN       VAL   6   1.569  -1.458  -1.298
   51    HA   VAL   6           HA       VAL   6   2.459   0.537  -3.272
   52    HB   VAL   6           HB       VAL   6   2.077   0.908  -0.276
   53   HG11  VAL   6          1HG1      VAL   6   3.948   2.238  -1.127
   54   HG12  VAL   6          2HG1      VAL   6   2.589   3.273  -0.688
   55   HG13  VAL   6          3HG1      VAL   6   2.907   2.911  -2.383
   56   HG21  VAL   6          1HG2      VAL   6  -0.023   0.808  -1.497
   57   HG22  VAL   6          2HG2      VAL   6   0.534   2.088  -2.579
   58   HG23  VAL   6          3HG2      VAL   6   0.280   2.417  -0.862
   59    H    CYS   7           HN       CYS   7   4.584   0.626  -3.575
   60    HA   CYS   7           HA       CYS   7   6.293  -0.786  -1.670
   61    HB2  CYS   7          2HB       CYS   7   6.723  -0.226  -4.606
   62    HB3  CYS   7          1HB       CYS   7   7.883  -1.016  -3.543
   63    H    TYR   8           HN       TYR   8   7.469   0.357  -0.476
   64    HA   TYR   8           HA       TYR   8   8.395   2.994  -1.347
   65    HB2  TYR   8          2HB       TYR   8   6.449   3.269   0.107
   66    HB3  TYR   8          1HB       TYR   8   7.174   2.213   1.304
   67    HD1  TYR   8          1HD       TYR   8   7.475   5.523  -0.333
   68    HD2  TYR   8          2HD       TYR   8   8.666   3.065   2.919
   69    HE1  TYR   8          1HE       TYR   8   8.409   7.480   0.799
   70    HE2  TYR   8          2HE       TYR   8   9.604   5.002   4.056
   71    HH   TYR   8           HH       TYR   8   9.003   8.216   3.056
   72    H    ARG   9           HN       ARG   9  10.494   2.688  -1.539
   73    HA   ARG   9           HA       ARG   9  12.684   2.322  -1.048
   74    HB2  ARG   9          2HB       ARG   9  11.709   2.099   1.813
   75    HB3  ARG   9          1HB       ARG   9  13.381   2.321   1.322
   76    HG2  ARG   9          2HG       ARG   9  12.703   4.486   0.270
   77    HG3  ARG   9          1HG       ARG   9  11.104   4.225   0.929
   78    HD2  ARG   9          2HD       ARG   9  11.944   4.275   3.183
   79    HD3  ARG   9          1HD       ARG   9  13.604   4.406   2.594
   80    HE   ARG   9           HE       ARG   9  12.137   6.461   1.469
   81   HH11  ARG   9          1HH1      ARG   9  13.083   5.546   4.769
   82   HH12  ARG   9          2HH1      ARG   9  13.238   7.160   5.305
   83   HH21  ARG   9          1HH2      ARG   9  12.348   8.704   2.286
   84   HH22  ARG   9          2HH2      ARG   9  12.826   8.931   3.905
   85    H    GLY  10           HN       GLY  10  10.927   0.105  -1.664
   86    HA2  GLY  10          2HA       GLY  10  11.658  -2.112  -2.165
   87    HA3  GLY  10          1HA       GLY  10  12.667  -2.065  -0.721
   88    H    ILE  11           HN       ILE  11  10.281  -0.776   0.610
   89    HA   ILE  11           HA       ILE  11   9.207  -3.199   1.725
   90    HB   ILE  11           HB       ILE  11   8.589  -0.294   2.311
   91   HG12  ILE  11          2HG1      ILE  11  10.417  -2.131   3.861
   92   HG13  ILE  11          1HG1      ILE  11  10.987  -0.987   2.649
   93   HG21  ILE  11          1HG2      ILE  11   6.824  -1.789   3.081
   94   HG22  ILE  11          2HG2      ILE  11   7.703  -1.110   4.449
   95   HG23  ILE  11          3HG2      ILE  11   8.008  -2.769   3.944
   96   HD11  ILE  11          1HD1      ILE  11  10.087   0.844   3.942
   97   HD12  ILE  11          2HD1      ILE  11  11.221  -0.108   4.911
   98   HD13  ILE  11          3HD1      ILE  11   9.477  -0.284   5.150
   99    H    CYS  12           HN       CYS  12   7.742  -4.083   0.375
  100    HA   CYS  12           HA       CYS  12   5.649  -2.349  -0.706
  101    HB2  CYS  12          2HB       CYS  12   6.229  -5.257  -1.299
  102    HB3  CYS  12          1HB       CYS  12   4.967  -4.265  -2.035
  103    H    TYR  13           HN       TYR  13   3.913  -2.123   0.450
  104    HA   TYR  13           HA       TYR  13   3.218  -4.308   2.257
  105    HB2  TYR  13          2HB       TYR  13   2.400  -2.620   3.874
  106    HB3  TYR  13          1HB       TYR  13   4.131  -2.530   3.607
  107    HD1  TYR  13          1HD       TYR  13   5.120  -0.547   2.571
  108    HD2  TYR  13          2HD       TYR  13   0.893  -0.799   3.119
  109    HE1  TYR  13          1HE       TYR  13   4.922   1.861   2.192
  110    HE2  TYR  13          2HE       TYR  13   0.700   1.595   2.741
  111    HH   TYR  13           HH       TYR  13   3.157   3.496   1.449
  112    H    ARG  14           HN       ARG  14   0.920  -4.064   3.026
  113    HA   ARG  14           HA       ARG  14  -0.741  -3.732   0.678
  114    HB2  ARG  14          2HB       ARG  14  -0.955  -5.831   1.887
  115    HB3  ARG  14          1HB       ARG  14  -1.230  -4.967   3.389
  116    HG2  ARG  14          2HG       ARG  14  -3.343  -4.107   2.503
  117    HG3  ARG  14          1HG       ARG  14  -3.066  -5.003   1.007
  118    HD2  ARG  14          2HD       ARG  14  -3.116  -7.087   2.185
  119    HD3  ARG  14          1HD       ARG  14  -3.214  -6.251   3.736
  120    HE   ARG  14           HE       ARG  14  -5.378  -5.327   2.705
  121   HH11  ARG  14          1HH1      ARG  14  -4.197  -8.665   2.452
  122   HH12  ARG  14          2HH1      ARG  14  -5.728  -9.356   2.209
  123   HH21  ARG  14          1HH2      ARG  14  -7.536  -6.307   2.382
  124   HH22  ARG  14          2HH2      ARG  14  -7.641  -7.986   2.171
  125    H    LYS  15           HN       LYS  15  -1.128  -1.635   0.492
  126    HA   LYS  15           HA       LYS  15  -1.823  -0.033   2.793
  127    HB2  LYS  15          2HB       LYS  15  -0.482   0.995   1.103
  128    HB3  LYS  15          1HB       LYS  15  -1.649   0.574  -0.139
  129    HG2  LYS  15          2HG       LYS  15  -1.750   2.960   0.424
  130    HG3  LYS  15          1HG       LYS  15  -3.255   2.142   0.836
  131    HD2  LYS  15          2HD       LYS  15  -2.575   2.006   3.149
  132    HD3  LYS  15          1HD       LYS  15  -1.031   2.772   2.765
  133    HE2  LYS  15          2HE       LYS  15  -3.749   4.014   2.400
  134    HE3  LYS  15          1HE       LYS  15  -2.678   4.321   3.768
  135    HZ1  LYS  15          1HZ       LYS  15  -2.483   6.062   2.148
  136    HZ2  LYS  15          2HZ       LYS  15  -2.117   4.969   0.919
  137    HZ3  LYS  15          3HZ       LYS  15  -1.045   5.188   2.194
  138    H    CYS  16           HN       CYS  16  -3.729   0.064   3.488
  139    HA   CYS  16           HA       CYS  16  -5.954  -0.635   1.710
  140    HB2  CYS  16          2HB       CYS  16  -5.722  -1.037   4.692
  141    HB3  CYS  16          1HB       CYS  16  -7.203  -1.290   3.775
  142    H    ARG  17           HN       ARG  17  -6.966   1.050   1.033
  143    HA   ARG  17           HA       ARG  17  -7.291   3.290   2.876
  144    HB2  ARG  17          2HB       ARG  17  -6.099   3.725   0.665
  145    HB3  ARG  17          1HB       ARG  17  -7.584   3.291  -0.153
  146    HG2  ARG  17          2HG       ARG  17  -7.493   5.546   1.837
  147    HG3  ARG  17          1HG       ARG  17  -7.032   5.784   0.160
  148    HD2  ARG  17          2HD       ARG  17  -9.709   4.728   1.069
  149    HD3  ARG  17          1HD       ARG  17  -9.387   6.414   0.671
  150    HE   ARG  17           HE       ARG  17  -8.578   4.828  -1.470
  151   HH11  ARG  17          1HH1      ARG  17 -11.584   5.801   0.118
  152   HH12  ARG  17          2HH1      ARG  17 -12.542   5.692  -1.290
  153   HH21  ARG  17          1HH2      ARG  17  -9.902   4.679  -3.427
  154   HH22  ARG  17          2HH2      ARG  17 -11.560   5.051  -3.352
  155    H    GLY  18           HN       GLY  18  -9.032   2.853   3.940
  156    HA2  GLY  18          2HA       GLY  18 -11.260   2.595   4.397
  157    HA3  GLY  18          1HA       GLY  18 -11.590   2.825   2.686
  Start of MODEL   10
    1    H1   LYS   1           HN       LYS   1 -11.549   1.898   0.561
    2    HA   LYS   1           HA       LYS   1 -11.948  -0.548   2.151
    3    HB2  LYS   1          2HB       LYS   1 -13.670   0.395  -0.150
    4    HB3  LYS   1          1HB       LYS   1 -13.874  -1.095   0.751
    5    HG2  LYS   1          2HG       LYS   1 -14.274   0.271   2.784
    6    HG3  LYS   1          1HG       LYS   1 -14.224   1.701   1.773
    7    HD2  LYS   1          2HD       LYS   1 -16.075   0.841   0.410
    8    HD3  LYS   1          1HD       LYS   1 -16.164  -0.585   1.440
    9    HE2  LYS   1          2HE       LYS   1 -16.562   2.251   2.365
   10    HE3  LYS   1          1HE       LYS   1 -17.865   1.125   2.001
   11    HZ1  LYS   1          1HZ       LYS   1 -15.824   0.753   4.155
   12    HZ2  LYS   1          2HZ       LYS   1 -17.090  -0.296   3.798
   13    HZ3  LYS   1          3HZ       LYS   1 -17.416   1.233   4.359
   14    H    TRP   2           HN       TRP   2  -9.870   0.668   0.213
   15    HA   TRP   2           HA       TRP   2  -9.845  -1.510  -1.768
   16    HB2  TRP   2          2HB       TRP   2 -10.066   0.921  -2.538
   17    HB3  TRP   2          1HB       TRP   2  -8.440   1.154  -1.929
   18    HD1  TRP   2          1HD       TRP   2  -6.670  -0.915  -3.161
   19    HE1  TRP   2          1HE       TRP   2  -6.453  -1.293  -5.699
   20    HE3  TRP   2          3HE       TRP   2 -11.087   1.161  -4.662
   21    HZ2  TRP   2          2HZ       TRP   2  -7.957  -0.769  -8.029
   22    HZ3  TRP   2          3HZ       TRP   2 -11.620   1.186  -7.064
   23    HH2  TRP   2          2HH       TRP   2 -10.086   0.242  -8.706
   24    H    CYS   3           HN       CYS   3  -8.230  -2.933  -1.453
   25    HA   CYS   3           HA       CYS   3  -5.917  -2.131   0.169
   26    HB2  CYS   3          2HB       CYS   3  -7.028  -4.866  -0.460
   27    HB3  CYS   3          1HB       CYS   3  -5.550  -4.576   0.453
   28    H    PHE   4           HN       PHE   4  -4.058  -1.864  -0.812
   29    HA   PHE   4           HA       PHE   4  -3.531  -3.336  -3.228
   30    HB2  PHE   4          2HB       PHE   4  -2.789  -1.312  -4.441
   31    HB3  PHE   4          1HB       PHE   4  -4.508  -1.293  -4.104
   32    HD1  PHE   4          1HD       PHE   4  -1.383   0.437  -3.775
   33    HD2  PHE   4          2HD       PHE   4  -5.333   0.202  -2.198
   34    HE1  PHE   4          1HE       PHE   4  -1.155   2.701  -2.846
   35    HE2  PHE   4          2HE       PHE   4  -5.101   2.454  -1.273
   36    HZ   PHE   4           HZ       PHE   4  -3.016   3.713  -1.599
   37    H    ARG   5           HN       ARG   5  -1.222  -2.824  -3.924
   38    HA   ARG   5           HA       ARG   5   0.381  -3.230  -1.555
   39    HB2  ARG   5          2HB       ARG   5   0.546  -4.652  -3.637
   40    HB3  ARG   5          1HB       ARG   5   1.260  -3.261  -4.428
   41    HG2  ARG   5          2HG       ARG   5   3.076  -3.243  -2.791
   42    HG3  ARG   5          1HG       ARG   5   2.376  -4.660  -2.007
   43    HD2  ARG   5          2HD       ARG   5   4.116  -5.426  -3.446
   44    HD3  ARG   5          1HD       ARG   5   2.572  -5.853  -4.182
   45    HE   ARG   5           HE       ARG   5   3.803  -3.366  -5.018
   46   HH11  ARG   5          1HH1      ARG   5   2.901  -6.686  -5.861
   47   HH12  ARG   5          2HH1      ARG   5   3.528  -6.605  -7.437
   48   HH21  ARG   5          1HH2      ARG   5   4.639  -3.235  -7.194
   49   HH22  ARG   5          2HH2      ARG   5   4.547  -4.582  -8.222
   50    H    VAL   6           HN       VAL   6   1.537  -1.701  -0.702
   51    HA   VAL   6           HA       VAL   6   2.115   0.677  -2.308
   52    HB   VAL   6           HB       VAL   6   2.005   0.424   0.724
   53   HG11  VAL   6          1HG1      VAL   6   2.488   2.851  -1.014
   54   HG12  VAL   6          2HG1      VAL   6   3.687   2.051   0.003
   55   HG13  VAL   6          3HG1      VAL   6   2.306   2.864   0.742
   56   HG21  VAL   6          1HG2      VAL   6   0.057   1.887   0.578
   57   HG22  VAL   6          2HG2      VAL   6  -0.206   0.384  -0.317
   58   HG23  VAL   6          3HG2      VAL   6   0.175   1.870  -1.181
   59    H    CYS   7           HN       CYS   7   4.122   0.790  -2.943
   60    HA   CYS   7           HA       CYS   7   6.123  -0.619  -1.366
   61    HB2  CYS   7          2HB       CYS   7   6.109   0.087  -4.307
   62    HB3  CYS   7          1HB       CYS   7   7.514  -0.547  -3.454
   63    H    TYR   8           HN       TYR   8   7.326   0.538  -0.258
   64    HA   TYR   8           HA       TYR   8   7.912   3.284  -1.085
   65    HB2  TYR   8          2HB       TYR   8   6.321   3.287   0.768
   66    HB3  TYR   8          1HB       TYR   8   7.368   2.215   1.689
   67    HD1  TYR   8          1HD       TYR   8   7.084   5.639   0.260
   68    HD2  TYR   8          2HD       TYR   8   9.136   3.126   3.004
   69    HE1  TYR   8          1HE       TYR   8   8.194   7.603   1.223
   70    HE2  TYR   8          2HE       TYR   8  10.240   5.069   3.976
   71    HH   TYR   8           HH       TYR   8   9.269   8.153   3.527
   72    H    ARG   9           HN       ARG   9   9.889   3.091  -1.817
   73    HA   ARG   9           HA       ARG   9  12.149   2.887  -1.878
   74    HB2  ARG   9          2HB       ARG   9  11.946   2.359   1.087
   75    HB3  ARG   9          1HB       ARG   9  13.409   2.785   0.218
   76    HG2  ARG   9          2HG       ARG   9  12.331   4.981  -0.352
   77    HG3  ARG   9          1HG       ARG   9  10.989   4.509   0.681
   78    HD2  ARG   9          2HD       ARG   9  12.489   4.271   2.570
   79    HD3  ARG   9          1HD       ARG   9  13.847   4.714   1.534
   80    HE   ARG   9           HE       ARG   9  11.624   6.554   2.004
   81   HH11  ARG   9          1HH1      ARG   9  15.084   5.827   2.149
   82   HH12  ARG   9          2HH1      ARG   9  15.539   7.375   2.663
   83   HH21  ARG   9          1HH2      ARG   9  12.240   8.668   2.731
   84   HH22  ARG   9          2HH2      ARG   9  13.871   9.034   3.010
   85    H    GLY  10           HN       GLY  10  10.353   0.538  -2.113
   86    HA2  GLY  10          2HA       GLY  10  11.066  -1.639  -2.857
   87    HA3  GLY  10          1HA       GLY  10  12.405  -1.499  -1.714
   88    H    ILE  11           HN       ILE  11  10.202  -0.400   0.154
   89    HA   ILE  11           HA       ILE  11   9.642  -2.954   1.387
   90    HB   ILE  11           HB       ILE  11   8.925  -0.131   2.258
   91   HG12  ILE  11          2HG1      ILE  11  11.178  -1.880   3.254
   92   HG13  ILE  11          1HG1      ILE  11  11.384  -0.621   2.042
   93   HG21  ILE  11          1HG2      ILE  11   8.891  -2.724   3.817
   94   HG22  ILE  11          2HG2      ILE  11   7.481  -1.805   3.299
   95   HG23  ILE  11          3HG2      ILE  11   8.591  -1.123   4.489
   96   HD11  ILE  11          1HD1      ILE  11  10.451  -0.222   4.884
   97   HD12  ILE  11          2HD1      ILE  11  10.652   1.046   3.675
   98   HD13  ILE  11          3HD1      ILE  11  12.057   0.149   4.252
   99    H    CYS  12           HN       CYS  12   7.969  -3.985   0.506
  100    HA   CYS  12           HA       CYS  12   5.691  -2.389  -0.404
  101    HB2  CYS  12          2HB       CYS  12   6.557  -5.133  -1.316
  102    HB3  CYS  12          1HB       CYS  12   5.157  -4.232  -1.898
  103    H    TYR  13           HN       TYR  13   3.944  -2.525   0.790
  104    HA   TYR  13           HA       TYR  13   3.362  -5.045   2.128
  105    HB2  TYR  13          2HB       TYR  13   2.568  -3.770   4.125
  106    HB3  TYR  13          1HB       TYR  13   4.299  -3.643   3.862
  107    HD1  TYR  13          1HD       TYR  13   1.238  -1.864   4.354
  108    HD2  TYR  13          2HD       TYR  13   5.167  -1.469   2.759
  109    HE1  TYR  13          1HE       TYR  13   1.048   0.558   4.494
  110    HE2  TYR  13          2HE       TYR  13   4.981   0.966   2.888
  111    HH   TYR  13           HH       TYR  13   3.219   2.692   2.973
  112    H    ARG  14           HN       ARG  14   1.030  -5.207   2.759
  113    HA   ARG  14           HA       ARG  14  -0.514  -4.193   0.513
  114    HB2  ARG  14          2HB       ARG  14  -0.449  -6.660   1.264
  115    HB3  ARG  14          1HB       ARG  14  -1.447  -6.156   2.617
  116    HG2  ARG  14          2HG       ARG  14  -2.875  -7.076   0.941
  117    HG3  ARG  14          1HG       ARG  14  -3.125  -5.328   0.942
  118    HD2  ARG  14          2HD       ARG  14  -1.633  -5.095  -0.977
  119    HD3  ARG  14          1HD       ARG  14  -1.314  -6.826  -0.944
  120    HE   ARG  14           HE       ARG  14  -4.037  -6.568  -1.209
  121   HH11  ARG  14          1HH1      ARG  14  -1.163  -5.813  -3.094
  122   HH12  ARG  14          2HH1      ARG  14  -1.986  -5.666  -4.573
  123   HH21  ARG  14          1HH2      ARG  14  -5.155  -6.488  -3.208
  124   HH22  ARG  14          2HH2      ARG  14  -4.339  -6.116  -4.664
  125    H    LYS  15           HN       LYS  15  -1.062  -2.145   1.012
  126    HA   LYS  15           HA       LYS  15  -2.127  -1.613   3.670
  127    HB2  LYS  15          2HB       LYS  15  -0.258  -0.189   2.900
  128    HB3  LYS  15          1HB       LYS  15  -1.231   0.336   1.543
  129    HG2  LYS  15          2HG       LYS  15  -2.813   1.401   3.049
  130    HG3  LYS  15          1HG       LYS  15  -1.905   0.810   4.438
  131    HD2  LYS  15          2HD       LYS  15   0.039   2.147   3.718
  132    HD3  LYS  15          1HD       LYS  15  -0.885   2.740   2.344
  133    HE2  LYS  15          2HE       LYS  15  -2.521   3.733   3.885
  134    HE3  LYS  15          1HE       LYS  15  -1.578   3.133   5.246
  135    HZ1  LYS  15          1HZ       LYS  15   0.250   4.547   4.556
  136    HZ2  LYS  15          2HZ       LYS  15  -1.139   5.469   4.795
  137    HZ3  LYS  15          3HZ       LYS  15  -0.632   5.097   3.234
  138    H    CYS  16           HN       CYS  16  -4.158  -0.989   3.962
  139    HA   CYS  16           HA       CYS  16  -5.869  -0.894   1.599
  140    HB2  CYS  16          2HB       CYS  16  -6.597  -1.535   4.461
  141    HB3  CYS  16          1HB       CYS  16  -7.665  -1.606   3.059
  142    H    ARG  17           HN       ARG  17  -6.728   0.907   1.082
  143    HA   ARG  17           HA       ARG  17  -6.802   3.071   3.059
  144    HB2  ARG  17          2HB       ARG  17  -5.174   3.204   1.013
  145    HB3  ARG  17          1HB       ARG  17  -6.631   3.427   0.062
  146    HG2  ARG  17          2HG       ARG  17  -5.753   5.238   2.313
  147    HG3  ARG  17          1HG       ARG  17  -5.437   5.527   0.612
  148    HD2  ARG  17          2HD       ARG  17  -8.172   5.295   1.852
  149    HD3  ARG  17          1HD       ARG  17  -7.351   6.816   1.508
  150    HE   ARG  17           HE       ARG  17  -7.607   5.126  -0.793
  151   HH11  ARG  17          1HH1      ARG  17  -9.398   7.408   1.233
  152   HH12  ARG  17          2HH1      ARG  17 -10.381   7.993  -0.012
  153   HH21  ARG  17          1HH2      ARG  17  -8.962   5.920  -2.533
  154   HH22  ARG  17          2HH2      ARG  17 -10.090   7.169  -2.225
  155    H    GLY  18           HN       GLY  18  -8.871   3.482   3.562
  156    HA2  GLY  18          2HA       GLY  18 -11.140   3.767   3.354
  157    HA3  GLY  18          1HA       GLY  18 -10.940   3.698   1.607
  Start of MODEL   11
    1    H1   LYS   1           HN       LYS   1 -12.425   0.528   1.551
    2    HA   LYS   1           HA       LYS   1 -11.493  -2.022   2.639
    3    HB2  LYS   1          2HB       LYS   1 -13.285  -3.003   1.176
    4    HB3  LYS   1          1HB       LYS   1 -13.877  -1.931   2.436
    5    HG2  LYS   1          2HG       LYS   1 -14.159  -0.146   0.824
    6    HG3  LYS   1          1HG       LYS   1 -13.479  -1.161  -0.447
    7    HD2  LYS   1          2HD       LYS   1 -15.327  -2.679  -0.297
    8    HD3  LYS   1          1HD       LYS   1 -15.964  -1.839   1.118
    9    HE2  LYS   1          2HE       LYS   1 -15.661  -0.614  -1.623
   10    HE3  LYS   1          1HE       LYS   1 -17.162  -1.275  -0.986
   11    HZ1  LYS   1          1HZ       LYS   1 -17.061   1.133  -0.695
   12    HZ2  LYS   1          2HZ       LYS   1 -15.658   1.014   0.197
   13    HZ3  LYS   1          3HZ       LYS   1 -17.085   0.354   0.788
   14    H    TRP   2           HN       TRP   2 -10.712   0.142   0.264
   15    HA   TRP   2           HA       TRP   2  -9.995  -1.740  -1.817
   16    HB2  TRP   2          2HB       TRP   2 -10.775   0.597  -2.313
   17    HB3  TRP   2          1HB       TRP   2  -9.344   1.210  -1.508
   18    HD1  TRP   2          1HD       TRP   2  -6.989  -0.230  -2.845
   19    HE1  TRP   2          1HE       TRP   2  -6.505  -0.006  -5.375
   20    HE3  TRP   2          3HE       TRP   2 -11.619   1.187  -4.465
   21    HZ2  TRP   2          2HZ       TRP   2  -7.878   0.671  -7.705
   22    HZ3  TRP   2          3HZ       TRP   2 -11.945   1.608  -6.864
   23    HH2  TRP   2          2HH       TRP   2 -10.111   1.355  -8.449
   24    H    CYS   3           HN       CYS   3  -8.230  -2.944  -1.457
   25    HA   CYS   3           HA       CYS   3  -6.047  -1.685   0.018
   26    HB2  CYS   3          2HB       CYS   3  -6.719  -4.588  -0.303
   27    HB3  CYS   3          1HB       CYS   3  -5.273  -3.995   0.519
   28    H    PHE   4           HN       PHE   4  -4.065  -1.613  -0.792
   29    HA   PHE   4           HA       PHE   4  -3.540  -2.770  -3.369
   30    HB2  PHE   4          2HB       PHE   4  -2.865  -0.541  -4.288
   31    HB3  PHE   4          1HB       PHE   4  -4.591  -0.674  -4.000
   32    HD1  PHE   4          1HD       PHE   4  -1.724   1.323  -3.531
   33    HD2  PHE   4          2HD       PHE   4  -5.418   0.305  -1.701
   34    HE1  PHE   4          1HE       PHE   4  -1.651   3.392  -2.219
   35    HE2  PHE   4          2HE       PHE   4  -5.350   2.355  -0.389
   36    HZ   PHE   4           HZ       PHE   4  -3.466   3.915  -0.641
   37    H    ARG   5           HN       ARG   5  -1.279  -2.526  -3.900
   38    HA   ARG   5           HA       ARG   5   0.279  -2.683  -1.462
   39    HB2  ARG   5          2HB       ARG   5   0.314  -4.594  -2.968
   40    HB3  ARG   5          1HB       ARG   5   0.858  -3.566  -4.279
   41    HG2  ARG   5          2HG       ARG   5   2.931  -3.127  -3.061
   42    HG3  ARG   5          1HG       ARG   5   2.384  -4.198  -1.767
   43    HD2  ARG   5          2HD       ARG   5   3.896  -5.370  -3.280
   44    HD3  ARG   5          1HD       ARG   5   2.273  -6.053  -3.353
   45    HE   ARG   5           HE       ARG   5   2.298  -4.229  -5.351
   46   HH11  ARG   5          1HH1      ARG   5   4.363  -6.977  -4.550
   47   HH12  ARG   5          2HH1      ARG   5   4.767  -7.328  -6.163
   48   HH21  ARG   5          1HH2      ARG   5   2.832  -4.693  -7.572
   49   HH22  ARG   5          2HH2      ARG   5   3.881  -5.972  -7.927
   50    H    VAL   6           HN       VAL   6   1.594  -1.148  -0.938
   51    HA   VAL   6           HA       VAL   6   2.397   0.867  -2.941
   52    HB   VAL   6           HB       VAL   6   2.344   1.138   0.084
   53   HG11  VAL   6          1HG1      VAL   6   2.803   3.231  -2.043
   54   HG12  VAL   6          2HG1      VAL   6   4.036   2.527  -0.999
   55   HG13  VAL   6          3HG1      VAL   6   2.751   3.510  -0.299
   56   HG21  VAL   6          1HG2      VAL   6   0.438   2.642  -0.230
   57   HG22  VAL   6          2HG2      VAL   6   0.080   1.008  -0.780
   58   HG23  VAL   6          3HG2      VAL   6   0.439   2.275  -1.955
   59    H    CYS   7           HN       CYS   7   4.554   1.003  -3.331
   60    HA   CYS   7           HA       CYS   7   6.274  -0.592  -1.599
   61    HB2  CYS   7          2HB       CYS   7   6.642   0.143  -4.514
   62    HB3  CYS   7          1HB       CYS   7   7.800  -0.746  -3.532
   63    H    TYR   8           HN       TYR   8   7.754   0.330  -0.493
   64    HA   TYR   8           HA       TYR   8   8.739   2.971  -1.239
   65    HB2  TYR   8          2HB       TYR   8   6.932   3.284   0.412
   66    HB3  TYR   8          1HB       TYR   8   7.724   2.153   1.491
   67    HD1  TYR   8          1HD       TYR   8   8.206   5.440  -0.196
   68    HD2  TYR   8          2HD       TYR   8   9.263   2.927   3.063
   69    HE1  TYR   8          1HE       TYR   8   9.403   7.305   0.835
   70    HE2  TYR   8          2HE       TYR   8  10.465   4.774   4.111
   71    HH   TYR   8           HH       TYR   8  10.111   7.971   3.117
   72    H    ARG   9           HN       ARG   9  10.776   2.447  -1.668
   73    HA   ARG   9           HA       ARG   9  12.952   1.949  -1.381
   74    HB2  ARG   9          2HB       ARG   9  12.289   1.537   1.539
   75    HB3  ARG   9          1HB       ARG   9  13.904   1.711   0.878
   76    HG2  ARG   9          2HG       ARG   9  13.222   4.004   0.119
   77    HG3  ARG   9          1HG       ARG   9  11.733   3.771   1.029
   78    HD2  ARG   9          2HD       ARG   9  13.159   3.264   3.034
   79    HD3  ARG   9          1HD       ARG   9  14.540   3.823   2.089
   80    HE   ARG   9           HE       ARG   9  12.246   5.579   2.353
   81   HH11  ARG   9          1HH1      ARG   9  15.658   4.989   3.147
   82   HH12  ARG   9          2HH1      ARG   9  15.845   6.464   3.945
   83   HH21  ARG   9          1HH2      ARG   9  12.510   7.535   3.478
   84   HH22  ARG   9          2HH2      ARG   9  14.023   7.967   4.144
   85    H    GLY  10           HN       GLY  10  10.918  -0.108  -1.852
   86    HA2  GLY  10          2HA       GLY  10  11.406  -2.357  -2.534
   87    HA3  GLY  10          1HA       GLY  10  12.609  -2.431  -1.250
   88    H    ILE  11           HN       ILE  11  10.365  -0.994   0.348
   89    HA   ILE  11           HA       ILE  11   9.287  -3.436   1.471
   90    HB   ILE  11           HB       ILE  11   8.829  -0.559   2.318
   91   HG12  ILE  11          2HG1      ILE  11  10.835  -2.482   3.497
   92   HG13  ILE  11          1HG1      ILE  11  11.254  -1.271   2.288
   93   HG21  ILE  11          1HG2      ILE  11   7.191  -2.145   3.203
   94   HG22  ILE  11          2HG2      ILE  11   8.238  -1.556   4.494
   95   HG23  ILE  11          3HG2      ILE  11   8.491  -3.165   3.817
   96   HD11  ILE  11          1HD1      ILE  11  10.115  -0.727   5.023
   97   HD12  ILE  11          2HD1      ILE  11  10.543   0.490   3.820
   98   HD13  ILE  11          3HD1      ILE  11  11.799  -0.519   4.537
   99    H    CYS  12           HN       CYS  12   7.729  -4.107   0.067
  100    HA   CYS  12           HA       CYS  12   5.671  -2.195  -0.714
  101    HB2  CYS  12          2HB       CYS  12   6.036  -5.079  -1.540
  102    HB3  CYS  12          1HB       CYS  12   4.828  -3.954  -2.150
  103    H    TYR  13           HN       TYR  13   3.957  -1.970   0.512
  104    HA   TYR  13           HA       TYR  13   3.262  -4.227   2.196
  105    HB2  TYR  13          2HB       TYR  13   2.591  -2.582   3.948
  106    HB3  TYR  13          1HB       TYR  13   4.317  -2.643   3.639
  107    HD1  TYR  13          1HD       TYR  13   5.470  -0.727   2.649
  108    HD2  TYR  13          2HD       TYR  13   1.279  -0.596   3.389
  109    HE1  TYR  13          1HE       TYR  13   5.510   1.704   2.399
  110    HE2  TYR  13          2HE       TYR  13   1.309   1.842   3.134
  111    HH   TYR  13           HH       TYR  13   3.937   3.543   1.843
  112    H    ARG  14           HN       ARG  14   1.073  -4.136   2.955
  113    HA   ARG  14           HA       ARG  14  -0.654  -3.496   0.730
  114    HB2  ARG  14          2HB       ARG  14  -0.667  -5.743   1.669
  115    HB3  ARG  14          1HB       ARG  14  -1.072  -5.097   3.248
  116    HG2  ARG  14          2HG       ARG  14  -3.211  -4.318   2.343
  117    HG3  ARG  14          1HG       ARG  14  -2.785  -5.042   0.785
  118    HD2  ARG  14          2HD       ARG  14  -2.562  -7.220   1.864
  119    HD3  ARG  14          1HD       ARG  14  -3.000  -6.497   3.410
  120    HE   ARG  14           HE       ARG  14  -4.807  -6.451   1.116
  121   HH11  ARG  14          1HH1      ARG  14  -4.152  -7.343   4.512
  122   HH12  ARG  14          2HH1      ARG  14  -5.739  -7.813   4.843
  123   HH21  ARG  14          1HH2      ARG  14  -7.030  -7.150   1.613
  124   HH22  ARG  14          2HH2      ARG  14  -7.404  -7.726   3.172
  125    H    LYS  15           HN       LYS  15  -1.096  -1.430   0.878
  126    HA   LYS  15           HA       LYS  15  -2.003  -0.301   3.416
  127    HB2  LYS  15          2HB       LYS  15  -0.348   0.946   1.996
  128    HB3  LYS  15          1HB       LYS  15  -1.573   1.055   0.746
  129    HG2  LYS  15          2HG       LYS  15  -2.987   2.375   2.211
  130    HG3  LYS  15          1HG       LYS  15  -1.801   2.234   3.506
  131    HD2  LYS  15          2HD       LYS  15  -0.149   3.398   2.075
  132    HD3  LYS  15          1HD       LYS  15  -1.397   3.590   0.839
  133    HE2  LYS  15          2HE       LYS  15  -2.763   4.845   2.433
  134    HE3  LYS  15          1HE       LYS  15  -1.499   4.669   3.646
  135    HZ1  LYS  15          1HZ       LYS  15  -1.248   6.133   1.070
  136    HZ2  LYS  15          2HZ       LYS  15  -0.015   5.955   2.205
  137    HZ3  LYS  15          3HZ       LYS  15  -1.400   6.815   2.601
  138    H    CYS  16           HN       CYS  16  -4.114   0.299   3.687
  139    HA   CYS  16           HA       CYS  16  -5.888  -0.352   1.469
  140    HB2  CYS  16          2HB       CYS  16  -6.387  -0.837   4.412
  141    HB3  CYS  16          1HB       CYS  16  -7.576  -1.077   3.139
  142    H    ARG  17           HN       ARG  17  -7.262   1.069   0.874
  143    HA   ARG  17           HA       ARG  17  -7.631   3.513   2.453
  144    HB2  ARG  17          2HB       ARG  17  -6.589   3.753   0.178
  145    HB3  ARG  17          1HB       ARG  17  -8.027   3.028  -0.521
  146    HG2  ARG  17          2HG       ARG  17  -8.087   5.398  -0.813
  147    HG3  ARG  17          1HG       ARG  17  -9.328   4.937   0.352
  148    HD2  ARG  17          2HD       ARG  17  -7.942   5.649   2.187
  149    HD3  ARG  17          1HD       ARG  17  -6.592   5.957   1.094
  150    HE   ARG  17           HE       ARG  17  -8.730   7.450   0.203
  151   HH11  ARG  17          1HH1      ARG  17  -6.754   7.350   3.147
  152   HH12  ARG  17          2HH1      ARG  17  -6.852   9.030   3.398
  153   HH21  ARG  17          1HH2      ARG  17  -8.813   9.744   0.563
  154   HH22  ARG  17          2HH2      ARG  17  -8.037  10.405   1.933
  155    H    GLY  18           HN       GLY  18  -9.310   2.760   3.689
  156    HA2  GLY  18          2HA       GLY  18 -11.475   2.191   4.181
  157    HA3  GLY  18          1HA       GLY  18 -11.857   2.326   2.460
  Start of MODEL   12
    1    H1   LYS   1           HN       LYS   1 -12.034   0.820   1.349
    2    HA   LYS   1           HA       LYS   1 -11.523  -1.831   2.527
    3    HB2  LYS   1          2HB       LYS   1 -13.427  -2.688   1.218
    4    HB3  LYS   1          1HB       LYS   1 -13.920  -1.459   2.372
    5    HG2  LYS   1          2HG       LYS   1 -13.984   0.188   0.553
    6    HG3  LYS   1          1HG       LYS   1 -13.540  -1.083  -0.592
    7    HD2  LYS   1          2HD       LYS   1 -15.574  -2.303  -0.012
    8    HD3  LYS   1          1HD       LYS   1 -16.008  -1.037   1.138
    9    HE2  LYS   1          2HE       LYS   1 -17.241  -0.719  -0.913
   10    HE3  LYS   1          1HE       LYS   1 -16.079   0.588  -0.718
   11    HZ1  LYS   1          1HZ       LYS   1 -14.632  -0.520  -2.322
   12    HZ2  LYS   1          2HZ       LYS   1 -16.160  -0.237  -2.976
   13    HZ3  LYS   1          3HZ       LYS   1 -15.747  -1.789  -2.469
   14    H    TRP   2           HN       TRP   2 -10.328   0.249   0.409
   15    HA   TRP   2           HA       TRP   2  -9.888  -1.594  -1.821
   16    HB2  TRP   2          2HB       TRP   2 -10.504   0.844  -2.179
   17    HB3  TRP   2          1HB       TRP   2  -8.976   1.275  -1.439
   18    HD1  TRP   2          1HD       TRP   2  -7.418  -1.190  -3.201
   19    HE1  TRP   2          1HE       TRP   2  -6.830  -0.620  -5.630
   20    HE3  TRP   2          3HE       TRP   2 -10.622   2.735  -3.908
   21    HZ2  TRP   2          2HZ       TRP   2  -7.611   1.256  -7.597
   22    HZ3  TRP   2          3HZ       TRP   2 -10.628   3.863  -6.096
   23    HH2  TRP   2          2HH       TRP   2  -9.155   3.135  -7.895
   24    H    CYS   3           HN       CYS   3  -8.139  -2.912  -1.599
   25    HA   CYS   3           HA       CYS   3  -5.918  -1.913   0.026
   26    HB2  CYS   3          2HB       CYS   3  -6.784  -4.752  -0.520
   27    HB3  CYS   3          1HB       CYS   3  -5.313  -4.316   0.339
   28    H    PHE   4           HN       PHE   4  -4.165  -1.391  -0.963
   29    HA   PHE   4           HA       PHE   4  -3.547  -2.634  -3.530
   30    HB2  PHE   4          2HB       PHE   4  -2.687  -0.300  -4.203
   31    HB3  PHE   4          1HB       PHE   4  -4.425  -0.569  -4.219
   32    HD1  PHE   4          1HD       PHE   4  -5.868   0.685  -2.840
   33    HD2  PHE   4          2HD       PHE   4  -1.661   0.973  -2.303
   34    HE1  PHE   4          1HE       PHE   4  -6.199   2.601  -1.356
   35    HE2  PHE   4          2HE       PHE   4  -1.986   2.890  -0.806
   36    HZ   PHE   4           HZ       PHE   4  -4.254   3.709  -0.325
   37    H    ARG   5           HN       ARG   5  -1.290  -2.410  -4.153
   38    HA   ARG   5           HA       ARG   5   0.424  -2.888  -1.864
   39    HB2  ARG   5          2HB       ARG   5   0.486  -4.483  -3.697
   40    HB3  ARG   5          1HB       ARG   5   0.831  -3.199  -4.836
   41    HG2  ARG   5          2HG       ARG   5   3.012  -2.844  -3.800
   42    HG3  ARG   5          1HG       ARG   5   2.668  -4.137  -2.644
   43    HD2  ARG   5          2HD       ARG   5   2.534  -5.758  -4.394
   44    HD3  ARG   5          1HD       ARG   5   2.623  -4.492  -5.620
   45    HE   ARG   5           HE       ARG   5   4.931  -4.201  -4.251
   46   HH11  ARG   5          1HH1      ARG   5   3.420  -7.040  -5.751
   47   HH12  ARG   5          2HH1      ARG   5   4.872  -7.740  -6.260
   48   HH21  ARG   5          1HH2      ARG   5   6.981  -5.163  -4.960
   49   HH22  ARG   5          2HH2      ARG   5   6.956  -6.649  -5.786
   50    H    VAL   6           HN       VAL   6   1.713  -1.419  -1.111
   51    HA   VAL   6           HA       VAL   6   2.450   0.877  -2.803
   52    HB   VAL   6           HB       VAL   6   2.397   0.785   0.230
   53   HG11  VAL   6          1HG1      VAL   6   2.713   3.113  -1.662
   54   HG12  VAL   6          2HG1      VAL   6   3.979   2.391  -0.672
   55   HG13  VAL   6          3HG1      VAL   6   2.625   3.221   0.095
   56   HG21  VAL   6          1HG2      VAL   6   0.118   0.615  -0.603
   57   HG22  VAL   6          2HG2      VAL   6   0.372   2.030  -1.628
   58   HG23  VAL   6          3HG2      VAL   6   0.394   2.192   0.129
   59    H    CYS   7           HN       CYS   7   4.559   0.860  -3.314
   60    HA   CYS   7           HA       CYS   7   6.333  -0.655  -1.557
   61    HB2  CYS   7          2HB       CYS   7   6.539  -0.180  -4.526
   62    HB3  CYS   7          1HB       CYS   7   7.802  -0.920  -3.546
   63    H    TYR   8           HN       TYR   8   7.792   0.388  -0.550
   64    HA   TYR   8           HA       TYR   8   8.722   2.963  -1.583
   65    HB2  TYR   8          2HB       TYR   8   6.966   3.322   0.095
   66    HB3  TYR   8          1HB       TYR   8   7.860   2.342   1.242
   67    HD1  TYR   8          1HD       TYR   8   7.890   5.517  -0.663
   68    HD2  TYR   8          2HD       TYR   8   9.609   3.347   2.560
   69    HE1  TYR   8          1HE       TYR   8   8.969   7.562   0.120
   70    HE2  TYR   8          2HE       TYR   8  10.704   5.385   3.360
   71    HH   TYR   8           HH       TYR   8   9.837   8.458   2.269
   72    H    ARG   9           HN       ARG   9  10.758   2.393  -2.050
   73    HA   ARG   9           HA       ARG   9  12.963   1.849  -1.818
   74    HB2  ARG   9          2HB       ARG   9  12.428   1.852   1.156
   75    HB3  ARG   9          1HB       ARG   9  14.001   1.951   0.383
   76    HG2  ARG   9          2HG       ARG   9  13.268   4.145  -0.580
   77    HG3  ARG   9          1HG       ARG   9  11.810   3.998   0.393
   78    HD2  ARG   9          2HD       ARG   9  13.283   3.709   2.399
   79    HD3  ARG   9          1HD       ARG   9  14.639   4.162   1.368
   80    HE   ARG   9           HE       ARG   9  12.561   6.041   1.183
   81   HH11  ARG   9          1HH1      ARG   9  15.356   5.125   3.138
   82   HH12  ARG   9          2HH1      ARG   9  15.357   6.525   4.082
   83   HH21  ARG   9          1HH2      ARG   9  12.495   7.955   2.507
   84   HH22  ARG   9          2HH2      ARG   9  13.689   8.203   3.708
   85    H    GLY  10           HN       GLY  10  10.895  -0.216  -1.948
   86    HA2  GLY  10          2HA       GLY  10  11.391  -2.567  -2.272
   87    HA3  GLY  10          1HA       GLY  10  12.570  -2.398  -0.969
   88    H    ILE  11           HN       ILE  11  10.373  -0.777   0.420
   89    HA   ILE  11           HA       ILE  11   9.319  -3.051   1.850
   90    HB   ILE  11           HB       ILE  11   8.814  -0.090   2.265
   91   HG12  ILE  11          2HG1      ILE  11  10.756  -1.863   3.739
   92   HG13  ILE  11          1HG1      ILE  11  11.219  -0.777   2.431
   93   HG21  ILE  11          1HG2      ILE  11   7.129  -1.546   3.288
   94   HG22  ILE  11          2HG2      ILE  11   8.112  -0.756   4.520
   95   HG23  ILE  11          3HG2      ILE  11   8.400  -2.447   4.112
   96   HD11  ILE  11          1HD1      ILE  11   9.971   0.024   5.061
   97   HD12  ILE  11          2HD1      ILE  11  10.438   1.127   3.765
   98   HD13  ILE  11          3HD1      ILE  11  11.670   0.199   4.620
   99    H    CYS  12           HN       CYS  12   7.819  -3.980   0.552
  100    HA   CYS  12           HA       CYS  12   5.711  -2.239  -0.424
  101    HB2  CYS  12          2HB       CYS  12   6.231  -5.155  -1.073
  102    HB3  CYS  12          1HB       CYS  12   4.958  -4.153  -1.760
  103    H    TYR  13           HN       TYR  13   3.841  -2.159   0.570
  104    HA   TYR  13           HA       TYR  13   3.081  -4.351   2.297
  105    HB2  TYR  13          2HB       TYR  13   2.306  -2.689   4.003
  106    HB3  TYR  13          1HB       TYR  13   4.050  -2.764   3.825
  107    HD1  TYR  13          1HD       TYR  13   5.258  -0.884   2.731
  108    HD2  TYR  13          2HD       TYR  13   1.084  -0.671   3.514
  109    HE1  TYR  13          1HE       TYR  13   5.344   1.537   2.460
  110    HE2  TYR  13          2HE       TYR  13   1.159   1.765   3.236
  111    HH   TYR  13           HH       TYR  13   3.872   3.390   1.949
  112    H    ARG  14           HN       ARG  14   0.773  -4.310   2.753
  113    HA   ARG  14           HA       ARG  14  -0.633  -3.283   0.429
  114    HB2  ARG  14          2HB       ARG  14  -0.766  -5.726   1.409
  115    HB3  ARG  14          1HB       ARG  14  -1.897  -4.988   2.529
  116    HG2  ARG  14          2HG       ARG  14  -3.197  -5.874   0.784
  117    HG3  ARG  14          1HG       ARG  14  -3.146  -4.128   0.520
  118    HD2  ARG  14          2HD       ARG  14  -1.284  -4.459  -1.094
  119    HD3  ARG  14          1HD       ARG  14  -1.455  -6.197  -0.870
  120    HE   ARG  14           HE       ARG  14  -3.928  -5.190  -1.623
  121   HH11  ARG  14          1HH1      ARG  14  -0.771  -5.816  -3.028
  122   HH12  ARG  14          2HH1      ARG  14  -1.322  -5.752  -4.640
  123   HH21  ARG  14          1HH2      ARG  14  -4.679  -5.054  -3.804
  124   HH22  ARG  14          2HH2      ARG  14  -3.608  -5.297  -5.096
  125    H    LYS  15           HN       LYS  15  -1.128  -1.245   0.814
  126    HA   LYS  15           HA       LYS  15  -2.177  -0.510   3.414
  127    HB2  LYS  15          2HB       LYS  15  -0.546   0.981   2.169
  128    HB3  LYS  15          1HB       LYS  15  -1.813   1.269   0.992
  129    HG2  LYS  15          2HG       LYS  15  -1.702   3.113   2.541
  130    HG3  LYS  15          1HG       LYS  15  -3.221   2.244   2.770
  131    HD2  LYS  15          2HD       LYS  15  -2.222   1.044   4.692
  132    HD3  LYS  15          1HD       LYS  15  -0.735   1.962   4.472
  133    HE2  LYS  15          2HE       LYS  15  -1.913   4.027   4.963
  134    HE3  LYS  15          1HE       LYS  15  -3.438   3.152   5.079
  135    HZ1  LYS  15          1HZ       LYS  15  -2.523   3.594   7.265
  136    HZ2  LYS  15          2HZ       LYS  15  -1.093   2.793   6.876
  137    HZ3  LYS  15          3HZ       LYS  15  -2.524   1.938   6.979
  138    H    CYS  16           HN       CYS  16  -4.274  -0.118   3.766
  139    HA   CYS  16           HA       CYS  16  -6.076  -0.566   1.509
  140    HB2  CYS  16          2HB       CYS  16  -6.480  -1.312   4.409
  141    HB3  CYS  16          1HB       CYS  16  -7.670  -1.515   3.132
  142    H    ARG  17           HN       ARG  17  -6.922   1.248   0.933
  143    HA   ARG  17           HA       ARG  17  -7.552   3.305   2.902
  144    HB2  ARG  17          2HB       ARG  17  -6.498   3.988   0.747
  145    HB3  ARG  17          1HB       ARG  17  -7.864   3.294  -0.116
  146    HG2  ARG  17          2HG       ARG  17  -8.089   5.693  -0.005
  147    HG3  ARG  17          1HG       ARG  17  -9.355   4.929   0.955
  148    HD2  ARG  17          2HD       ARG  17  -8.425   6.847   2.128
  149    HD3  ARG  17          1HD       ARG  17  -8.048   5.362   2.997
  150    HE   ARG  17           HE       ARG  17  -6.013   6.107   1.163
  151   HH11  ARG  17          1HH1      ARG  17  -7.237   6.902   4.391
  152   HH12  ARG  17          2HH1      ARG  17  -5.712   7.336   5.013
  153   HH21  ARG  17          1HH2      ARG  17  -3.952   6.777   1.995
  154   HH22  ARG  17          2HH2      ARG  17  -3.816   7.346   3.598
  155    H    GLY  18           HN       GLY  18  -9.371   2.827   3.942
  156    HA2  GLY  18          2HA       GLY  18 -11.561   2.328   4.317
  157    HA3  GLY  18          1HA       GLY  18 -11.836   2.534   2.586
  Start of MODEL   13
    1    H1   LYS   1           HN       LYS   1 -11.701   1.405   1.288
    2    HA   LYS   1           HA       LYS   1 -11.476  -1.287   2.451
    3    HB2  LYS   1          2HB       LYS   1 -13.335  -1.942   0.953
    4    HB3  LYS   1          1HB       LYS   1 -13.799  -0.698   2.107
    5    HG2  LYS   1          2HG       LYS   1 -13.633   0.994   0.412
    6    HG3  LYS   1          1HG       LYS   1 -13.053  -0.193  -0.760
    7    HD2  LYS   1          2HD       LYS   1 -15.179  -1.370  -0.612
    8    HD3  LYS   1          1HD       LYS   1 -15.744  -0.215   0.598
    9    HE2  LYS   1          2HE       LYS   1 -14.973   0.433  -2.246
   10    HE3  LYS   1          1HE       LYS   1 -16.616   0.319  -1.622
   11    HZ1  LYS   1          1HZ       LYS   1 -14.573   2.314  -0.770
   12    HZ2  LYS   1          2HZ       LYS   1 -16.073   2.149  -0.092
   13    HZ3  LYS   1          3HZ       LYS   1 -15.939   2.612  -1.712
   14    H    TRP   2           HN       TRP   2 -10.203   0.786   0.192
   15    HA   TRP   2           HA       TRP   2  -9.740  -1.170  -1.902
   16    HB2  TRP   2          2HB       TRP   2 -10.172   1.286  -2.372
   17    HB3  TRP   2          1HB       TRP   2  -8.639   1.640  -1.604
   18    HD1  TRP   2          1HD       TRP   2  -6.596  -0.196  -2.957
   19    HE1  TRP   2          1HE       TRP   2  -6.121  -0.100  -5.501
   20    HE3  TRP   2          3HE       TRP   2 -10.930   1.987  -4.532
   21    HZ2  TRP   2          2HZ       TRP   2  -7.399   0.784  -7.827
   22    HZ3  TRP   2          3HZ       TRP   2 -11.220   2.427  -6.932
   23    HH2  TRP   2          2HH       TRP   2  -9.486   1.840  -8.541
   24    H    CYS   3           HN       CYS   3  -8.203  -2.646  -1.433
   25    HA   CYS   3           HA       CYS   3  -5.850  -1.703   0.031
   26    HB2  CYS   3          2HB       CYS   3  -6.812  -4.519  -0.379
   27    HB3  CYS   3          1HB       CYS   3  -5.467  -4.022   0.638
   28    H    PHE   4           HN       PHE   4  -4.032  -1.576  -0.998
   29    HA   PHE   4           HA       PHE   4  -3.608  -3.155  -3.382
   30    HB2  PHE   4          2HB       PHE   4  -2.873  -1.231  -4.701
   31    HB3  PHE   4          1HB       PHE   4  -4.539  -1.016  -4.205
   32    HD1  PHE   4          1HD       PHE   4  -4.854   0.454  -2.001
   33    HD2  PHE   4          2HD       PHE   4  -1.400   0.509  -4.489
   34    HE1  PHE   4          1HE       PHE   4  -4.302   2.698  -1.173
   35    HE2  PHE   4          2HE       PHE   4  -0.841   2.761  -3.653
   36    HZ   PHE   4           HZ       PHE   4  -2.286   3.852  -1.999
   37    H    ARG   5           HN       ARG   5  -1.330  -3.040  -4.033
   38    HA   ARG   5           HA       ARG   5   0.268  -3.206  -1.640
   39    HB2  ARG   5          2HB       ARG   5   0.352  -4.973  -3.404
   40    HB3  ARG   5          1HB       ARG   5   1.020  -3.782  -4.499
   41    HG2  ARG   5          2HG       ARG   5   2.989  -3.542  -3.130
   42    HG3  ARG   5          1HG       ARG   5   2.316  -4.647  -1.927
   43    HD2  ARG   5          2HD       ARG   5   2.933  -5.341  -4.790
   44    HD3  ARG   5          1HD       ARG   5   3.945  -5.751  -3.406
   45    HE   ARG   5           HE       ARG   5   1.392  -6.731  -2.916
   46   HH11  ARG   5          1HH1      ARG   5   3.984  -7.288  -5.263
   47   HH12  ARG   5          2HH1      ARG   5   3.670  -8.947  -5.440
   48   HH21  ARG   5          1HH2      ARG   5   0.923  -9.017  -3.197
   49   HH22  ARG   5          2HH2      ARG   5   1.882  -9.945  -4.262
   50    H    VAL   6           HN       VAL   6   1.493  -1.640  -0.978
   51    HA   VAL   6           HA       VAL   6   2.228   0.474  -2.862
   52    HB   VAL   6           HB       VAL   6   2.239   0.530   0.172
   53   HG11  VAL   6          1HG1      VAL   6   2.685   2.757  -1.821
   54   HG12  VAL   6          2HG1      VAL   6   3.916   2.009  -0.803
   55   HG13  VAL   6          3HG1      VAL   6   2.607   2.936  -0.068
   56   HG21  VAL   6          1HG2      VAL   6   0.320   1.810  -1.764
   57   HG22  VAL   6          2HG2      VAL   6   0.323   2.030  -0.013
   58   HG23  VAL   6          3HG2      VAL   6  -0.026   0.446  -0.704
   59    H    CYS   7           HN       CYS   7   4.243   0.354  -3.532
   60    HA   CYS   7           HA       CYS   7   6.198  -0.867  -1.742
   61    HB2  CYS   7          2HB       CYS   7   6.248  -0.537  -4.748
   62    HB3  CYS   7          1HB       CYS   7   7.619  -1.099  -3.798
   63    H    TYR   8           HN       TYR   8   7.423   0.402  -0.778
   64    HA   TYR   8           HA       TYR   8   8.252   2.960  -1.940
   65    HB2  TYR   8          2HB       TYR   8   6.239   3.453  -0.683
   66    HB3  TYR   8          1HB       TYR   8   6.860   2.571   0.704
   67    HD1  TYR   8          1HD       TYR   8   8.259   3.679   2.293
   68    HD2  TYR   8          2HD       TYR   8   7.323   5.613  -1.376
   69    HE1  TYR   8          1HE       TYR   8   9.186   5.752   3.166
   70    HE2  TYR   8          2HE       TYR   8   8.253   7.708  -0.521
   71    HH   TYR   8           HH       TYR   8   8.681   8.760   1.692
   72    H    ARG   9           HN       ARG   9  10.398   2.968  -1.777
   73    HA   ARG   9           HA       ARG   9  12.528   2.689  -1.083
   74    HB2  ARG   9          2HB       ARG   9  11.267   2.611   1.663
   75    HB3  ARG   9          1HB       ARG   9  12.993   2.727   1.373
   76    HG2  ARG   9          2HG       ARG   9  12.519   4.862   0.109
   77    HG3  ARG   9          1HG       ARG   9  10.868   4.731   0.696
   78    HD2  ARG   9          2HD       ARG   9  11.645   4.764   3.000
   79    HD3  ARG   9          1HD       ARG   9  13.316   4.859   2.440
   80    HE   ARG   9           HE       ARG   9  11.985   6.950   1.265
   81   HH11  ARG   9          1HH1      ARG   9  12.778   5.977   4.574
   82   HH12  ARG   9          2HH1      ARG   9  12.740   7.570   5.186
   83   HH21  ARG   9          1HH2      ARG   9  11.979   9.142   2.130
   84   HH22  ARG   9          2HH2      ARG   9  12.324   9.380   3.771
   85    H    GLY  10           HN       GLY  10  10.925   0.389  -1.741
   86    HA2  GLY  10          2HA       GLY  10  11.693  -1.806  -2.097
   87    HA3  GLY  10          1HA       GLY  10  12.754  -1.629  -0.703
   88    H    ILE  11           HN       ILE  11  10.033  -0.415   0.405
   89    HA   ILE  11           HA       ILE  11   9.291  -2.885   1.763
   90    HB   ILE  11           HB       ILE  11   8.220  -0.089   2.208
   91   HG12  ILE  11          2HG1      ILE  11  10.461  -1.388   3.754
   92   HG13  ILE  11          1HG1      ILE  11  10.733  -0.278   2.414
   93   HG21  ILE  11          1HG2      ILE  11   7.622  -0.939   4.410
   94   HG22  ILE  11          2HG2      ILE  11   8.358  -2.494   4.031
   95   HG23  ILE  11          3HG2      ILE  11   6.921  -1.969   3.157
   96   HD11  ILE  11          1HD1      ILE  11  10.906   0.869   4.567
   97   HD12  ILE  11          2HD1      ILE  11   9.267   0.360   4.976
   98   HD13  ILE  11          3HD1      ILE  11   9.537   1.478   3.640
   99    H    CYS  12           HN       CYS  12   7.775  -4.003   0.685
  100    HA   CYS  12           HA       CYS  12   5.644  -2.467  -0.565
  101    HB2  CYS  12          2HB       CYS  12   6.446  -5.353  -1.072
  102    HB3  CYS  12          1HB       CYS  12   5.096  -4.492  -1.814
  103    H    TYR  13           HN       TYR  13   3.815  -2.376   0.504
  104    HA   TYR  13           HA       TYR  13   3.118  -4.587   2.246
  105    HB2  TYR  13          2HB       TYR  13   2.332  -2.931   3.963
  106    HB3  TYR  13          1HB       TYR  13   4.074  -2.993   3.764
  107    HD1  TYR  13          1HD       TYR  13   5.179  -1.136   2.383
  108    HD2  TYR  13          2HD       TYR  13   1.163  -0.880   3.767
  109    HE1  TYR  13          1HE       TYR  13   5.257   1.280   2.104
  110    HE2  TYR  13          2HE       TYR  13   1.224   1.560   3.481
  111    HH   TYR  13           HH       TYR  13   3.612   3.172   1.744
  112    H    ARG  14           HN       ARG  14   0.954  -4.866   2.567
  113    HA   ARG  14           HA       ARG  14  -0.672  -3.916   0.393
  114    HB2  ARG  14          2HB       ARG  14  -0.684  -6.291   1.029
  115    HB3  ARG  14          1HB       ARG  14  -1.203  -5.863   2.645
  116    HG2  ARG  14          2HG       ARG  14  -3.338  -5.093   1.780
  117    HG3  ARG  14          1HG       ARG  14  -2.802  -5.435   0.133
  118    HD2  ARG  14          2HD       ARG  14  -2.602  -7.758   0.594
  119    HD3  ARG  14          1HD       ARG  14  -2.916  -7.509   2.310
  120    HE   ARG  14           HE       ARG  14  -5.159  -6.639   1.425
  121   HH11  ARG  14          1HH1      ARG  14  -3.381  -9.388   0.077
  122   HH12  ARG  14          2HH1      ARG  14  -4.771 -10.202  -0.470
  123   HH21  ARG  14          1HH2      ARG  14  -7.061  -7.756   0.667
  124   HH22  ARG  14          2HH2      ARG  14  -6.925  -9.258  -0.108
  125    H    LYS  15           HN       LYS  15  -1.228  -1.923   0.720
  126    HA   LYS  15           HA       LYS  15  -2.053  -0.983   3.350
  127    HB2  LYS  15          2HB       LYS  15  -0.467   0.386   2.094
  128    HB3  LYS  15          1HB       LYS  15  -1.611   0.507   0.766
  129    HG2  LYS  15          2HG       LYS  15  -3.172   1.696   2.243
  130    HG3  LYS  15          1HG       LYS  15  -1.979   1.615   3.534
  131    HD2  LYS  15          2HD       LYS  15  -0.416   2.909   2.155
  132    HD3  LYS  15          1HD       LYS  15  -1.629   2.993   0.875
  133    HE2  LYS  15          2HE       LYS  15  -1.646   5.049   2.151
  134    HE3  LYS  15          1HE       LYS  15  -3.147   4.167   2.416
  135    HZ1  LYS  15          1HZ       LYS  15  -2.303   5.031   4.491
  136    HZ2  LYS  15          2HZ       LYS  15  -0.821   4.302   4.247
  137    HZ3  LYS  15          3HZ       LYS  15  -2.172   3.348   4.533
  138    H    CYS  16           HN       CYS  16  -4.081  -0.526   3.847
  139    HA   CYS  16           HA       CYS  16  -6.087  -0.776   1.745
  140    HB2  CYS  16          2HB       CYS  16  -6.317  -1.312   4.704
  141    HB3  CYS  16          1HB       CYS  16  -7.691  -1.280   3.603
  142    H    ARG  17           HN       ARG  17  -6.691   1.021   1.052
  143    HA   ARG  17           HA       ARG  17  -6.893   3.372   2.764
  144    HB2  ARG  17          2HB       ARG  17  -5.696   3.637   0.640
  145    HB3  ARG  17          1HB       ARG  17  -7.062   2.973  -0.237
  146    HG2  ARG  17          2HG       ARG  17  -8.408   4.912   0.426
  147    HG3  ARG  17          1HG       ARG  17  -7.001   5.587   1.257
  148    HD2  ARG  17          2HD       ARG  17  -7.258   6.562  -0.960
  149    HD3  ARG  17          1HD       ARG  17  -5.773   5.616  -0.841
  150    HE   ARG  17           HE       ARG  17  -8.178   4.411  -1.992
  151   HH11  ARG  17          1HH1      ARG  17  -4.890   5.634  -2.474
  152   HH12  ARG  17          2HH1      ARG  17  -4.663   4.926  -3.993
  153   HH21  ARG  17          1HH2      ARG  17  -7.895   3.418  -4.116
  154   HH22  ARG  17          2HH2      ARG  17  -6.429   3.605  -4.953
  155    H    GLY  18           HN       GLY  18  -8.719   2.835   3.896
  156    HA2  GLY  18          2HA       GLY  18 -10.978   2.807   4.258
  157    HA3  GLY  18          1HA       GLY  18 -11.227   3.057   2.527
  Start of MODEL   14
    1    H1   LYS   1           HN       LYS   1 -12.275   0.980   0.870
    2    HA   LYS   1           HA       LYS   1 -11.930  -1.479   2.408
    3    HB2  LYS   1          2HB       LYS   1 -13.643  -0.853   0.016
    4    HB3  LYS   1          1HB       LYS   1 -13.533  -2.417   0.808
    5    HG2  LYS   1          2HG       LYS   1 -14.461   0.109   2.114
    6    HG3  LYS   1          1HG       LYS   1 -15.521  -1.118   1.434
    7    HD2  LYS   1          2HD       LYS   1 -14.405  -2.767   3.005
    8    HD3  LYS   1          1HD       LYS   1 -13.590  -1.395   3.747
    9    HE2  LYS   1          2HE       LYS   1 -15.541  -1.996   5.040
   10    HE3  LYS   1          1HE       LYS   1 -15.771  -0.412   4.301
   11    HZ1  LYS   1          1HZ       LYS   1 -17.120  -1.431   2.595
   12    HZ2  LYS   1          2HZ       LYS   1 -17.752  -1.797   4.096
   13    HZ3  LYS   1          3HZ       LYS   1 -16.881  -2.963   3.241
   14    H    TRP   2           HN       TRP   2 -10.504   0.338  -0.046
   15    HA   TRP   2           HA       TRP   2  -9.817  -1.929  -1.716
   16    HB2  TRP   2          2HB       TRP   2 -10.412   0.347  -2.660
   17    HB3  TRP   2          1HB       TRP   2  -8.920   0.952  -1.960
   18    HD1  TRP   2          1HD       TRP   2  -6.623  -0.536  -2.928
   19    HE1  TRP   2          1HE       TRP   2  -6.131  -1.153  -5.383
   20    HE3  TRP   2          3HE       TRP   2 -11.342  -0.095  -4.841
   21    HZ2  TRP   2          2HZ       TRP   2  -7.554  -1.412  -7.807
   22    HZ3  TRP   2          3HZ       TRP   2 -11.685  -0.541  -7.236
   23    HH2  TRP   2          2HH       TRP   2  -9.826  -1.184  -8.680
   24    H    CYS   3           HN       CYS   3  -8.056  -3.053  -1.339
   25    HA   CYS   3           HA       CYS   3  -5.942  -1.820   0.264
   26    HB2  CYS   3          2HB       CYS   3  -6.670  -4.716  -0.106
   27    HB3  CYS   3          1HB       CYS   3  -5.241  -4.169   0.769
   28    H    PHE   4           HN       PHE   4  -4.135  -1.345  -0.732
   29    HA   PHE   4           HA       PHE   4  -3.567  -2.761  -3.200
   30    HB2  PHE   4          2HB       PHE   4  -2.874  -0.642  -4.276
   31    HB3  PHE   4          1HB       PHE   4  -4.583  -0.660  -3.887
   32    HD1  PHE   4          1HD       PHE   4  -1.530   1.124  -3.644
   33    HD2  PHE   4          2HD       PHE   4  -5.286   0.592  -1.717
   34    HE1  PHE   4          1HE       PHE   4  -1.267   3.298  -2.530
   35    HE2  PHE   4          2HE       PHE   4  -5.025   2.757  -0.601
   36    HZ   PHE   4           HZ       PHE   4  -3.015   4.119  -1.005
   37    H    ARG   5           HN       ARG   5  -1.313  -2.417  -3.881
   38    HA   ARG   5           HA       ARG   5   0.307  -2.799  -1.513
   39    HB2  ARG   5          2HB       ARG   5   0.318  -4.432  -3.406
   40    HB3  ARG   5          1HB       ARG   5   1.064  -3.190  -4.397
   41    HG2  ARG   5          2HG       ARG   5   2.950  -3.089  -2.842
   42    HG3  ARG   5          1HG       ARG   5   2.217  -4.378  -1.886
   43    HD2  ARG   5          2HD       ARG   5   3.866  -5.351  -3.311
   44    HD3  ARG   5          1HD       ARG   5   2.273  -5.810  -3.912
   45    HE   ARG   5           HE       ARG   5   2.822  -3.622  -5.351
   46   HH11  ARG   5          1HH1      ARG   5   4.683  -6.567  -4.740
   47   HH12  ARG   5          2HH1      ARG   5   5.592  -6.463  -6.175
   48   HH21  ARG   5          1HH2      ARG   5   4.026  -3.471  -7.312
   49   HH22  ARG   5          2HH2      ARG   5   5.178  -4.656  -7.700
   50    H    VAL   6           HN       VAL   6   1.603  -1.319  -0.786
   51    HA   VAL   6           HA       VAL   6   2.366   0.909  -2.540
   52    HB   VAL   6           HB       VAL   6   2.308   0.839   0.500
   53   HG11  VAL   6          1HG1      VAL   6   4.010   2.351  -0.383
   54   HG12  VAL   6          2HG1      VAL   6   2.694   3.255   0.364
   55   HG13  VAL   6          3HG1      VAL   6   2.795   3.138  -1.392
   56   HG21  VAL   6          1HG2      VAL   6   0.053   0.811  -0.425
   57   HG22  VAL   6          2HG2      VAL   6   0.434   2.223  -1.412
   58   HG23  VAL   6          3HG2      VAL   6   0.400   2.359   0.348
   59    H    CYS   7           HN       CYS   7   4.439   0.944  -3.069
   60    HA   CYS   7           HA       CYS   7   6.274  -0.669  -1.474
   61    HB2  CYS   7          2HB       CYS   7   6.418   0.086  -4.401
   62    HB3  CYS   7          1HB       CYS   7   7.688  -0.755  -3.516
   63    H    TYR   8           HN       TYR   8   7.577   0.360  -0.307
   64    HA   TYR   8           HA       TYR   8   8.459   3.059  -1.055
   65    HB2  TYR   8          2HB       TYR   8   6.891   3.252   0.761
   66    HB3  TYR   8          1HB       TYR   8   7.685   1.961   1.649
   67    HD1  TYR   8          1HD       TYR   8   8.320   5.383   0.294
   68    HD2  TYR   8          2HD       TYR   8   9.264   2.489   3.263
   69    HE1  TYR   8          1HE       TYR   8   9.683   7.041   1.468
   70    HE2  TYR   8          2HE       TYR   8  10.625   4.133   4.448
   71    HH   TYR   8           HH       TYR   8  10.541   7.455   3.686
   72    H    ARG   9           HN       ARG   9  10.466   2.764  -1.726
   73    HA   ARG   9           HA       ARG   9  12.670   2.306  -1.766
   74    HB2  ARG   9          2HB       ARG   9  12.377   1.895   1.221
   75    HB3  ARG   9          1HB       ARG   9  13.878   2.205   0.360
   76    HG2  ARG   9          2HG       ARG   9  13.011   4.416  -0.302
   77    HG3  ARG   9          1HG       ARG   9  11.555   4.100   0.642
   78    HD2  ARG   9          2HD       ARG   9  13.058   5.442   1.945
   79    HD3  ARG   9          1HD       ARG   9  12.981   3.826   2.644
   80    HE   ARG   9           HE       ARG   9  15.085   4.148   0.756
   81   HH11  ARG   9          1HH1      ARG   9  14.245   4.491   4.178
   82   HH12  ARG   9          2HH1      ARG   9  15.874   4.552   4.678
   83   HH21  ARG   9          1HH2      ARG   9  17.284   4.226   1.478
   84   HH22  ARG   9          2HH2      ARG   9  17.625   4.408   3.135
   85    H    GLY  10           HN       GLY  10  10.756   0.172  -2.077
   86    HA2  GLY  10          2HA       GLY  10  11.284  -2.023  -2.843
   87    HA3  GLY  10          1HA       GLY  10  12.552  -2.086  -1.623
   88    H    ILE  11           HN       ILE  11  10.440  -0.846   0.230
   89    HA   ILE  11           HA       ILE  11   9.550  -3.383   1.284
   90    HB   ILE  11           HB       ILE  11   9.024  -0.562   2.274
   91   HG12  ILE  11          2HG1      ILE  11  11.128  -2.500   3.246
   92   HG13  ILE  11          1HG1      ILE  11  11.449  -1.219   2.080
   93   HG21  ILE  11          1HG2      ILE  11   7.465  -2.229   3.172
   94   HG22  ILE  11          2HG2      ILE  11   8.556  -1.639   4.426
   95   HG23  ILE  11          3HG2      ILE  11   8.824  -3.223   3.698
   96   HD11  ILE  11          1HD1      ILE  11  10.796   0.444   3.738
   97   HD12  ILE  11          2HD1      ILE  11  12.116  -0.567   4.334
   98   HD13  ILE  11          3HD1      ILE  11  10.466  -0.836   4.907
   99    H    CYS  12           HN       CYS  12   7.780  -4.217   0.336
  100    HA   CYS  12           HA       CYS  12   5.693  -2.362  -0.544
  101    HB2  CYS  12          2HB       CYS  12   6.168  -5.208  -1.460
  102    HB3  CYS  12          1HB       CYS  12   4.893  -4.120  -1.999
  103    H    TYR  13           HN       TYR  13   4.012  -2.189   0.694
  104    HA   TYR  13           HA       TYR  13   3.222  -4.514   2.250
  105    HB2  TYR  13          2HB       TYR  13   2.506  -2.918   4.047
  106    HB3  TYR  13          1HB       TYR  13   4.240  -3.009   3.812
  107    HD1  TYR  13          1HD       TYR  13   1.246  -0.833   3.454
  108    HD2  TYR  13          2HD       TYR  13   5.489  -1.078   3.005
  109    HE1  TYR  13          1HE       TYR  13   1.375   1.590   3.305
  110    HE2  TYR  13          2HE       TYR  13   5.602   1.365   2.842
  111    HH   TYR  13           HH       TYR  13   4.159   3.280   2.315
  112    H    ARG  14           HN       ARG  14   1.048  -4.790   2.523
  113    HA   ARG  14           HA       ARG  14  -0.581  -3.562   0.482
  114    HB2  ARG  14          2HB       ARG  14  -0.769  -5.966   0.800
  115    HB3  ARG  14          1HB       ARG  14  -1.152  -5.727   2.494
  116    HG2  ARG  14          2HG       ARG  14  -3.258  -4.671   1.890
  117    HG3  ARG  14          1HG       ARG  14  -2.879  -4.864   0.177
  118    HD2  ARG  14          2HD       ARG  14  -3.169  -7.100   2.178
  119    HD3  ARG  14          1HD       ARG  14  -4.393  -6.625   0.996
  120    HE   ARG  14           HE       ARG  14  -2.448  -7.084  -0.631
  121   HH11  ARG  14          1HH1      ARG  14  -3.257  -9.028   2.204
  122   HH12  ARG  14          2HH1      ARG  14  -2.655 -10.486   1.564
  123   HH21  ARG  14          1HH2      ARG  14  -1.649  -9.074  -1.530
  124   HH22  ARG  14          2HH2      ARG  14  -1.737 -10.513  -0.622
  125    H    LYS  15           HN       LYS  15  -1.028  -1.625   1.026
  126    HA   LYS  15           HA       LYS  15  -1.997  -0.963   3.702
  127    HB2  LYS  15          2HB       LYS  15  -0.118   0.333   2.694
  128    HB3  LYS  15          1HB       LYS  15  -1.160   0.773   1.370
  129    HG2  LYS  15          2HG       LYS  15  -1.898   1.546   4.157
  130    HG3  LYS  15          1HG       LYS  15  -0.682   2.460   3.267
  131    HD2  LYS  15          2HD       LYS  15  -2.251   2.820   1.477
  132    HD3  LYS  15          1HD       LYS  15  -3.466   1.878   2.350
  133    HE2  LYS  15          2HE       LYS  15  -2.199   4.435   3.352
  134    HE3  LYS  15          1HE       LYS  15  -3.776   4.321   2.579
  135    HZ1  LYS  15          1HZ       LYS  15  -4.541   2.920   4.360
  136    HZ2  LYS  15          2HZ       LYS  15  -3.976   4.380   4.964
  137    HZ3  LYS  15          3HZ       LYS  15  -3.035   2.982   5.133
  138    H    CYS  16           HN       CYS  16  -4.090  -0.091   3.977
  139    HA   CYS  16           HA       CYS  16  -5.784  -0.493   1.632
  140    HB2  CYS  16          2HB       CYS  16  -6.508  -0.910   4.533
  141    HB3  CYS  16          1HB       CYS  16  -7.578  -1.160   3.156
  142    H    ARG  17           HN       ARG  17  -7.293   0.909   1.107
  143    HA   ARG  17           HA       ARG  17  -7.573   3.410   2.623
  144    HB2  ARG  17          2HB       ARG  17  -6.262   3.795   0.601
  145    HB3  ARG  17          1HB       ARG  17  -7.455   2.950  -0.369
  146    HG2  ARG  17          2HG       ARG  17  -9.093   4.715   0.154
  147    HG3  ARG  17          1HG       ARG  17  -7.851   5.569   1.071
  148    HD2  ARG  17          2HD       ARG  17  -7.684   4.873  -1.858
  149    HD3  ARG  17          1HD       ARG  17  -8.121   6.454  -1.215
  150    HE   ARG  17           HE       ARG  17  -5.751   5.988  -0.052
  151   HH11  ARG  17          1HH1      ARG  17  -6.740   5.771  -3.439
  152   HH12  ARG  17          2HH1      ARG  17  -5.244   6.265  -4.055
  153   HH21  ARG  17          1HH2      ARG  17  -3.692   6.650  -0.886
  154   HH22  ARG  17          2HH2      ARG  17  -3.457   6.804  -2.568
  155    H    GLY  18           HN       GLY  18  -9.582   3.224   3.475
  156    HA2  GLY  18          2HA       GLY  18 -11.833   2.870   3.596
  157    HA3  GLY  18          1HA       GLY  18 -11.858   2.853   1.830
  Start of MODEL   15
    1    H1   LYS   1           HN       LYS   1 -12.038   1.162   1.110
    2    HA   LYS   1           HA       LYS   1 -12.059  -1.486   2.390
    3    HB2  LYS   1          2HB       LYS   1 -13.914  -2.120   0.887
    4    HB3  LYS   1          1HB       LYS   1 -14.339  -0.818   1.987
    5    HG2  LYS   1          2HG       LYS   1 -14.158   0.804   0.221
    6    HG3  LYS   1          1HG       LYS   1 -13.543  -0.418  -0.893
    7    HD2  LYS   1          2HD       LYS   1 -15.892   0.018  -1.340
    8    HD3  LYS   1          1HD       LYS   1 -15.682  -1.618  -0.725
    9    HE2  LYS   1          2HE       LYS   1 -17.633  -0.591   0.275
   10    HE3  LYS   1          1HE       LYS   1 -16.406  -0.859   1.505
   11    HZ1  LYS   1          1HZ       LYS   1 -16.888   1.732   0.142
   12    HZ2  LYS   1          2HZ       LYS   1 -15.872   1.473   1.469
   13    HZ3  LYS   1          3HZ       LYS   1 -17.521   1.325   1.631
   14    H    TRP   2           HN       TRP   2 -10.340   0.294   0.253
   15    HA   TRP   2           HA       TRP   2 -10.003  -1.980  -1.537
   16    HB2  TRP   2          2HB       TRP   2 -10.639   0.297  -2.515
   17    HB3  TRP   2          1HB       TRP   2  -9.027   0.821  -2.057
   18    HD1  TRP   2          1HD       TRP   2  -6.952  -0.648  -3.206
   19    HE1  TRP   2          1HE       TRP   2  -6.779  -1.616  -5.590
   20    HE3  TRP   2          3HE       TRP   2 -11.897  -0.662  -4.413
   21    HZ2  TRP   2          2HZ       TRP   2  -8.518  -2.292  -7.693
   22    HZ3  TRP   2          3HZ       TRP   2 -12.563  -1.490  -6.634
   23    HH2  TRP   2          2HH       TRP   2 -10.900  -2.288  -8.233
   24    H    CYS   3           HN       CYS   3  -8.159  -3.062  -1.393
   25    HA   CYS   3           HA       CYS   3  -5.967  -1.831   0.100
   26    HB2  CYS   3          2HB       CYS   3  -6.664  -4.732  -0.273
   27    HB3  CYS   3          1HB       CYS   3  -5.210  -4.159   0.541
   28    H    PHE   4           HN       PHE   4  -4.111  -1.528  -0.843
   29    HA   PHE   4           HA       PHE   4  -3.586  -2.776  -3.414
   30    HB2  PHE   4          2HB       PHE   4  -2.694  -0.492  -4.163
   31    HB3  PHE   4          1HB       PHE   4  -4.441  -0.679  -4.097
   32    HD1  PHE   4          1HD       PHE   4  -5.756   0.737  -2.749
   33    HD2  PHE   4          2HD       PHE   4  -1.533   0.746  -2.308
   34    HE1  PHE   4          1HE       PHE   4  -5.927   2.700  -1.325
   35    HE2  PHE   4          2HE       PHE   4  -1.700   2.733  -0.877
   36    HZ   PHE   4           HZ       PHE   4  -3.896   3.707  -0.373
   37    H    ARG   5           HN       ARG   5  -1.244  -2.343  -4.021
   38    HA   ARG   5           HA       ARG   5   0.303  -2.766  -1.580
   39    HB2  ARG   5          2HB       ARG   5   0.334  -4.579  -3.237
   40    HB3  ARG   5          1HB       ARG   5   1.013  -3.479  -4.428
   41    HG2  ARG   5          2HG       ARG   5   3.010  -3.211  -3.060
   42    HG3  ARG   5          1HG       ARG   5   2.326  -4.274  -1.832
   43    HD2  ARG   5          2HD       ARG   5   3.887  -5.516  -3.191
   44    HD3  ARG   5          1HD       ARG   5   2.252  -6.092  -3.504
   45    HE   ARG   5           HE       ARG   5   2.964  -4.076  -5.333
   46   HH11  ARG   5          1HH1      ARG   5   3.723  -7.470  -4.641
   47   HH12  ARG   5          2HH1      ARG   5   3.989  -7.879  -6.275
   48   HH21  ARG   5          1HH2      ARG   5   3.417  -4.626  -7.529
   49   HH22  ARG   5          2HH2      ARG   5   3.844  -6.226  -7.952
   50    H    VAL   6           HN       VAL   6   1.595  -1.274  -0.923
   51    HA   VAL   6           HA       VAL   6   2.439   0.831  -2.784
   52    HB   VAL   6           HB       VAL   6   2.349   0.873   0.251
   53   HG11  VAL   6          1HG1      VAL   6   4.146   2.264  -0.607
   54   HG12  VAL   6          2HG1      VAL   6   2.847   3.275   0.027
   55   HG13  VAL   6          3HG1      VAL   6   3.029   3.054  -1.714
   56   HG21  VAL   6          1HG2      VAL   6   0.598   2.273  -1.760
   57   HG22  VAL   6          2HG2      VAL   6   0.540   2.489  -0.009
   58   HG23  VAL   6          3HG2      VAL   6   0.125   0.931  -0.719
   59    H    CYS   7           HN       CYS   7   4.534   0.833  -3.295
   60    HA   CYS   7           HA       CYS   7   6.307  -0.714  -1.578
   61    HB2  CYS   7          2HB       CYS   7   6.532  -0.124  -4.535
   62    HB3  CYS   7          1HB       CYS   7   7.783  -0.917  -3.577
   63    H    TYR   8           HN       TYR   8   7.600   0.344  -0.424
   64    HA   TYR   8           HA       TYR   8   8.511   3.011  -1.243
   65    HB2  TYR   8          2HB       TYR   8   6.837   3.312   0.457
   66    HB3  TYR   8          1HB       TYR   8   7.546   2.050   1.451
   67    HD1  TYR   8          1HD       TYR   8   8.332   5.397  -0.000
   68    HD2  TYR   8          2HD       TYR   8   9.017   2.634   3.160
   69    HE1  TYR   8          1HE       TYR   8   9.595   7.096   1.204
   70    HE2  TYR   8          2HE       TYR   8  10.292   4.322   4.374
   71    HH   TYR   8           HH       TYR   8  10.248   7.600   3.513
   72    H    ARG   9           HN       ARG   9  10.571   2.724  -1.707
   73    HA   ARG   9           HA       ARG   9  12.752   2.306  -1.556
   74    HB2  ARG   9          2HB       ARG   9  12.197   2.076   1.409
   75    HB3  ARG   9          1HB       ARG   9  13.801   2.191   0.697
   76    HG2  ARG   9          2HG       ARG   9  13.073   4.392  -0.300
   77    HG3  ARG   9          1HG       ARG   9  11.625   4.253   0.674
   78    HD2  ARG   9          2HD       ARG   9  12.892   4.269   2.713
   79    HD3  ARG   9          1HD       ARG   9  14.414   4.222   1.819
   80    HE   ARG   9           HE       ARG   9  12.843   6.441   1.039
   81   HH11  ARG   9          1HH1      ARG   9  14.883   5.398   3.755
   82   HH12  ARG   9          2HH1      ARG   9  15.401   6.979   4.119
   83   HH21  ARG   9          1HH2      ARG   9  13.540   8.579   1.594
   84   HH22  ARG   9          2HH2      ARG   9  14.606   8.814   2.909
   85    H    GLY  10           HN       GLY  10  10.917   0.091  -1.942
   86    HA2  GLY  10          2HA       GLY  10  11.569  -2.108  -2.603
   87    HA3  GLY  10          1HA       GLY  10  12.817  -2.075  -1.364
   88    H    ILE  11           HN       ILE  11  10.387  -0.818   0.223
   89    HA   ILE  11           HA       ILE  11   9.560  -3.357   1.395
   90    HB   ILE  11           HB       ILE  11   8.945  -0.522   2.276
   91   HG12  ILE  11          2HG1      ILE  11  11.073  -2.344   3.396
   92   HG13  ILE  11          1HG1      ILE  11  11.397  -1.108   2.184
   93   HG21  ILE  11          1HG2      ILE  11   8.781  -3.151   3.765
   94   HG22  ILE  11          2HG2      ILE  11   7.412  -2.208   3.179
   95   HG23  ILE  11          3HG2      ILE  11   8.448  -1.561   4.451
   96   HD11  ILE  11          1HD1      ILE  11  11.946  -0.332   4.410
   97   HD12  ILE  11          2HD1      ILE  11  10.286  -0.635   4.938
   98   HD13  ILE  11          3HD1      ILE  11  10.618   0.604   3.727
   99    H    CYS  12           HN       CYS  12   7.809  -4.198   0.435
  100    HA   CYS  12           HA       CYS  12   5.761  -2.357  -0.546
  101    HB2  CYS  12          2HB       CYS  12   6.226  -5.257  -1.284
  102    HB3  CYS  12          1HB       CYS  12   4.941  -4.221  -1.904
  103    H    TYR  13           HN       TYR  13   3.972  -2.155   0.564
  104    HA   TYR  13           HA       TYR  13   3.227  -4.345   2.317
  105    HB2  TYR  13          2HB       TYR  13   2.521  -2.686   4.033
  106    HB3  TYR  13          1HB       TYR  13   4.252  -2.717   3.765
  107    HD1  TYR  13          1HD       TYR  13   5.331  -0.804   2.528
  108    HD2  TYR  13          2HD       TYR  13   1.238  -0.710   3.687
  109    HE1  TYR  13          1HE       TYR  13   5.317   1.636   2.263
  110    HE2  TYR  13          2HE       TYR  13   1.213   1.725   3.420
  111    HH   TYR  13           HH       TYR  13   3.635   3.449   1.839
  112    H    ARG  14           HN       ARG  14   1.027  -4.439   2.835
  113    HA   ARG  14           HA       ARG  14  -0.621  -3.715   0.562
  114    HB2  ARG  14          2HB       ARG  14  -0.521  -6.046   1.566
  115    HB3  ARG  14          1HB       ARG  14  -1.288  -5.381   2.991
  116    HG2  ARG  14          2HG       ARG  14  -2.944  -6.486   1.700
  117    HG3  ARG  14          1HG       ARG  14  -3.229  -4.751   1.574
  118    HD2  ARG  14          2HD       ARG  14  -2.243  -4.700  -0.626
  119    HD3  ARG  14          1HD       ARG  14  -1.745  -6.389  -0.485
  120    HE   ARG  14           HE       ARG  14  -4.499  -6.189  -0.079
  121   HH11  ARG  14          1HH1      ARG  14  -2.140  -6.161  -2.760
  122   HH12  ARG  14          2HH1      ARG  14  -3.312  -6.549  -3.921
  123   HH21  ARG  14          1HH2      ARG  14  -6.054  -6.748  -1.706
  124   HH22  ARG  14          2HH2      ARG  14  -5.574  -6.861  -3.334
  125    H    LYS  15           HN       LYS  15  -1.044  -1.609   0.864
  126    HA   LYS  15           HA       LYS  15  -2.011  -0.631   3.437
  127    HB2  LYS  15          2HB       LYS  15  -0.323   0.660   2.108
  128    HB3  LYS  15          1HB       LYS  15  -1.533   0.868   0.856
  129    HG2  LYS  15          2HG       LYS  15  -2.929   2.139   2.417
  130    HG3  LYS  15          1HG       LYS  15  -1.706   1.926   3.671
  131    HD2  LYS  15          2HD       LYS  15  -0.073   3.103   2.259
  132    HD3  LYS  15          1HD       LYS  15  -1.319   3.338   1.037
  133    HE2  LYS  15          2HE       LYS  15  -1.062   5.351   2.351
  134    HE3  LYS  15          1HE       LYS  15  -2.637   4.622   2.651
  135    HZ1  LYS  15          1HZ       LYS  15  -0.273   4.310   4.408
  136    HZ2  LYS  15          2HZ       LYS  15  -1.823   3.755   4.751
  137    HZ3  LYS  15          3HZ       LYS  15  -1.512   5.398   4.672
  138    H    CYS  16           HN       CYS  16  -4.091   0.107   3.721
  139    HA   CYS  16           HA       CYS  16  -5.934  -0.494   1.525
  140    HB2  CYS  16          2HB       CYS  16  -6.378  -1.038   4.464
  141    HB3  CYS  16          1HB       CYS  16  -7.553  -1.306   3.182
  142    H    ARG  17           HN       ARG  17  -7.207   1.079   0.962
  143    HA   ARG  17           HA       ARG  17  -7.546   3.343   2.793
  144    HB2  ARG  17          2HB       ARG  17  -6.362   3.854   0.648
  145    HB3  ARG  17          1HB       ARG  17  -7.764   3.265  -0.226
  146    HG2  ARG  17          2HG       ARG  17  -9.120   5.070   0.681
  147    HG3  ARG  17          1HG       ARG  17  -7.743   5.646   1.625
  148    HD2  ARG  17          2HD       ARG  17  -6.491   6.036  -0.449
  149    HD3  ARG  17          1HD       ARG  17  -7.869   5.476  -1.388
  150    HE   ARG  17           HE       ARG  17  -8.655   7.576   0.301
  151   HH11  ARG  17          1HH1      ARG  17  -6.776   7.014  -2.644
  152   HH12  ARG  17          2HH1      ARG  17  -7.036   8.582  -3.271
  153   HH21  ARG  17          1HH2      ARG  17  -9.009   9.738  -0.601
  154   HH22  ARG  17          2HH2      ARG  17  -8.315  10.132  -2.111
  155    H    GLY  18           HN       GLY  18  -9.342   2.817   3.826
  156    HA2  GLY  18          2HA       GLY  18 -11.591   2.625   4.174
  157    HA3  GLY  18          1HA       GLY  18 -11.839   2.880   2.451
  Start of MODEL   16
    1    H1   LYS   1           HN       LYS   1 -12.202   1.593   1.331
    2    HA   LYS   1           HA       LYS   1 -12.186  -1.212   2.150
    3    HB2  LYS   1          2HB       LYS   1 -14.092  -1.463   0.598
    4    HB3  LYS   1          1HB       LYS   1 -14.375  -0.240   1.826
    5    HG2  LYS   1          2HG       LYS   1 -13.870   1.516   0.193
    6    HG3  LYS   1          1HG       LYS   1 -13.587   0.286  -1.040
    7    HD2  LYS   1          2HD       LYS   1 -15.810   1.205  -1.314
    8    HD3  LYS   1          1HD       LYS   1 -15.938  -0.461  -0.756
    9    HE2  LYS   1          2HE       LYS   1 -16.328   0.341   1.527
   10    HE3  LYS   1          1HE       LYS   1 -16.187   2.006   0.962
   11    HZ1  LYS   1          1HZ       LYS   1 -18.508   1.277   1.176
   12    HZ2  LYS   1          2HZ       LYS   1 -18.232   0.064   0.040
   13    HZ3  LYS   1          3HZ       LYS   1 -18.137   1.665  -0.419
   14    H    TRP   2           HN       TRP   2 -10.158   0.491   0.468
   15    HA   TRP   2           HA       TRP   2  -9.888  -1.417  -1.732
   16    HB2  TRP   2          2HB       TRP   2 -10.390   0.819  -2.532
   17    HB3  TRP   2          1HB       TRP   2  -9.112   1.492  -1.545
   18    HD1  TRP   2          1HD       TRP   2  -8.576  -1.605  -3.732
   19    HE1  TRP   2          1HE       TRP   2  -6.850  -1.018  -5.581
   20    HE3  TRP   2          3HE       TRP   2  -8.157   3.385  -2.847
   21    HZ2  TRP   2          2HZ       TRP   2  -5.513   1.309  -6.522
   22    HZ3  TRP   2          3HZ       TRP   2  -6.658   4.726  -4.261
   23    HH2  TRP   2          2HH       TRP   2  -5.369   3.702  -6.055
   24    H    CYS   3           HN       CYS   3  -8.335  -2.822  -1.206
   25    HA   CYS   3           HA       CYS   3  -5.970  -1.820   0.197
   26    HB2  CYS   3          2HB       CYS   3  -7.049  -4.637  -0.033
   27    HB3  CYS   3          1HB       CYS   3  -5.550  -4.197   0.769
   28    H    PHE   4           HN       PHE   4  -4.136  -1.735  -0.865
   29    HA   PHE   4           HA       PHE   4  -3.733  -3.397  -3.193
   30    HB2  PHE   4          2HB       PHE   4  -3.057  -1.459  -4.577
   31    HB3  PHE   4          1HB       PHE   4  -4.745  -1.348  -4.112
   32    HD1  PHE   4          1HD       PHE   4  -1.637   0.334  -4.268
   33    HD2  PHE   4          2HD       PHE   4  -5.272   0.172  -2.061
   34    HE1  PHE   4          1HE       PHE   4  -1.229   2.602  -3.428
   35    HE2  PHE   4          2HE       PHE   4  -4.866   2.434  -1.210
   36    HZ   PHE   4           HZ       PHE   4  -2.826   3.658  -1.901
   37    H    ARG   5           HN       ARG   5  -1.389  -3.099  -3.914
   38    HA   ARG   5           HA       ARG   5   0.171  -3.085  -1.467
   39    HB2  ARG   5          2HB       ARG   5   0.299  -5.004  -3.066
   40    HB3  ARG   5          1HB       ARG   5   1.036  -3.914  -4.232
   41    HG2  ARG   5          2HG       ARG   5   2.858  -3.481  -2.619
   42    HG3  ARG   5          1HG       ARG   5   2.140  -4.673  -1.538
   43    HD2  ARG   5          2HD       ARG   5   3.869  -5.771  -2.738
   44    HD3  ARG   5          1HD       ARG   5   2.332  -6.326  -3.389
   45    HE   ARG   5           HE       ARG   5   3.242  -4.127  -4.870
   46   HH11  ARG   5          1HH1      ARG   5   3.851  -7.582  -4.379
   47   HH12  ARG   5          2HH1      ARG   5   4.633  -7.815  -5.872
   48   HH21  ARG   5          1HH2      ARG   5   4.322  -4.449  -6.951
   49   HH22  ARG   5          2HH2      ARG   5   4.887  -5.994  -7.375
   50    H    VAL   6           HN       VAL   6   1.634  -1.626  -1.002
   51    HA   VAL   6           HA       VAL   6   2.357   0.372  -3.026
   52    HB   VAL   6           HB       VAL   6   2.242   0.740  -0.011
   53   HG11  VAL   6          1HG1      VAL   6   2.589   3.122  -0.497
   54   HG12  VAL   6          2HG1      VAL   6   2.764   2.738  -2.209
   55   HG13  VAL   6          3HG1      VAL   6   3.940   2.128  -1.045
   56   HG21  VAL   6          1HG2      VAL   6  -0.001   0.562  -0.946
   57   HG22  VAL   6          2HG2      VAL   6   0.379   1.831  -2.111
   58   HG23  VAL   6          3HG2      VAL   6   0.327   2.201  -0.387
   59    H    CYS   7           HN       CYS   7   4.528   0.489  -3.363
   60    HA   CYS   7           HA       CYS   7   6.249  -0.889  -1.440
   61    HB2  CYS   7          2HB       CYS   7   6.758  -0.260  -4.363
   62    HB3  CYS   7          1HB       CYS   7   7.923  -1.006  -3.278
   63    H    TYR   8           HN       TYR   8   7.316   0.305  -0.186
   64    HA   TYR   8           HA       TYR   8   7.953   3.060  -0.979
   65    HB2  TYR   8          2HB       TYR   8   6.198   2.960   0.756
   66    HB3  TYR   8          1HB       TYR   8   7.256   1.960   1.745
   67    HD1  TYR   8          1HD       TYR   8   7.075   5.313   0.153
   68    HD2  TYR   8          2HD       TYR   8   8.629   2.952   3.323
   69    HE1  TYR   8          1HE       TYR   8   7.967   7.330   1.201
   70    HE2  TYR   8          2HE       TYR   8   9.529   4.946   4.391
   71    HH   TYR   8           HH       TYR   8   8.610   8.068   3.480
   72    H    ARG   9           HN       ARG   9  10.024   3.155  -1.356
   73    HA   ARG   9           HA       ARG   9  12.281   2.916  -1.251
   74    HB2  ARG   9          2HB       ARG   9  11.835   2.227   1.664
   75    HB3  ARG   9          1HB       ARG   9  13.351   2.733   0.941
   76    HG2  ARG   9          2HG       ARG   9  12.262   4.915   0.393
   77    HG3  ARG   9          1HG       ARG   9  10.867   4.370   1.317
   78    HD2  ARG   9          2HD       ARG   9  12.385   4.011   3.267
   79    HD3  ARG   9          1HD       ARG   9  13.666   4.792   2.341
   80    HE   ARG   9           HE       ARG   9  11.227   6.287   2.560
   81   HH11  ARG   9          1HH1      ARG   9  14.500   5.835   3.893
   82   HH12  ARG   9          2HH1      ARG   9  14.406   7.209   4.882
   83   HH21  ARG   9          1HH2      ARG   9  11.129   8.128   3.946
   84   HH22  ARG   9          2HH2      ARG   9  12.467   8.563   4.914
   85    H    GLY  10           HN       GLY  10  10.657   0.587  -1.915
   86    HA2  GLY  10          2HA       GLY  10  11.444  -1.515  -2.678
   87    HA3  GLY  10          1HA       GLY  10  12.682  -1.474  -1.432
   88    H    ILE  11           HN       ILE  11  10.278  -0.553   0.354
   89    HA   ILE  11           HA       ILE  11   9.717  -3.221   1.358
   90    HB   ILE  11           HB       ILE  11   8.819  -0.526   2.430
   91   HG12  ILE  11          2HG1      ILE  11  11.215  -2.113   3.361
   92   HG13  ILE  11          1HG1      ILE  11  11.326  -0.800   2.194
   93   HG21  ILE  11          1HG2      ILE  11   7.558  -2.430   3.302
   94   HG22  ILE  11          2HG2      ILE  11   8.582  -1.742   4.562
   95   HG23  ILE  11          3HG2      ILE  11   9.062  -3.233   3.755
   96   HD11  ILE  11          1HD1      ILE  11  10.450   0.759   3.862
   97   HD12  ILE  11          2HD1      ILE  11  11.893  -0.059   4.461
   98   HD13  ILE  11          3HD1      ILE  11  10.295  -0.562   5.018
   99    H    CYS  12           HN       CYS  12   8.095  -4.170   0.250
  100    HA   CYS  12           HA       CYS  12   5.830  -2.545  -0.615
  101    HB2  CYS  12          2HB       CYS  12   6.476  -5.425  -1.258
  102    HB3  CYS  12          1HB       CYS  12   5.195  -4.434  -1.959
  103    H    TYR  13           HN       TYR  13   3.918  -2.573   0.329
  104    HA   TYR  13           HA       TYR  13   3.259  -4.757   2.117
  105    HB2  TYR  13          2HB       TYR  13   2.622  -3.129   3.901
  106    HB3  TYR  13          1HB       TYR  13   4.349  -3.179   3.591
  107    HD1  TYR  13          1HD       TYR  13   1.363  -1.101   3.630
  108    HD2  TYR  13          2HD       TYR  13   5.415  -1.287   2.326
  109    HE1  TYR  13          1HE       TYR  13   1.395   1.331   3.367
  110    HE2  TYR  13          2HE       TYR  13   5.439   1.140   2.062
  111    HH   TYR  13           HH       TYR  13   3.130   3.118   3.383
  112    H    ARG  14           HN       ARG  14   0.998  -4.807   2.613
  113    HA   ARG  14           HA       ARG  14  -0.602  -3.765   0.424
  114    HB2  ARG  14          2HB       ARG  14  -0.875  -6.112   1.241
  115    HB3  ARG  14          1HB       ARG  14  -1.464  -5.471   2.767
  116    HG2  ARG  14          2HG       ARG  14  -3.246  -4.273   1.361
  117    HG3  ARG  14          1HG       ARG  14  -2.768  -5.368   0.065
  118    HD2  ARG  14          2HD       ARG  14  -3.828  -6.120   2.785
  119    HD3  ARG  14          1HD       ARG  14  -4.662  -6.288   1.250
  120    HE   ARG  14           HE       ARG  14  -3.007  -7.960   0.642
  121   HH11  ARG  14          1HH1      ARG  14  -3.325  -7.179   4.098
  122   HH12  ARG  14          2HH1      ARG  14  -2.796  -8.702   4.626
  123   HH21  ARG  14          1HH2      ARG  14  -2.267 -10.057   1.415
  124   HH22  ARG  14          2HH2      ARG  14  -2.170 -10.373   3.076
  125    H    LYS  15           HN       LYS  15  -1.036  -1.689   0.709
  126    HA   LYS  15           HA       LYS  15  -1.854  -0.710   3.321
  127    HB2  LYS  15          2HB       LYS  15  -0.228   0.647   2.119
  128    HB3  LYS  15          1HB       LYS  15  -1.282   0.725   0.722
  129    HG2  LYS  15          2HG       LYS  15  -1.315   2.826   1.947
  130    HG3  LYS  15          1HG       LYS  15  -2.896   2.049   2.013
  131    HD2  LYS  15          2HD       LYS  15  -2.343   1.182   4.263
  132    HD3  LYS  15          1HD       LYS  15  -0.797   2.030   4.185
  133    HE2  LYS  15          2HE       LYS  15  -3.511   3.329   4.018
  134    HE3  LYS  15          1HE       LYS  15  -2.523   3.257   5.472
  135    HZ1  LYS  15          1HZ       LYS  15  -1.737   4.616   2.939
  136    HZ2  LYS  15          2HZ       LYS  15  -0.840   4.565   4.362
  137    HZ3  LYS  15          3HZ       LYS  15  -2.310   5.373   4.328
  138    H    CYS  16           HN       CYS  16  -3.904  -0.190   3.766
  139    HA   CYS  16           HA       CYS  16  -5.850  -0.557   1.624
  140    HB2  CYS  16          2HB       CYS  16  -6.196  -0.900   4.610
  141    HB3  CYS  16          1HB       CYS  16  -7.488  -1.039   3.427
  142    H    ARG  17           HN       ARG  17  -6.904   1.105   0.970
  143    HA   ARG  17           HA       ARG  17  -7.030   3.465   2.692
  144    HB2  ARG  17          2HB       ARG  17  -5.852   3.802   0.495
  145    HB3  ARG  17          1HB       ARG  17  -7.299   3.258  -0.337
  146    HG2  ARG  17          2HG       ARG  17  -7.171   5.663  -0.433
  147    HG3  ARG  17          1HG       ARG  17  -8.521   5.196   0.602
  148    HD2  ARG  17          2HD       ARG  17  -7.098   5.564   2.580
  149    HD3  ARG  17          1HD       ARG  17  -5.788   6.075   1.524
  150    HE   ARG  17           HE       ARG  17  -7.888   7.684   0.860
  151   HH11  ARG  17          1HH1      ARG  17  -6.076   7.031   3.798
  152   HH12  ARG  17          2HH1      ARG  17  -6.383   8.546   4.511
  153   HH21  ARG  17          1HH2      ARG  17  -8.307   9.779   1.821
  154   HH22  ARG  17          2HH2      ARG  17  -7.673  10.153   3.350
  155    H    GLY  18           HN       GLY  18  -8.795   2.734   3.809
  156    HA2  GLY  18          2HA       GLY  18 -11.003   2.507   4.242
  157    HA3  GLY  18          1HA       GLY  18 -11.339   3.031   2.591
  Start of MODEL   17
    1    H1   LYS   1           HN       LYS   1 -12.228   0.601   1.568
    2    HA   LYS   1           HA       LYS   1 -11.202  -2.013   2.435
    3    HB2  LYS   1          2HB       LYS   1 -13.070  -2.984   1.120
    4    HB3  LYS   1          1HB       LYS   1 -13.618  -1.949   2.433
    5    HG2  LYS   1          2HG       LYS   1 -13.943  -0.137   0.846
    6    HG3  LYS   1          1HG       LYS   1 -13.452  -1.208  -0.467
    7    HD2  LYS   1          2HD       LYS   1 -15.343  -2.639  -0.034
    8    HD3  LYS   1          1HD       LYS   1 -15.778  -1.674   1.381
    9    HE2  LYS   1          2HE       LYS   1 -15.727  -0.714  -1.475
   10    HE3  LYS   1          1HE       LYS   1 -17.170  -1.072  -0.528
   11    HZ1  LYS   1          1HZ       LYS   1 -16.753   1.278  -0.532
   12    HZ2  LYS   1          2HZ       LYS   1 -15.187   1.067   0.043
   13    HZ3  LYS   1          3HZ       LYS   1 -16.499   0.687   1.027
   14    H    TRP   2           HN       TRP   2 -10.402   0.336   0.379
   15    HA   TRP   2           HA       TRP   2  -9.861  -1.379  -1.912
   16    HB2  TRP   2          2HB       TRP   2 -10.639   1.056  -2.161
   17    HB3  TRP   2          1HB       TRP   2  -9.067   1.528  -1.531
   18    HD1  TRP   2          1HD       TRP   2  -7.069  -0.165  -3.169
   19    HE1  TRP   2          1HE       TRP   2  -6.854   0.063  -5.725
   20    HE3  TRP   2          3HE       TRP   2 -11.612   1.918  -4.182
   21    HZ2  TRP   2          2HZ       TRP   2  -8.394   1.022  -7.877
   22    HZ3  TRP   2          3HZ       TRP   2 -12.164   2.469  -6.520
   23    HH2  TRP   2          2HH       TRP   2 -10.582   2.027  -8.321
   24    H    CYS   3           HN       CYS   3  -8.183  -2.672  -1.547
   25    HA   CYS   3           HA       CYS   3  -5.922  -1.591  -0.035
   26    HB2  CYS   3          2HB       CYS   3  -6.776  -4.430  -0.487
   27    HB3  CYS   3          1HB       CYS   3  -5.350  -3.944   0.422
   28    H    PHE   4           HN       PHE   4  -4.128  -1.251  -1.043
   29    HA   PHE   4           HA       PHE   4  -3.610  -2.638  -3.543
   30    HB2  PHE   4          2HB       PHE   4  -2.771  -0.468  -4.496
   31    HB3  PHE   4          1HB       PHE   4  -4.505  -0.523  -4.239
   32    HD1  PHE   4          1HD       PHE   4  -1.459   1.230  -3.540
   33    HD2  PHE   4          2HD       PHE   4  -5.462   0.687  -2.205
   34    HE1  PHE   4          1HE       PHE   4  -1.340   3.349  -2.299
   35    HE2  PHE   4          2HE       PHE   4  -5.344   2.796  -0.964
   36    HZ   PHE   4           HZ       PHE   4  -3.283   4.134  -1.008
   37    H    ARG   5           HN       ARG   5  -1.362  -2.742  -4.082
   38    HA   ARG   5           HA       ARG   5   0.228  -2.963  -1.673
   39    HB2  ARG   5          2HB       ARG   5   0.269  -4.737  -3.444
   40    HB3  ARG   5          1HB       ARG   5   1.051  -3.577  -4.513
   41    HG2  ARG   5          2HG       ARG   5   2.849  -3.347  -2.763
   42    HG3  ARG   5          1HG       ARG   5   2.126  -4.735  -1.955
   43    HD2  ARG   5          2HD       ARG   5   3.916  -5.521  -3.300
   44    HD3  ARG   5          1HD       ARG   5   2.414  -6.007  -4.093
   45    HE   ARG   5           HE       ARG   5   3.511  -3.507  -4.987
   46   HH11  ARG   5          1HH1      ARG   5   3.396  -6.983  -5.553
   47   HH12  ARG   5          2HH1      ARG   5   4.070  -6.891  -7.115
   48   HH21  ARG   5          1HH2      ARG   5   4.485  -3.369  -7.093
   49   HH22  ARG   5          2HH2      ARG   5   4.735  -4.783  -7.997
   50    H    VAL   6           HN       VAL   6   1.603  -1.493  -1.047
   51    HA   VAL   6           HA       VAL   6   2.391   0.602  -2.938
   52    HB   VAL   6           HB       VAL   6   2.364   0.729   0.084
   53   HG11  VAL   6          1HG1      VAL   6   2.679   2.895  -1.977
   54   HG12  VAL   6          2HG1      VAL   6   3.956   2.225  -0.958
   55   HG13  VAL   6          3HG1      VAL   6   2.617   3.116  -0.228
   56   HG21  VAL   6          1HG2      VAL   6   0.388   2.168  -0.114
   57   HG22  VAL   6          2HG2      VAL   6   0.078   0.538  -0.703
   58   HG23  VAL   6          3HG2      VAL   6   0.344   1.853  -1.848
   59    H    CYS   7           HN       CYS   7   4.537   0.582  -3.396
   60    HA   CYS   7           HA       CYS   7   6.250  -0.839  -1.509
   61    HB2  CYS   7          2HB       CYS   7   6.670  -0.435  -4.483
   62    HB3  CYS   7          1HB       CYS   7   7.842  -1.164  -3.394
   63    H    TYR   8           HN       TYR   8   7.481   0.299  -0.358
   64    HA   TYR   8           HA       TYR   8   8.326   2.922  -1.328
   65    HB2  TYR   8          2HB       TYR   8   6.643   3.166   0.407
   66    HB3  TYR   8          1HB       TYR   8   7.544   2.084   1.458
   67    HD1  TYR   8          1HD       TYR   8   8.271   5.194  -0.508
   68    HD2  TYR   8          2HD       TYR   8   8.630   3.119   3.180
   69    HE1  TYR   8          1HE       TYR   8   9.365   7.145   0.466
   70    HE2  TYR   8          2HE       TYR   8   9.748   5.063   4.172
   71    HH   TYR   8           HH       TYR   8   9.700   8.096   2.666
   72    H    ARG   9           HN       ARG   9  10.300   2.476  -1.969
   73    HA   ARG   9           HA       ARG   9  12.531   2.141  -1.868
   74    HB2  ARG   9          2HB       ARG   9  12.043   2.409   1.106
   75    HB3  ARG   9          1HB       ARG   9  13.638   2.418   0.364
   76    HG2  ARG   9          2HG       ARG   9  12.930   4.404  -0.980
   77    HG3  ARG   9          1HG       ARG   9  11.419   4.378  -0.102
   78    HD2  ARG   9          2HD       ARG   9  12.473   4.863   1.953
   79    HD3  ARG   9          1HD       ARG   9  14.082   4.629   1.264
   80    HE   ARG   9           HE       ARG   9  13.091   6.538  -0.304
   81   HH11  ARG   9          1HH1      ARG   9  13.166   6.371   3.239
   82   HH12  ARG   9          2HH1      ARG   9  13.310   8.049   3.455
   83   HH21  ARG   9          1HH2      ARG   9  13.330   8.854  -0.004
   84   HH22  ARG   9          2HH2      ARG   9  13.392   9.497   1.561
   85    H    GLY  10           HN       GLY  10  10.806  -0.096  -1.958
   86    HA2  GLY  10          2HA       GLY  10  11.493  -2.348  -2.336
   87    HA3  GLY  10          1HA       GLY  10  12.739  -2.144  -1.111
   88    H    ILE  11           HN       ILE  11  10.274  -0.776   0.319
   89    HA   ILE  11           HA       ILE  11   9.488  -3.207   1.721
   90    HB   ILE  11           HB       ILE  11   8.900  -0.302   2.380
   91   HG12  ILE  11          2HG1      ILE  11  11.023  -2.067   3.610
   92   HG13  ILE  11          1HG1      ILE  11  11.347  -0.915   2.320
   93   HG21  ILE  11          1HG2      ILE  11   8.406  -1.165   4.629
   94   HG22  ILE  11          2HG2      ILE  11   8.721  -2.809   4.073
   95   HG23  ILE  11          3HG2      ILE  11   7.356  -1.903   3.418
   96   HD11  ILE  11          1HD1      ILE  11  10.648   0.906   3.742
   97   HD12  ILE  11          2HD1      ILE  11  11.922  -0.033   4.524
   98   HD13  ILE  11          3HD1      ILE  11  10.240  -0.227   5.030
   99    H    CYS  12           HN       CYS  12   7.873  -4.117   0.569
  100    HA   CYS  12           HA       CYS  12   5.760  -2.396  -0.455
  101    HB2  CYS  12          2HB       CYS  12   6.275  -5.339  -0.937
  102    HB3  CYS  12          1HB       CYS  12   4.991  -4.391  -1.677
  103    H    TYR  13           HN       TYR  13   3.902  -2.202   0.542
  104    HA   TYR  13           HA       TYR  13   3.117  -4.255   2.427
  105    HB2  TYR  13          2HB       TYR  13   2.405  -2.462   4.020
  106    HB3  TYR  13          1HB       TYR  13   4.143  -2.557   3.819
  107    HD1  TYR  13          1HD       TYR  13   5.340  -0.746   2.567
  108    HD2  TYR  13          2HD       TYR  13   1.179  -0.493   3.427
  109    HE1  TYR  13          1HE       TYR  13   5.404   1.665   2.133
  110    HE2  TYR  13          2HE       TYR  13   1.232   1.911   2.989
  111    HH   TYR  13           HH       TYR  13   3.718   3.501   1.439
  112    H    ARG  14           HN       ARG  14   0.838  -4.281   2.757
  113    HA   ARG  14           HA       ARG  14  -0.520  -3.253   0.393
  114    HB2  ARG  14          2HB       ARG  14  -0.680  -5.689   1.084
  115    HB3  ARG  14          1HB       ARG  14  -1.607  -5.149   2.477
  116    HG2  ARG  14          2HG       ARG  14  -3.271  -4.177   0.948
  117    HG3  ARG  14          1HG       ARG  14  -2.356  -4.815  -0.420
  118    HD2  ARG  14          2HD       ARG  14  -2.589  -7.091   0.624
  119    HD3  ARG  14          1HD       ARG  14  -3.695  -6.354   1.780
  120    HE   ARG  14           HE       ARG  14  -4.230  -6.163  -1.085
  121   HH11  ARG  14          1HH1      ARG  14  -5.155  -7.412   2.107
  122   HH12  ARG  14          2HH1      ARG  14  -6.709  -7.890   1.637
  123   HH21  ARG  14          1HH2      ARG  14  -6.388  -6.893  -1.750
  124   HH22  ARG  14          2HH2      ARG  14  -7.421  -7.584  -0.587
  125    H    LYS  15           HN       LYS  15  -1.079  -1.242   0.764
  126    HA   LYS  15           HA       LYS  15  -2.050  -0.443   3.392
  127    HB2  LYS  15          2HB       LYS  15  -0.440   0.928   1.922
  128    HB3  LYS  15          1HB       LYS  15  -1.847   1.303   0.943
  129    HG2  LYS  15          2HG       LYS  15  -2.931   2.315   2.897
  130    HG3  LYS  15          1HG       LYS  15  -1.498   1.942   3.859
  131    HD2  LYS  15          2HD       LYS  15  -0.168   3.315   2.218
  132    HD3  LYS  15          1HD       LYS  15  -1.702   3.821   1.516
  133    HE2  LYS  15          2HE       LYS  15  -0.818   4.263   4.372
  134    HE3  LYS  15          1HE       LYS  15  -0.875   5.479   3.103
  135    HZ1  LYS  15          1HZ       LYS  15  -2.770   5.672   4.520
  136    HZ2  LYS  15          2HZ       LYS  15  -3.211   4.077   4.314
  137    HZ3  LYS  15          3HZ       LYS  15  -3.313   5.149   3.020
  138    H    CYS  16           HN       CYS  16  -4.186   0.063   3.795
  139    HA   CYS  16           HA       CYS  16  -6.013  -0.444   1.572
  140    HB2  CYS  16          2HB       CYS  16  -6.357  -1.089   4.498
  141    HB3  CYS  16          1HB       CYS  16  -7.635  -1.215   3.297
  142    H    ARG  17           HN       ARG  17  -6.989   1.279   0.910
  143    HA   ARG  17           HA       ARG  17  -7.567   3.433   2.794
  144    HB2  ARG  17          2HB       ARG  17  -6.603   4.067   0.596
  145    HB3  ARG  17          1HB       ARG  17  -7.953   3.283  -0.212
  146    HG2  ARG  17          2HG       ARG  17  -9.491   4.892   0.855
  147    HG3  ARG  17          1HG       ARG  17  -8.098   5.705   1.576
  148    HD2  ARG  17          2HD       ARG  17  -7.203   6.136  -0.647
  149    HD3  ARG  17          1HD       ARG  17  -8.583   5.306  -1.360
  150    HE   ARG  17           HE       ARG  17  -9.419   7.425   0.317
  151   HH11  ARG  17          1HH1      ARG  17  -8.048   6.747  -2.877
  152   HH12  ARG  17          2HH1      ARG  17  -8.670   8.151  -3.600
  153   HH21  ARG  17          1HH2      ARG  17 -10.293   9.399  -0.714
  154   HH22  ARG  17          2HH2      ARG  17  -9.955   9.668  -2.352
  155    H    GLY  18           HN       GLY  18  -9.216   2.662   3.968
  156    HA2  GLY  18          2HA       GLY  18 -11.337   1.979   4.459
  157    HA3  GLY  18          1HA       GLY  18 -11.778   2.298   2.776
  Start of MODEL   18
    1    H1   LYS   1           HN       LYS   1 -11.865   1.645   0.975
    2    HA   LYS   1           HA       LYS   1 -12.714  -1.158   1.322
    3    HB2  LYS   1          2HB       LYS   1 -13.343   0.730  -0.935
    4    HB3  LYS   1          1HB       LYS   1 -13.935  -0.909  -0.747
    5    HG2  LYS   1          2HG       LYS   1 -15.182  -0.247   1.224
    6    HG3  LYS   1          1HG       LYS   1 -14.556   1.396   1.072
    7    HD2  LYS   1          2HD       LYS   1 -15.551   1.542  -1.173
    8    HD3  LYS   1          1HD       LYS   1 -16.266  -0.054  -0.943
    9    HE2  LYS   1          2HE       LYS   1 -17.518   0.778   0.964
   10    HE3  LYS   1          1HE       LYS   1 -16.783   2.365   0.776
   11    HZ1  LYS   1          1HZ       LYS   1 -18.970   2.321  -0.190
   12    HZ2  LYS   1          2HZ       LYS   1 -18.573   1.039  -1.197
   13    HZ3  LYS   1          3HZ       LYS   1 -17.823   2.535  -1.406
   14    H    TRP   2           HN       TRP   2 -10.297   0.885   0.046
   15    HA   TRP   2           HA       TRP   2  -9.685  -1.021  -2.082
   16    HB2  TRP   2          2HB       TRP   2 -10.005   1.437  -2.573
   17    HB3  TRP   2          1HB       TRP   2  -8.503   1.719  -1.700
   18    HD1  TRP   2          1HD       TRP   2  -6.342   0.178  -2.800
   19    HE1  TRP   2          1HE       TRP   2  -5.756  -0.057  -5.322
   20    HE3  TRP   2          3HE       TRP   2 -10.843   1.454  -4.824
   21    HZ2  TRP   2          2HZ       TRP   2  -7.029   0.244  -7.789
   22    HZ3  TRP   2          3HZ       TRP   2 -11.082   1.449  -7.277
   23    HH2  TRP   2          2HH       TRP   2  -9.216   0.859  -8.722
   24    H    CYS   3           HN       CYS   3  -8.153  -2.416  -1.683
   25    HA   CYS   3           HA       CYS   3  -5.926  -1.685   0.085
   26    HB2  CYS   3          2HB       CYS   3  -7.110  -4.342  -0.615
   27    HB3  CYS   3          1HB       CYS   3  -5.608  -4.170   0.293
   28    H    PHE   4           HN       PHE   4  -3.986  -1.626  -0.861
   29    HA   PHE   4           HA       PHE   4  -3.617  -3.010  -3.370
   30    HB2  PHE   4          2HB       PHE   4  -2.808  -1.018  -4.536
   31    HB3  PHE   4          1HB       PHE   4  -4.475  -0.807  -4.037
   32    HD1  PHE   4          1HD       PHE   4  -4.694   0.410  -1.623
   33    HD2  PHE   4          2HD       PHE   4  -1.400   0.734  -4.286
   34    HE1  PHE   4          1HE       PHE   4  -4.102   2.560  -0.613
   35    HE2  PHE   4          2HE       PHE   4  -0.798   2.875  -3.281
   36    HZ   PHE   4           HZ       PHE   4  -2.145   3.803  -1.432
   37    H    ARG   5           HN       ARG   5  -1.275  -2.669  -4.079
   38    HA   ARG   5           HA       ARG   5   0.319  -3.180  -1.712
   39    HB2  ARG   5          2HB       ARG   5   0.260  -4.693  -3.782
   40    HB3  ARG   5          1HB       ARG   5   1.160  -3.421  -4.584
   41    HG2  ARG   5          2HG       ARG   5   2.958  -3.624  -2.967
   42    HG3  ARG   5          1HG       ARG   5   2.064  -4.885  -2.118
   43    HD2  ARG   5          2HD       ARG   5   2.070  -6.175  -4.285
   44    HD3  ARG   5          1HD       ARG   5   3.218  -4.980  -4.893
   45    HE   ARG   5           HE       ARG   5   3.809  -6.331  -2.402
   46   HH11  ARG   5          1HH1      ARG   5   4.553  -5.972  -5.828
   47   HH12  ARG   5          2HH1      ARG   5   6.030  -6.816  -5.755
   48   HH21  ARG   5          1HH2      ARG   5   5.815  -7.540  -2.287
   49   HH22  ARG   5          2HH2      ARG   5   6.765  -7.704  -3.700
   50    H    VAL   6           HN       VAL   6   1.749  -1.758  -1.010
   51    HA   VAL   6           HA       VAL   6   2.414   0.508  -2.754
   52    HB   VAL   6           HB       VAL   6   2.473   0.466   0.275
   53   HG11  VAL   6          1HG1      VAL   6   4.052   2.029  -0.711
   54   HG12  VAL   6          2HG1      VAL   6   2.736   2.894   0.083
   55   HG13  VAL   6          3HG1      VAL   6   2.761   2.746  -1.674
   56   HG21  VAL   6          1HG2      VAL   6   0.172   0.325  -0.489
   57   HG22  VAL   6          2HG2      VAL   6   0.425   1.713  -1.547
   58   HG23  VAL   6          3HG2      VAL   6   0.499   1.913   0.204
   59    H    CYS   7           HN       CYS   7   4.381   0.247  -3.496
   60    HA   CYS   7           HA       CYS   7   6.377  -0.948  -1.731
   61    HB2  CYS   7          2HB       CYS   7   6.281  -0.710  -4.743
   62    HB3  CYS   7          1HB       CYS   7   7.710  -1.214  -3.848
   63    H    TYR   8           HN       TYR   8   7.673   0.345  -0.823
   64    HA   TYR   8           HA       TYR   8   8.494   2.821  -2.134
   65    HB2  TYR   8          2HB       TYR   8   6.604   3.456  -0.775
   66    HB3  TYR   8          1HB       TYR   8   7.247   2.567   0.597
   67    HD1  TYR   8          1HD       TYR   8   8.159   3.843   2.265
   68    HD2  TYR   8          2HD       TYR   8   8.382   5.288  -1.724
   69    HE1  TYR   8          1HE       TYR   8   9.278   5.860   3.065
   70    HE2  TYR   8          2HE       TYR   8   9.490   7.307  -0.939
   71    HH   TYR   8           HH       TYR   8   9.761   8.608   1.055
   72    H    ARG   9           HN       ARG   9  10.606   2.625  -2.229
   73    HA   ARG   9           HA       ARG   9  12.799   2.442  -1.681
   74    HB2  ARG   9          2HB       ARG   9  11.803   2.468   1.177
   75    HB3  ARG   9          1HB       ARG   9  13.492   2.605   0.704
   76    HG2  ARG   9          2HG       ARG   9  12.929   4.693  -0.488
   77    HG3  ARG   9          1HG       ARG   9  11.270   4.543   0.103
   78    HD2  ARG   9          2HD       ARG   9  13.752   4.783   1.789
   79    HD3  ARG   9          1HD       ARG   9  12.556   6.048   1.513
   80    HE   ARG   9           HE       ARG   9  10.994   4.268   2.556
   81   HH11  ARG   9          1HH1      ARG   9  14.315   4.988   3.549
   82   HH12  ARG   9          2HH1      ARG   9  14.070   4.627   5.191
   83   HH21  ARG   9          1HH2      ARG   9  10.641   3.778   4.852
   84   HH22  ARG   9          2HH2      ARG   9  11.929   3.920   5.943
   85    H    GLY  10           HN       GLY  10  11.000   0.106  -1.930
   86    HA2  GLY  10          2HA       GLY  10  11.730  -2.115  -2.246
   87    HA3  GLY  10          1HA       GLY  10  12.876  -1.896  -0.928
   88    H    ILE  11           HN       ILE  11  10.352  -0.472   0.299
   89    HA   ILE  11           HA       ILE  11   9.549  -2.797   1.842
   90    HB   ILE  11           HB       ILE  11   8.655   0.083   2.156
   91   HG12  ILE  11          2HG1      ILE  11  10.914  -1.248   3.645
   92   HG13  ILE  11          1HG1      ILE  11  11.165  -0.227   2.231
   93   HG21  ILE  11          1HG2      ILE  11   8.754  -2.217   4.119
   94   HG22  ILE  11          2HG2      ILE  11   7.305  -1.620   3.320
   95   HG23  ILE  11          3HG2      ILE  11   8.167  -0.589   4.463
   96   HD11  ILE  11          1HD1      ILE  11  11.521   1.024   4.292
   97   HD12  ILE  11          2HD1      ILE  11   9.896   0.606   4.834
   98   HD13  ILE  11          3HD1      ILE  11  10.116   1.641   3.424
   99    H    CYS  12           HN       CYS  12   8.048  -3.915   0.749
  100    HA   CYS  12           HA       CYS  12   5.834  -2.428  -0.454
  101    HB2  CYS  12          2HB       CYS  12   6.624  -5.325  -0.837
  102    HB3  CYS  12          1HB       CYS  12   5.255  -4.520  -1.598
  103    H    TYR  13           HN       TYR  13   3.957  -2.358   0.561
  104    HA   TYR  13           HA       TYR  13   3.306  -4.503   2.381
  105    HB2  TYR  13          2HB       TYR  13   2.530  -2.832   4.085
  106    HB3  TYR  13          1HB       TYR  13   4.271  -2.902   3.876
  107    HD1  TYR  13          1HD       TYR  13   1.299  -0.818   3.652
  108    HD2  TYR  13          2HD       TYR  13   5.435  -1.046   2.694
  109    HE1  TYR  13          1HE       TYR  13   1.361   1.615   3.336
  110    HE2  TYR  13          2HE       TYR  13   5.513   1.369   2.378
  111    HH   TYR  13           HH       TYR  13   4.027   3.214   1.895
  112    H    ARG  14           HN       ARG  14   1.088  -4.560   2.920
  113    HA   ARG  14           HA       ARG  14  -0.526  -3.776   0.647
  114    HB2  ARG  14          2HB       ARG  14  -0.514  -6.114   1.641
  115    HB3  ARG  14          1HB       ARG  14  -1.296  -5.428   3.053
  116    HG2  ARG  14          2HG       ARG  14  -2.942  -6.466   1.663
  117    HG3  ARG  14          1HG       ARG  14  -3.175  -4.714   1.602
  118    HD2  ARG  14          2HD       ARG  14  -2.043  -4.616  -0.537
  119    HD3  ARG  14          1HD       ARG  14  -1.676  -6.339  -0.438
  120    HE   ARG  14           HE       ARG  14  -4.424  -6.040  -0.239
  121   HH11  ARG  14          1HH1      ARG  14  -1.856  -5.730  -2.627
  122   HH12  ARG  14          2HH1      ARG  14  -2.869  -5.903  -3.977
  123   HH21  ARG  14          1HH2      ARG  14  -5.837  -6.324  -2.064
  124   HH22  ARG  14          2HH2      ARG  14  -5.233  -6.245  -3.649
  125    H    LYS  15           HN       LYS  15  -1.058  -1.681   0.902
  126    HA   LYS  15           HA       LYS  15  -2.001  -0.765   3.506
  127    HB2  LYS  15          2HB       LYS  15  -0.443   0.683   2.266
  128    HB3  LYS  15          1HB       LYS  15  -1.598   0.782   0.947
  129    HG2  LYS  15          2HG       LYS  15  -3.182   1.937   2.402
  130    HG3  LYS  15          1HG       LYS  15  -2.041   1.813   3.742
  131    HD2  LYS  15          2HD       LYS  15  -0.422   3.137   2.488
  132    HD3  LYS  15          1HD       LYS  15  -1.556   3.269   1.145
  133    HE2  LYS  15          2HE       LYS  15  -1.595   5.302   2.483
  134    HE3  LYS  15          1HE       LYS  15  -3.133   4.458   2.612
  135    HZ1  LYS  15          1HZ       LYS  15  -0.951   4.374   4.634
  136    HZ2  LYS  15          2HZ       LYS  15  -2.456   3.622   4.782
  137    HZ3  LYS  15          3HZ       LYS  15  -2.356   5.280   4.754
  138    H    CYS  16           HN       CYS  16  -4.048  -0.468   3.977
  139    HA   CYS  16           HA       CYS  16  -6.016  -0.704   1.825
  140    HB2  CYS  16          2HB       CYS  16  -6.199  -1.605   4.700
  141    HB3  CYS  16          1HB       CYS  16  -7.576  -1.528   3.604
  142    H    ARG  17           HN       ARG  17  -7.422   0.863   1.586
  143    HA   ARG  17           HA       ARG  17  -7.625   2.922   3.670
  144    HB2  ARG  17          2HB       ARG  17  -7.687   3.346   0.707
  145    HB3  ARG  17          1HB       ARG  17  -7.748   4.597   1.934
  146    HG2  ARG  17          2HG       ARG  17  -5.416   4.066   2.548
  147    HG3  ARG  17          1HG       ARG  17  -5.389   2.830   1.291
  148    HD2  ARG  17          2HD       ARG  17  -5.752   5.800   0.902
  149    HD3  ARG  17          1HD       ARG  17  -4.350   4.830   0.445
  150    HE   ARG  17           HE       ARG  17  -6.870   4.027  -0.732
  151   HH11  ARG  17          1HH1      ARG  17  -3.950   5.966  -1.227
  152   HH12  ARG  17          2HH1      ARG  17  -4.149   6.030  -2.922
  153   HH21  ARG  17          1HH2      ARG  17  -7.114   4.133  -3.033
  154   HH22  ARG  17          2HH2      ARG  17  -5.959   4.987  -3.937
  155    H    GLY  18           HN       GLY  18  -9.584   1.996   4.356
  156    HA2  GLY  18          2HA       GLY  18 -11.877   2.022   4.423
  157    HA3  GLY  18          1HA       GLY  18 -11.871   2.848   2.871
  Start of MODEL   19
    1    H1   LYS   1           HN       LYS   1 -12.043   1.341   1.016
    2    HA   LYS   1           HA       LYS   1 -12.210  -1.339   2.216
    3    HB2  LYS   1          2HB       LYS   1 -13.659  -0.233  -0.187
    4    HB3  LYS   1          1HB       LYS   1 -13.794  -1.872   0.426
    5    HG2  LYS   1          2HG       LYS   1 -14.701  -0.964   2.529
    6    HG3  LYS   1          1HG       LYS   1 -14.639   0.648   1.828
    7    HD2  LYS   1          2HD       LYS   1 -16.891  -0.226   1.611
    8    HD3  LYS   1          1HD       LYS   1 -16.149  -0.095   0.021
    9    HE2  LYS   1          2HE       LYS   1 -17.399  -2.194   0.262
   10    HE3  LYS   1          1HE       LYS   1 -15.689  -2.499   0.014
   11    HZ1  LYS   1          1HZ       LYS   1 -15.442  -2.928   2.368
   12    HZ2  LYS   1          2HZ       LYS   1 -16.661  -3.897   1.752
   13    HZ3  LYS   1          3HZ       LYS   1 -17.055  -2.534   2.658
   14    H    TRP   2           HN       TRP   2 -10.414   0.581   0.126
   15    HA   TRP   2           HA       TRP   2  -9.909  -1.553  -1.775
   16    HB2  TRP   2          2HB       TRP   2 -10.286   0.841  -2.482
   17    HB3  TRP   2          1HB       TRP   2  -8.739   1.226  -1.738
   18    HD1  TRP   2          1HD       TRP   2  -6.587  -0.221  -2.862
   19    HE1  TRP   2          1HE       TRP   2  -6.197  -0.743  -5.387
   20    HE3  TRP   2          3HE       TRP   2 -11.334   0.378  -4.540
   21    HZ2  TRP   2          2HZ       TRP   2  -7.736  -0.892  -7.723
   22    HZ3  TRP   2          3HZ       TRP   2 -11.805   0.014  -6.914
   23    HH2  TRP   2          2HH       TRP   2 -10.027  -0.611  -8.465
   24    H    CYS   3           HN       CYS   3  -8.206  -2.812  -1.568
   25    HA   CYS   3           HA       CYS   3  -6.002  -1.905   0.135
   26    HB2  CYS   3          2HB       CYS   3  -7.081  -4.633  -0.376
   27    HB3  CYS   3          1HB       CYS   3  -5.547  -4.367   0.457
   28    H    PHE   4           HN       PHE   4  -4.093  -1.722  -0.799
   29    HA   PHE   4           HA       PHE   4  -3.578  -3.113  -3.276
   30    HB2  PHE   4          2HB       PHE   4  -2.857  -1.020  -4.396
   31    HB3  PHE   4          1HB       PHE   4  -4.574  -1.029  -4.047
   32    HD1  PHE   4          1HD       PHE   4  -1.714   0.917  -4.043
   33    HD2  PHE   4          2HD       PHE   4  -5.145   0.150  -1.652
   34    HE1  PHE   4          1HE       PHE   4  -1.499   3.137  -3.007
   35    HE2  PHE   4          2HE       PHE   4  -4.937   2.354  -0.619
   36    HZ   PHE   4           HZ       PHE   4  -3.124   3.858  -1.289
   37    H    ARG   5           HN       ARG   5  -1.218  -2.721  -3.893
   38    HA   ARG   5           HA       ARG   5   0.245  -2.821  -1.374
   39    HB2  ARG   5          2HB       ARG   5   0.298  -4.833  -2.765
   40    HB3  ARG   5          1HB       ARG   5   0.967  -3.899  -4.088
   41    HG2  ARG   5          2HG       ARG   5   2.969  -3.453  -2.735
   42    HG3  ARG   5          1HG       ARG   5   2.290  -4.441  -1.437
   43    HD2  ARG   5          2HD       ARG   5   2.947  -5.359  -4.232
   44    HD3  ARG   5          1HD       ARG   5   3.846  -5.752  -2.772
   45    HE   ARG   5           HE       ARG   5   1.804  -6.871  -1.988
   46   HH11  ARG   5          1HH1      ARG   5   2.349  -6.473  -5.464
   47   HH12  ARG   5          2HH1      ARG   5   1.384  -7.789  -5.931
   48   HH21  ARG   5          1HH2      ARG   5   0.472  -8.721  -2.639
   49   HH22  ARG   5          2HH2      ARG   5   0.333  -9.110  -4.302
   50    H    VAL   6           HN       VAL   6   1.567  -1.282  -0.896
   51    HA   VAL   6           HA       VAL   6   2.365   0.639  -2.970
   52    HB   VAL   6           HB       VAL   6   2.436   0.996   0.042
   53   HG11  VAL   6          1HG1      VAL   6   3.969   2.445  -1.147
   54   HG12  VAL   6          2HG1      VAL   6   2.644   3.383  -0.458
   55   HG13  VAL   6          3HG1      VAL   6   2.659   3.014  -2.183
   56   HG21  VAL   6          1HG2      VAL   6   0.309   1.954  -1.876
   57   HG22  VAL   6          2HG2      VAL   6   0.420   2.389  -0.170
   58   HG23  VAL   6          3HG2      VAL   6   0.114   0.719  -0.633
   59    H    CYS   7           HN       CYS   7   4.527   0.793  -3.378
   60    HA   CYS   7           HA       CYS   7   6.286  -0.714  -1.590
   61    HB2  CYS   7          2HB       CYS   7   6.594  -0.195  -4.555
   62    HB3  CYS   7          1HB       CYS   7   7.826  -0.945  -3.546
   63    H    TYR   8           HN       TYR   8   7.557   0.403  -0.442
   64    HA   TYR   8           HA       TYR   8   8.409   3.078  -1.328
   65    HB2  TYR   8          2HB       TYR   8   6.557   3.204   0.319
   66    HB3  TYR   8          1HB       TYR   8   7.488   2.205   1.420
   67    HD1  TYR   8          1HD       TYR   8   7.292   5.538  -0.174
   68    HD2  TYR   8          2HD       TYR   8   9.142   3.166   2.832
   69    HE1  TYR   8          1HE       TYR   8   8.206   7.558   0.842
   70    HE2  TYR   8          2HE       TYR   8  10.063   5.159   3.859
   71    HH   TYR   8           HH       TYR   8   9.010   8.269   3.120
   72    H    ARG   9           HN       ARG   9  10.556   2.856  -1.650
   73    HA   ARG   9           HA       ARG   9  12.748   2.417  -1.357
   74    HB2  ARG   9          2HB       ARG   9  12.031   1.977   1.556
   75    HB3  ARG   9          1HB       ARG   9  13.650   2.247   0.932
   76    HG2  ARG   9          2HG       ARG   9  12.906   4.484   0.140
   77    HG3  ARG   9          1HG       ARG   9  11.352   4.185   0.905
   78    HD2  ARG   9          2HD       ARG   9  12.551   3.896   3.074
   79    HD3  ARG   9          1HD       ARG   9  14.033   4.413   2.265
   80    HE   ARG   9           HE       ARG   9  11.784   6.175   1.960
   81   HH11  ARG   9          1HH1      ARG   9  14.778   5.581   3.769
   82   HH12  ARG   9          2HH1      ARG   9  14.754   7.086   4.555
   83   HH21  ARG   9          1HH2      ARG   9  11.736   8.203   3.073
   84   HH22  ARG   9          2HH2      ARG   9  12.999   8.656   4.115
   85    H    GLY  10           HN       GLY  10  10.828   0.256  -1.917
   86    HA2  GLY  10          2HA       GLY  10  11.398  -1.940  -2.622
   87    HA3  GLY  10          1HA       GLY  10  12.653  -1.969  -1.382
   88    H    ILE  11           HN       ILE  11  10.371  -0.708   0.311
   89    HA   ILE  11           HA       ILE  11   9.556  -3.211   1.485
   90    HB   ILE  11           HB       ILE  11   8.858  -0.368   2.294
   91   HG12  ILE  11          2HG1      ILE  11  11.057  -2.086   3.455
   92   HG13  ILE  11          1HG1      ILE  11  11.339  -0.886   2.197
   93   HG21  ILE  11          1HG2      ILE  11   8.791  -2.962   3.848
   94   HG22  ILE  11          2HG2      ILE  11   7.389  -2.073   3.257
   95   HG23  ILE  11          3HG2      ILE  11   8.420  -1.367   4.503
   96   HD11  ILE  11          1HD1      ILE  11  10.237  -0.335   4.952
   97   HD12  ILE  11          2HD1      ILE  11  10.554   0.875   3.710
   98   HD13  ILE  11          3HD1      ILE  11  11.890  -0.025   4.424
   99    H    CYS  12           HN       CYS  12   7.906  -4.126   0.414
  100    HA   CYS  12           HA       CYS  12   5.774  -2.385  -0.549
  101    HB2  CYS  12          2HB       CYS  12   6.302  -5.286  -1.252
  102    HB3  CYS  12          1HB       CYS  12   5.029  -4.255  -1.898
  103    H    TYR  13           HN       TYR  13   3.920  -2.306   0.445
  104    HA   TYR  13           HA       TYR  13   3.234  -4.433   2.292
  105    HB2  TYR  13          2HB       TYR  13   2.561  -2.674   3.960
  106    HB3  TYR  13          1HB       TYR  13   4.294  -2.805   3.703
  107    HD1  TYR  13          1HD       TYR  13   1.384  -0.648   3.470
  108    HD2  TYR  13          2HD       TYR  13   5.485  -1.013   2.400
  109    HE1  TYR  13          1HE       TYR  13   1.487   1.757   3.046
  110    HE2  TYR  13          2HE       TYR  13   5.593   1.394   1.968
  111    HH   TYR  13           HH       TYR  13   3.169   3.510   2.994
  112    H    ARG  14           HN       ARG  14   1.050  -4.690   2.593
  113    HA   ARG  14           HA       ARG  14  -0.555  -3.653   0.438
  114    HB2  ARG  14          2HB       ARG  14  -0.579  -6.076   1.281
  115    HB3  ARG  14          1HB       ARG  14  -1.437  -5.464   2.686
  116    HG2  ARG  14          2HG       ARG  14  -3.224  -4.647   1.220
  117    HG3  ARG  14          1HG       ARG  14  -2.365  -5.307  -0.174
  118    HD2  ARG  14          2HD       ARG  14  -2.455  -7.547   0.963
  119    HD3  ARG  14          1HD       ARG  14  -3.532  -6.819   2.152
  120    HE   ARG  14           HE       ARG  14  -4.110  -6.952  -0.723
  121   HH11  ARG  14          1HH1      ARG  14  -5.228  -7.217   2.644
  122   HH12  ARG  14          2HH1      ARG  14  -6.818  -7.643   2.236
  123   HH21  ARG  14          1HH2      ARG  14  -6.326  -7.528  -1.266
  124   HH22  ARG  14          2HH2      ARG  14  -7.454  -7.853  -0.036
  125    H    LYS  15           HN       LYS  15  -1.081  -1.641   0.798
  126    HA   LYS  15           HA       LYS  15  -1.919  -0.796   3.449
  127    HB2  LYS  15          2HB       LYS  15  -0.266   0.564   2.121
  128    HB3  LYS  15          1HB       LYS  15  -1.545   0.876   0.960
  129    HG2  LYS  15          2HG       LYS  15  -2.856   1.985   2.723
  130    HG3  LYS  15          1HG       LYS  15  -1.534   1.701   3.854
  131    HD2  LYS  15          2HD       LYS  15  -0.045   3.011   2.373
  132    HD3  LYS  15          1HD       LYS  15  -1.439   3.364   1.353
  133    HE2  LYS  15          2HE       LYS  15  -1.050   5.226   2.855
  134    HE3  LYS  15          1HE       LYS  15  -2.555   4.416   3.279
  135    HZ1  LYS  15          1HZ       LYS  15  -1.407   3.301   5.098
  136    HZ2  LYS  15          2HZ       LYS  15  -1.230   4.967   5.235
  137    HZ3  LYS  15          3HZ       LYS  15   0.045   4.043   4.666
  138    H    CYS  16           HN       CYS  16  -3.987  -0.219   3.845
  139    HA   CYS  16           HA       CYS  16  -5.846  -0.556   1.613
  140    HB2  CYS  16          2HB       CYS  16  -6.335  -1.189   4.526
  141    HB3  CYS  16          1HB       CYS  16  -7.550  -1.283   3.258
  142    H    ARG  17           HN       ARG  17  -7.208   0.949   1.173
  143    HA   ARG  17           HA       ARG  17  -7.427   3.248   2.967
  144    HB2  ARG  17          2HB       ARG  17  -6.098   3.836   0.985
  145    HB3  ARG  17          1HB       ARG  17  -7.351   3.200  -0.066
  146    HG2  ARG  17          2HG       ARG  17  -7.426   5.616  -0.034
  147    HG3  ARG  17          1HG       ARG  17  -8.878   4.950   0.714
  148    HD2  ARG  17          2HD       ARG  17  -7.868   5.336   2.938
  149    HD3  ARG  17          1HD       ARG  17  -6.471   6.062   2.139
  150    HE   ARG  17           HE       ARG  17  -8.811   7.328   1.271
  151   HH11  ARG  17          1HH1      ARG  17  -6.693   7.187   4.128
  152   HH12  ARG  17          2HH1      ARG  17  -7.221   8.694   4.739
  153   HH21  ARG  17          1HH2      ARG  17  -9.510   9.392   2.166
  154   HH22  ARG  17          2HH2      ARG  17  -8.827   9.952   3.628
  155    H    GLY  18           HN       GLY  18  -9.330   2.813   3.887
  156    HA2  GLY  18          2HA       GLY  18 -11.600   2.726   4.079
  157    HA3  GLY  18          1HA       GLY  18 -11.711   3.001   2.342
  Start of MODEL   20
    1    H1   LYS   1           HN       LYS   1 -11.003   2.416   0.671
    2    HA   LYS   1           HA       LYS   1 -12.396  -0.034   1.515
    3    HB2  LYS   1          2HB       LYS   1 -12.823   1.608  -0.976
    4    HB3  LYS   1          1HB       LYS   1 -13.705   0.166  -0.499
    5    HG2  LYS   1          2HG       LYS   1 -14.609   1.334   1.428
    6    HG3  LYS   1          1HG       LYS   1 -13.702   2.778   0.985
    7    HD2  LYS   1          2HD       LYS   1 -14.897   2.936  -1.117
    8    HD3  LYS   1          1HD       LYS   1 -15.772   1.452  -0.759
    9    HE2  LYS   1          2HE       LYS   1 -15.929   4.024   0.818
   10    HE3  LYS   1          1HE       LYS   1 -17.128   3.451  -0.338
   11    HZ1  LYS   1          1HZ       LYS   1 -17.837   2.938   1.874
   12    HZ2  LYS   1          2HZ       LYS   1 -16.403   2.165   2.243
   13    HZ3  LYS   1          3HZ       LYS   1 -17.446   1.490   1.109
   14    H    TRP   2           HN       TRP   2  -9.590   1.093  -0.022
   15    HA   TRP   2           HA       TRP   2  -9.575  -1.222  -1.805
   16    HB2  TRP   2          2HB       TRP   2  -9.460   1.224  -2.698
   17    HB3  TRP   2          1HB       TRP   2  -7.802   1.167  -2.123
   18    HD1  TRP   2          1HD       TRP   2  -6.501  -1.243  -3.119
   19    HE1  TRP   2          1HE       TRP   2  -6.443  -2.010  -5.595
   20    HE3  TRP   2          3HE       TRP   2 -10.513   1.367  -4.807
   21    HZ2  TRP   2          2HZ       TRP   2  -7.927  -1.496  -7.955
   22    HZ3  TRP   2          3HZ       TRP   2 -11.136   1.195  -7.173
   23    HH2  TRP   2          2HH       TRP   2  -9.868  -0.206  -8.711
   24    H    CYS   3           HN       CYS   3  -8.042  -2.667  -1.494
   25    HA   CYS   3           HA       CYS   3  -5.770  -2.042   0.252
   26    HB2  CYS   3          2HB       CYS   3  -7.183  -4.677  -0.210
   27    HB3  CYS   3          1HB       CYS   3  -5.723  -4.472   0.751
   28    H    PHE   4           HN       PHE   4  -3.942  -1.985  -0.843
   29    HA   PHE   4           HA       PHE   4  -3.584  -3.797  -3.059
   30    HB2  PHE   4          2HB       PHE   4  -2.848  -2.009  -4.597
   31    HB3  PHE   4          1HB       PHE   4  -4.539  -1.847  -4.168
   32    HD1  PHE   4          1HD       PHE   4  -5.038  -0.115  -2.216
   33    HD2  PHE   4          2HD       PHE   4  -1.467  -0.172  -4.531
   34    HE1  PHE   4          1HE       PHE   4  -4.656   2.246  -1.673
   35    HE2  PHE   4          2HE       PHE   4  -1.076   2.191  -3.977
   36    HZ   PHE   4           HZ       PHE   4  -2.670   3.403  -2.549
   37    H    ARG   5           HN       ARG   5  -1.342  -3.753  -3.818
   38    HA   ARG   5           HA       ARG   5   0.376  -3.619  -1.538
   39    HB2  ARG   5          2HB       ARG   5   0.621  -5.494  -3.057
   40    HB3  ARG   5          1HB       ARG   5   0.934  -4.404  -4.395
   41    HG2  ARG   5          2HG       ARG   5   3.023  -3.728  -3.458
   42    HG3  ARG   5          1HG       ARG   5   2.690  -4.602  -1.961
   43    HD2  ARG   5          2HD       ARG   5   2.931  -5.872  -4.666
   44    HD3  ARG   5          1HD       ARG   5   4.253  -5.781  -3.497
   45    HE   ARG   5           HE       ARG   5   1.864  -6.942  -2.427
   46   HH11  ARG   5          1HH1      ARG   5   4.710  -7.732  -4.379
   47   HH12  ARG   5          2HH1      ARG   5   4.783  -9.350  -3.847
   48   HH21  ARG   5          1HH2      ARG   5   1.991  -9.152  -1.693
   49   HH22  ARG   5          2HH2      ARG   5   3.221 -10.162  -2.267
   50    H    VAL   6           HN       VAL   6   1.472  -2.013  -0.986
   51    HA   VAL   6           HA       VAL   6   1.973   0.167  -2.876
   52    HB   VAL   6           HB       VAL   6   1.864   0.225   0.162
   53   HG11  VAL   6          1HG1      VAL   6   2.246   2.487  -1.799
   54   HG12  VAL   6          2HG1      VAL   6   3.463   1.850  -0.698
   55   HG13  VAL   6          3HG1      VAL   6   2.037   2.669  -0.057
   56   HG21  VAL   6          1HG2      VAL   6  -0.152   1.591  -0.123
   57   HG22  VAL   6          2HG2      VAL   6  -0.349  -0.023  -0.815
   58   HG23  VAL   6          3HG2      VAL   6  -0.053   1.357  -1.867
   59    H    CYS   7           HN       CYS   7   4.063   0.498  -3.342
   60    HA   CYS   7           HA       CYS   7   6.003  -0.776  -1.582
   61    HB2  CYS   7          2HB       CYS   7   6.217  -0.103  -4.527
   62    HB3  CYS   7          1HB       CYS   7   7.563  -0.661  -3.540
   63    H    TYR   8           HN       TYR   8   7.035   0.485  -0.374
   64    HA   TYR   8           HA       TYR   8   7.393   3.295  -1.140
   65    HB2  TYR   8          2HB       TYR   8   5.609   2.970   0.563
   66    HB3  TYR   8          1HB       TYR   8   6.770   2.156   1.594
   67    HD1  TYR   8          1HD       TYR   8   8.329   3.425   2.921
   68    HD2  TYR   8          2HD       TYR   8   5.772   5.388   0.155
   69    HE1  TYR   8          1HE       TYR   8   8.895   5.575   3.937
   70    HE2  TYR   8          2HE       TYR   8   6.334   7.550   1.157
   71    HH   TYR   8           HH       TYR   8   7.164   8.382   3.375
   72    H    ARG   9           HN       ARG   9   9.510   3.250  -1.694
   73    HA   ARG   9           HA       ARG   9  11.759   3.262  -1.491
   74    HB2  ARG   9          2HB       ARG   9  11.295   2.913   1.482
   75    HB3  ARG   9          1HB       ARG   9  12.767   3.489   0.724
   76    HG2  ARG   9          2HG       ARG   9  11.481   5.480  -0.085
   77    HG3  ARG   9          1HG       ARG   9  10.106   4.892   0.842
   78    HD2  ARG   9          2HD       ARG   9  11.556   4.885   2.861
   79    HD3  ARG   9          1HD       ARG   9  12.798   5.701   1.915
   80    HE   ARG   9           HE       ARG   9  10.277   7.027   1.837
   81   HH11  ARG   9          1HH1      ARG   9  13.325   6.780   3.639
   82   HH12  ARG   9          2HH1      ARG   9  13.045   8.155   4.589
   83   HH21  ARG   9          1HH2      ARG   9   9.854   8.880   3.229
   84   HH22  ARG   9          2HH2      ARG   9  11.014   9.379   4.354
   85    H    GLY  10           HN       GLY  10  10.326   0.774  -1.854
   86    HA2  GLY  10          2HA       GLY  10  11.360  -1.324  -2.389
   87    HA3  GLY  10          1HA       GLY  10  12.476  -1.059  -1.052
   88    H    ILE  11           HN       ILE  11   9.957  -0.141   0.462
   89    HA   ILE  11           HA       ILE  11   9.443  -2.740   1.615
   90    HB   ILE  11           HB       ILE  11   8.292  -0.033   2.376
   91   HG12  ILE  11          2HG1      ILE  11  10.644  -1.452   3.634
   92   HG13  ILE  11          1HG1      ILE  11  10.809  -0.176   2.434
   93   HG21  ILE  11          1HG2      ILE  11   8.493  -2.631   3.922
   94   HG22  ILE  11          2HG2      ILE  11   7.018  -1.936   3.254
   95   HG23  ILE  11          3HG2      ILE  11   7.869  -1.110   4.558
   96   HD11  ILE  11          1HD1      ILE  11  11.120   0.661   4.701
   97   HD12  ILE  11          2HD1      ILE  11   9.511   0.084   5.141
   98   HD13  ILE  11          3HD1      ILE  11   9.692   1.378   3.956
   99    H    CYS  12           HN       CYS  12   8.064  -3.897   0.403
  100    HA   CYS  12           HA       CYS  12   5.690  -2.530  -0.615
  101    HB2  CYS  12          2HB       CYS  12   6.769  -5.254  -1.376
  102    HB3  CYS  12          1HB       CYS  12   5.339  -4.457  -2.045
  103    H    TYR  13           HN       TYR  13   3.865  -2.750   0.376
  104    HA   TYR  13           HA       TYR  13   3.348  -5.142   1.926
  105    HB2  TYR  13          2HB       TYR  13   2.613  -3.752   3.862
  106    HB3  TYR  13          1HB       TYR  13   4.342  -3.698   3.571
  107    HD1  TYR  13          1HD       TYR  13   1.445  -1.767   4.219
  108    HD2  TYR  13          2HD       TYR  13   5.174  -1.589   2.172
  109    HE1  TYR  13          1HE       TYR  13   1.379   0.682   4.291
  110    HE2  TYR  13          2HE       TYR  13   5.101   0.849   2.234
  111    HH   TYR  13           HH       TYR  13   3.040   2.539   4.239
  112    H    ARG  14           HN       ARG  14   1.110  -5.406   2.414
  113    HA   ARG  14           HA       ARG  14  -0.571  -4.237   0.379
  114    HB2  ARG  14          2HB       ARG  14  -0.736  -6.649   0.898
  115    HB3  ARG  14          1HB       ARG  14  -1.207  -6.257   2.543
  116    HG2  ARG  14          2HG       ARG  14  -3.234  -5.166   1.697
  117    HG3  ARG  14          1HG       ARG  14  -2.767  -5.599   0.051
  118    HD2  ARG  14          2HD       ARG  14  -4.381  -7.180   0.900
  119    HD3  ARG  14          1HD       ARG  14  -2.825  -7.975   0.681
  120    HE   ARG  14           HE       ARG  14  -3.756  -7.002   3.295
  121   HH11  ARG  14          1HH1      ARG  14  -2.290  -9.556   1.333
  122   HH12  ARG  14          2HH1      ARG  14  -2.259 -10.705   2.577
  123   HH21  ARG  14          1HH2      ARG  14  -3.691  -8.590   5.036
  124   HH22  ARG  14          2HH2      ARG  14  -3.057 -10.126   4.742
  125    H    LYS  15           HN       LYS  15  -1.127  -2.251   0.825
  126    HA   LYS  15           HA       LYS  15  -1.887  -1.592   3.559
  127    HB2  LYS  15          2HB       LYS  15  -0.068  -0.263   2.608
  128    HB3  LYS  15          1HB       LYS  15  -1.079   0.174   1.247
  129    HG2  LYS  15          2HG       LYS  15  -0.880   2.005   2.839
  130    HG3  LYS  15          1HG       LYS  15  -2.546   1.433   2.734
  131    HD2  LYS  15          2HD       LYS  15  -2.268   0.177   4.781
  132    HD3  LYS  15          1HD       LYS  15  -0.578   0.656   4.894
  133    HE2  LYS  15          2HE       LYS  15  -2.010   1.995   6.376
  134    HE3  LYS  15          1HE       LYS  15  -1.234   2.980   5.138
  135    HZ1  LYS  15          1HZ       LYS  15  -3.584   3.541   5.470
  136    HZ2  LYS  15          2HZ       LYS  15  -4.050   2.000   4.983
  137    HZ3  LYS  15          3HZ       LYS  15  -3.265   3.031   3.904
  138    H    CYS  16           HN       CYS  16  -3.898  -0.942   4.002
  139    HA   CYS  16           HA       CYS  16  -5.809  -0.852   1.799
  140    HB2  CYS  16          2HB       CYS  16  -6.205  -1.422   4.741
  141    HB3  CYS  16          1HB       CYS  16  -7.499  -1.310   3.557
  142    H    ARG  17           HN       ARG  17  -6.726   0.972   1.401
  143    HA   ARG  17           HA       ARG  17  -6.660   3.053   3.440
  144    HB2  ARG  17          2HB       ARG  17  -4.940   3.459   1.679
  145    HB3  ARG  17          1HB       ARG  17  -6.211   3.433   0.473
  146    HG2  ARG  17          2HG       ARG  17  -7.242   5.389   1.439
  147    HG3  ARG  17          1HG       ARG  17  -6.054   5.397   2.742
  148    HD2  ARG  17          2HD       ARG  17  -4.269   5.823   1.142
  149    HD3  ARG  17          1HD       ARG  17  -5.428   5.729  -0.186
  150    HE   ARG  17           HE       ARG  17  -6.449   7.599   1.457
  151   HH11  ARG  17          1HH1      ARG  17  -3.308   7.333  -0.189
  152   HH12  ARG  17          2HH1      ARG  17  -3.111   9.019  -0.349
  153   HH21  ARG  17          1HH2      ARG  17  -6.183   9.855   1.187
  154   HH22  ARG  17          2HH2      ARG  17  -4.766  10.484   0.439
  155    H    GLY  18           HN       GLY  18  -8.696   2.967   4.035
  156    HA2  GLY  18          2HA       GLY  18 -10.926   3.440   3.931
  157    HA3  GLY  18          1HA       GLY  18 -10.699   3.884   2.249