*HEADER    HYDROLASE INHIBITOR                     15-AUG-14   2MT8              
*TITLE     SOLUTION STRUCTURE MTABL13, A GRAFTED MCOTI-II                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MTABL13 OF GRAFTED MCOTI-II;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
*SOURCE   4 ORGANISM_TAXID: 32630                                                
*KEYWDS    CYCLOTIDE, TRYPSIN INHIBITOR, HYDROLASE INHIBITOR                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.HUANG, C.WANG, D.CRAIK                                              
*REVDAT   1   14-OCT-15 2MT8    0                                                


!#
!# NOE Restraints
!#

assign (resid  30 and name   HN)   (resid  30 and name   HA)   2.255    0.455    0.455  
assign (resid  14 and name   HN)   (resid  14 and name   HA)   2.365    0.565    0.565  
assign (resid  37 and name   HN)   (resid  37 and name   HA)   2.350    0.550    0.550  
assign (resid  10 and name   HN)   (resid  10 and name  HB2)   2.920    1.120    1.120  
assign (resid  10 and name   HN)   (resid  10 and name  HB1)   2.920    1.120    1.120  
assign (resid  10 and name   HA)   (resid  11 and name   HN)   2.300    0.500    0.500  
assign (resid  11 and name   HN)   (resid  11 and name  HB1)   2.795    0.995    0.995  
assign (resid  11 and name   HN)   (resid  11 and name  HB2)   2.795    0.995    0.995  
assign (resid  11 and name   HN)   (resid  12 and name   HN)   2.210    0.410    0.410  
assign (resid  12 and name   HN)   (resid  12 and name  HB2)   2.815    1.015    1.015  
assign (resid  12 and name   HN)   (resid  12 and name  HB1)   2.815    1.015    1.015  
assign (resid  10 and name   HA)   (resid  12 and name   HN)   2.900    1.100    1.100  
assign (resid  12 and name   HA)   (resid  13 and name   HN)   2.240    0.440    0.440  
assign (resid  12 and name  HB2)   (resid  13 and name   HN)   2.505    0.705    0.705  
assign (resid  12 and name  HB1)   (resid  13 and name   HN)   2.650    0.850    0.850  
assign (resid  13 and name   HN)   (resid  13 and name  HB2)   2.565    0.765    0.765  
assign (resid  13 and name   HN)   (resid  13 and name  HB1)   2.565    0.765    0.765  
assign (resid  13 and name   HA)   (resid  22 and name   HN)   2.650    0.850    0.850  
assign (resid  13 and name  HB2)   (resid  14 and name   HN)   2.640    0.840    0.840  
assign (resid  13 and name  HB1)   (resid  14 and name   HN)   2.640    0.840    0.840  
assign (resid  14 and name   HN)   (resid  14 and name  HB2)   2.650    0.850    0.850  
assign (resid  14 and name   HN)   (resid  14 and name  HB1)   2.650    0.850    0.850  
assign (resid  14 and name   HA)   (resid  15 and name   HN)   2.900    1.100    1.100  
assign (resid  14 and name  HB2)   (resid  15 and name   HN)   3.015    1.215    1.215  
assign (resid  14 and name  HB1)   (resid  15 and name   HN)   3.015    1.215    1.215  
assign (resid  15 and name   HN)   (resid  15 and name  HB#)   2.850    1.050    1.050  
assign (resid  16 and name   HN)   (resid  16 and name  HB2)   2.650    0.850    0.850  
assign (resid  16 and name   HN)   (resid  16 and name  HB1)   2.650    0.850    0.850  
assign (resid  15 and name  HB#)   (resid  16 and name   HN)   3.190    1.390    1.390  
assign (resid  17 and name   HA)   (resid  18 and name   HN)   2.240    0.440    0.440  
assign (resid  19 and name   HA)   (resid  20 and name   HN)   2.900    1.100    1.100  
assign (resid  18 and name  HA#)   (resid  20 and name   HN)   3.390    1.590    1.590  
assign (resid  20 and name   HN)   (resid  20 and name  HB1)   2.650    0.850    0.850  
assign (resid  20 and name   HN)   (resid  20 and name  HB2)   2.650    0.850    0.850  
assign (resid  20 and name   HA)   (resid  21 and name   HN)   2.315    0.515    0.515  
assign (resid  20 and name  HB2)   (resid  21 and name   HN)   2.795    0.995    0.995  
assign (resid  20 and name  HB1)   (resid  21 and name   HN)   2.795    0.995    0.995  
assign (resid  21 and name   HN)   (resid  21 and name   HB)   2.860    1.060    1.060  
assign (resid  21 and name   HN)   (resid  28 and name   HA)   3.185    1.385    1.385  
assign (resid  21 and name   HA)   (resid  22 and name   HN)   2.335    0.535    0.535  
assign (resid  22 and name   HN)   (resid  22 and name  HB1)   2.505    0.705    0.705  
assign (resid  22 and name   HN)   (resid  22 and name  HB2)   2.505    0.705    0.705  
assign (resid  21 and name   HB)   (resid  22 and name   HN)   2.300    0.500    0.500  
assign (resid  22 and name   HA)   (resid  23 and name   HN)   2.240    0.440    0.440  
assign (resid  23 and name   HN)   (resid  28 and name   HA)   2.640    0.840    0.840  
assign (resid  22 and name   HA)   (resid  28 and name   HA)   2.440    0.640    0.640  
assign (resid  23 and name   HN)   (resid  23 and name  HB1)   2.650    0.850    0.850  
assign (resid  23 and name   HN)   (resid  23 and name  HB2)   2.650    0.850    0.850  
assign (resid  23 and name   HA)   (resid  24 and name   HN)   2.315    0.515    0.515  
assign (resid  23 and name  HB2)   (resid  24 and name   HN)   2.610    0.810    0.810  
assign (resid  23 and name  HB1)   (resid  24 and name   HN)   2.610    0.810    0.810  
assign (resid  25 and name   HN)   (resid  25 and name  HB1)   2.735    0.935    0.935  
assign (resid  25 and name   HN)   (resid  25 and name  HB2)   2.735    0.935    0.935  
assign (resid  23 and name  HB2)   (resid  25 and name   HN)   2.675    0.875    0.875  
assign (resid  23 and name  HB1)   (resid  25 and name   HN)   2.675    0.875    0.875  
assign (resid  27 and name   HN)   (resid  27 and name  HB1)   2.690    0.890    0.890  
assign (resid  27 and name   HN)   (resid  27 and name  HB2)   2.690    0.890    0.890  
assign (resid  27 and name   HA)   (resid   9 and name   HA)   2.505    0.705    0.705  
assign (resid  10 and name   HN)   (resid  27 and name   HA)   2.610    0.810    0.810  
assign (resid  27 and name   HA)   (resid  28 and name   HN)   2.400    0.600    0.600  
assign (resid  27 and name   HN)   (resid   9 and name   HA)   3.170    1.370    1.370  
assign (resid  28 and name   HN)   (resid   9 and name   HA)   2.845    1.045    1.045  
assign (resid  27 and name  HB2)   (resid  28 and name   HN)   2.900    1.100    1.100  
assign (resid  27 and name  HB1)   (resid  28 and name   HN)   2.900    1.100    1.100  
assign (resid  28 and name   HA)   (resid  29 and name   HN)   2.255    0.455    0.455  
assign (resid  22 and name   HA)   (resid  29 and name   HN)   2.830    1.030    1.030  
assign (resid  20 and name   HA)   (resid  29 and name   HN)   3.125    1.325    1.325  
assign (resid  28 and name  HB#)   (resid  29 and name   HN)   3.255    1.455    1.455  
assign (resid  29 and name     )   (resid  30 and name   HN)   2.650    0.850    0.850  
assign (resid  29 and name  HA2)   (resid  30 and name   HN)   2.650    0.850    0.850  
assign (resid  30 and name   HN)   (resid  30 and name  HB1)   2.425    0.625    0.625  
assign (resid  30 and name   HN)   (resid  30 and name  HB2)   2.425    0.625    0.625  
assign (resid  30 and name   HA)   (resid  31 and name   HN)   2.650    0.850    0.850  
assign (resid  30 and name  HB1)   (resid  31 and name   HN)   2.750    0.950    0.950  
assign (resid  30 and name  HB2)   (resid  31 and name   HN)   2.750    0.950    0.950  
assign (resid  20 and name   HA)   (resid  31 and name   HN)   3.015    1.215    1.215  
assign (resid  31 and name   HA)   (resid  32 and name   HN)   2.650    0.850    0.850  
assign (resid  32 and name   HN)   (resid  32 and name   HB)   2.410    0.610    0.610  
assign (resid  33 and name   HN)   (resid  33 and name  HB1)   2.660    0.860    0.860  
assign (resid  33 and name   HN)   (resid  33 and name  HB2)   2.660    0.860    0.860  
assign (resid  32 and name   HA)   (resid  33 and name   HN)   2.470    0.670    0.670  
assign (resid  33 and name   HA)   (resid  34 and name   HN)   2.650    0.850    0.850  
assign (resid  34 and name   HA)   (resid  35 and name   HN)   2.650    0.850    0.850  
assign (resid  37 and name   HN)   (resid  37 and name  HB1)   2.520    0.720    0.720  
assign (resid  37 and name   HN)   (resid  37 and name  HB2)   2.520    0.720    0.720  
assign (resid  37 and name   HA)   (resid  38 and name   HN)   2.650    0.850    0.850  
assign (resid  38 and name   HA)   (resid  39 and name   HN)   2.285    0.485    0.485  
assign (resid  39 and name   HN)   (resid  39 and name  HB2)   2.690    0.890    0.890  
assign (resid  39 and name   HN)   (resid  39 and name  HB1)   2.690    0.890    0.890  
assign (resid  39 and name   HA)   (resid   1 and name   HN)   2.355    0.655    0.655  
assign (resid   1 and name   HN)   (resid   1 and name  HB#)   2.930    1.130    1.130  
assign (resid   1 and name   HA)   (resid   2 and name   HN)   2.380    0.580    0.580  
assign (resid   1 and name  HB#)   (resid   2 and name   HN)   3.500    1.700    1.700  
assign (resid   2 and name   HN)   (resid   2 and name  HB1)   2.795    0.995    0.995  
assign (resid   2 and name   HN)   (resid   2 and name  HB2)   2.795    0.995    0.995  
assign (resid   3 and name   HA)   (resid   4 and name   HN)   2.380    0.580    0.580  
assign (resid   4 and name   HN)   (resid   4 and name   HB)   2.485    0.685    0.685  
assign (resid   4 and name   HA)   (resid   5 and name   HN)   2.650    0.850    0.850  
assign (resid   5 and name   HN)   (resid   5 and name  HB1)   2.505    0.705    0.705  
assign (resid   5 and name   HN)   (resid   5 and name  HB2)   2.505    0.705    0.705  
assign (resid   5 and name   HA)   (resid   6 and name   HN)   2.650    0.850    0.850  
assign (resid   5 and name  HB1)   (resid   6 and name   HN)   2.705    0.905    0.905  
assign (resid   5 and name  HB2)   (resid   6 and name   HN)   2.705    0.905    0.905  
assign (resid   6 and name   HA)   (resid   7 and name   HN)   2.650    0.850    0.850  
assign (resid  21 and name   HN)   (resid  29 and name   HN)   2.565    0.765    0.765  
assign (resid  28 and name   HN)   (resid  29 and name   HN)   3.185    1.385    1.385  
assign (resid  29 and name   HN)   (resid  30 and name   HN)   3.125    1.325    1.325  
assign (resid  23 and name   HN)   (resid  29 and name   HN)   3.140    1.340    1.340  
assign (resid  13 and name   HN)   (resid  14 and name   HN)   2.505    0.705    0.705  
assign (resid  13 and name   HN)   (resid  15 and name   HN)   3.110    1.310    1.310  
assign (resid  24 and name   HN)   (resid  25 and name   HN)   2.595    0.795    0.795  
assign (resid  23 and name   HN)   (resid  24 and name   HN)   3.200    1.400    1.400  
assign (resid  31 and name   HN)   (resid  32 and name   HN)   2.860    1.060    1.060  
assign (resid  31 and name   HN)   (resid  32 and name   HA)   3.400    1.600    1.600  
assign (resid  27 and name   HN)   (resid  28 and name   HN)   3.125    1.325    1.325  
assign (resid  39 and name  HB2)   (resid   1 and name   HN)   2.815    1.015    1.015  
assign (resid  39 and name  HB1)   (resid   1 and name   HN)   2.815    1.015    1.015  
assign (resid  39 and name   HN)   (resid   1 and name   HN)   3.150    1.350    1.350  
assign (resid   1 and name   HN)   (resid   2 and name   HN)   2.780    0.980    0.980  
assign (resid  19 and name   HN)   (resid  20 and name   HN)   2.520    0.720    0.720  
assign (resid  10 and name   HN)   (resid   9 and name   HA)   2.225    0.425    0.425  
assign (resid   8 and name   HA)   (resid   9 and name   HN)   2.225    0.425    0.425  
assign (resid  25 and name   HN)   (resid  26 and name   HN)   2.440    0.640    0.640  
assign (resid  26 and name   HN)   (resid  27 and name   HN)   2.395    0.595    0.595  
assign (resid  23 and name  HB1)   (resid  26 and name   HN)   3.125    1.325    1.325  
assign (resid  37 and name   HN)   (resid  39 and name   HN)   2.935    1.135    1.135  
assign (resid  12 and name   HA)   (resid  14 and name   HN)   2.920    1.120    1.120  
assign (resid  14 and name   HN)   (resid  15 and name   HN)   2.505    0.705    0.705  
assign (resid  23 and name   HN)   (resid  27 and name   HN)   2.920    1.120    1.120  
assign (resid  15 and name   HN)   (resid  16 and name   HN)   2.315    0.515    0.515  
assign (resid  12 and name   HN)   (resid  15 and name  HB#)   3.100    1.300    1.300  
assign (resid  11 and name  HB2)   (resid  12 and name   HN)   2.750    0.950    0.950  
assign (resid  11 and name  HB1)   (resid  12 and name   HN)   2.750    0.950    0.950  
assign (resid   3 and name   HN)   (resid   4 and name   HN)   2.860    1.060    1.060  
assign (resid   2 and name  HB1)   (resid   3 and name   HN)   2.815    1.015    1.015  
assign (resid   2 and name  HB2)   (resid   3 and name   HN)   2.815    1.015    1.015  
assign (resid   4 and name   HA)   (resid   6 and name   HN)   3.170    1.370    1.370  
assign (resid   4 and name   HB)   (resid   5 and name   HN)   2.580    0.780    0.780  
assign (resid   3 and name   HA)   (resid   5 and name   HN)   2.970    1.170    1.170  
assign (resid  25 and name   HN)   (resid  27 and name   HN)   3.000    1.200    1.200  
assign (resid  36 and name   HA)   (resid  37 and name   HN)   2.650    0.850    0.850  
assign (resid  36 and name  HB2)   (resid  37 and name   HN)   2.955    1.155    1.155  
assign (resid  36 and name  HB1)   (resid  37 and name   HN)   2.955    1.155    1.155  
assign (resid  12 and name  HB2)   (resid  15 and name   HN)   3.400    1.600    1.600  
assign (resid  12 and name  HB1)   (resid  15 and name   HN)   3.400    1.600    1.600  
assign (resid  32 and name   HB)   (resid  33 and name   HN)   2.780    0.980    0.980  
assign (resid  13 and name   HA)   (resid  21 and name   HA)   2.780    0.980    0.980  
assign (resid  23 and name  HB2)   (resid  26 and name   HN)   3.125    1.325    1.325  
assign (resid  11 and name   HN)   (resid  11 and name  HD#)   3.640    1.840    1.840  
assign (resid  11 and name   HN)   (resid  11 and name  HG#)   3.845    2.045    2.045  
assign (resid  11 and name  HB1)   (resid  11 and name   HE)   3.650    1.850    1.850  
assign (resid  11 and name  HB2)   (resid  11 and name   HE)   3.650    1.850    1.850  
assign (resid  11 and name   HA)   (resid  11 and name  HD#)   3.750    1.950    1.950  
assign (resid  12 and name   HN)   (resid  12 and name  HD#)   3.515    1.715    1.715  
assign (resid  12 and name  HB2)   (resid  12 and name   HE)   3.400    1.600    1.600  
assign (resid  12 and name  HB1)   (resid  12 and name   HE)   3.400    1.600    1.600  
assign (resid  21 and name   HN)   (resid  21 and name HG12)   2.890    1.090    1.090  
assign (resid  21 and name   HN)   (resid  21 and name HG11)   2.890    1.090    1.090  
assign (resid  23 and name  HB2)   (resid  23 and name   HE)   3.605    1.805    1.805  
assign (resid  23 and name  HB1)   (resid  23 and name   HE)   3.605    1.805    1.805  
assign (resid  23 and name   HN)   (resid  23 and name  HG1)   2.625    0.825    0.825  
assign (resid  23 and name   HN)   (resid  23 and name  HG2)   2.625    0.825    0.825  
assign (resid  23 and name   HN)   (resid  23 and name  HD#)   4.090    2.290    2.290  
assign (resid  23 and name  HG1)   (resid  24 and name   HN)   3.650    1.850    1.850  
assign (resid  23 and name  HG2)   (resid  24 and name   HN)   3.650    1.850    1.850  
assign (resid  23 and name   HA)   (resid  23 and name  HD#)   3.670    1.870    1.870  
assign (resid  23 and name   HA)   (resid  23 and name  HG2)   2.860    1.060    1.060  
assign (resid  23 and name   HA)   (resid  23 and name  HG1)   2.860    1.060    1.060  
assign (resid  27 and name   HN)   (resid  27 and name  HD#)   4.605    2.805    2.805  
assign (resid  27 and name   HA)   (resid  27 and name  HD#)   4.220    2.420    2.420  
assign (resid  27 and name  HD#)   (resid   9 and name   HA)   4.405    2.605    2.605  
assign (resid  27 and name  HE#)   (resid   9 and name   HA)   4.715    2.915    2.915  
assign (resid  23 and name  HG1)   (resid  29 and name   HN)   3.635    1.835    1.835  
assign (resid  23 and name  HG2)   (resid  29 and name   HN)   3.635    1.835    1.835  
assign (resid  30 and name   HN)   (resid  30 and name  HG#)   3.425    1.625    1.625  
assign (resid  30 and name  HG#)   (resid  31 and name   HN)   3.985    2.185    2.185  
assign (resid  32 and name   HN)   (resid  32 and name HG12)   2.985    1.185    1.185  
assign (resid  32 and name   HN)   (resid  32 and name HG11)   2.985    1.185    1.185  
assign (resid  33 and name   HA)   (resid  33 and name  HD#)   4.095    2.295    2.295  
assign (resid  39 and name   HN)   (resid  39 and name  HG1)   3.125    1.325    1.325  
assign (resid  39 and name   HN)   (resid  39 and name  HG2)   3.125    1.325    1.325  
assign (resid  39 and name   HN)   (resid  39 and name  HD#)   4.090    2.290    2.290  
assign (resid  39 and name   HA)   (resid  39 and name   HE)   3.650    1.850    1.850  
assign (resid  39 and name  HB2)   (resid  39 and name   HE)   3.650    1.850    1.850  
assign (resid  39 and name  HB1)   (resid  39 and name   HE)   3.650    1.850    1.850  
assign (resid  39 and name   HA)   (resid  39 and name  HD#)   3.705    1.905    1.905  
assign (resid   2 and name   HN)   (resid   2 and name  HG#)   4.000    2.200    2.200  
assign (resid   4 and name   HN)   (resid   4 and name HG12)   3.015    1.215    1.215  
assign (resid   4 and name   HN)   (resid   4 and name HG11)   3.015    1.215    1.215  
assign (resid   5 and name   HA)   (resid   5 and name  HD#)   4.080    2.280    2.280  
assign (resid  12 and name  HG1)   (resid  13 and name   HN)   3.650    1.850    1.850  
assign (resid  12 and name  HG2)   (resid  13 and name   HN)   3.650    1.850    1.850  
assign (resid  23 and name  HD#)   (resid  24 and name   HN)   4.090    2.290    2.290  
assign (resid  27 and name  HD#)   (resid  28 and name   HN)   4.715    2.915    2.915  
assign (resid  39 and name  HG1)   (resid   1 and name   HN)   3.650    1.850    1.850  
assign (resid  39 and name  HG2)   (resid   1 and name   HN)   3.650    1.850    1.850  
assign (resid  30 and name  HG#)   (resid   1 and name   HN)   4.090    2.290    2.290  
assign (resid  23 and name  HD#)   (resid  30 and name   HN)   4.090    2.290    2.290  
assign (resid  16 and name   HA)   (resid  17 and name  HD2)   2.595    0.795    0.795  
assign (resid  16 and name   HA)   (resid  17 and name  HD1)   2.595    0.795    0.795  
assign (resid   9 and name  HG2)   (resid   9 and name  HZ#)   4.140    2.340    2.340  
assign (resid   9 and name  HG1)   (resid   9 and name  HZ#)   4.140    2.340    2.340  
assign (resid   9 and name  HB#)   (resid   9 and name  HZ#)   4.580    2.780    2.780  
assign (resid   9 and name   HN)   (resid   9 and name  HD#)   3.255    1.455    1.455  
assign (resid  26 and name   HN)   (resid  27 and name  HD#)   4.715    2.915    2.915  
assign (resid  10 and name   HN)   (resid   9 and name  HB#)   3.595    1.795    1.795  
assign (resid  10 and name   HN)   (resid   9 and name  HG2)   3.650    1.850    1.850  
assign (resid  10 and name   HN)   (resid   9 and name  HG1)   3.650    1.850    1.850  
assign (resid  12 and name   HE)   (resid  14 and name   HN)   3.650    1.850    1.850  
assign (resid  12 and name   HN)   (resid  22 and name  HB2)   3.650    1.850    1.850  
assign (resid  12 and name   HN)   (resid  22 and name  HB1)   3.650    1.850    1.850  
assign (resid   2 and name  HG#)   (resid   3 and name   HN)   4.090    2.290    2.290  
assign (resid   7 and name   HN)   (resid   8 and name  HD2)   3.650    1.850    1.850  
assign (resid   7 and name   HN)   (resid   8 and name  HD1)   3.650    1.850    1.850  
assign (resid   5 and name  HD#)   (resid   6 and name   HN)   4.715    2.915    2.915  
assign (resid   5 and name   HN)   (resid   5 and name  HD#)   4.715    2.915    2.915  
assign (resid   4 and name HG12)   (resid   5 and name   HN)   3.605    1.805    1.805  
assign (resid   4 and name HG11)   (resid   5 and name   HN)   3.605    1.805    1.805  
assign (resid  37 and name   HA)   (resid  37 and name  HD#)   4.405    2.605    2.605  
assign (resid  37 and name   HN)   (resid  37 and name  HD#)   4.715    2.915    2.915  
assign (resid  35 and name   HA)   (resid  36 and name  HD2)   2.765    0.965    0.965  
assign (resid  35 and name   HA)   (resid  36 and name  HD1)   2.765    0.965    0.965  
assign (resid  33 and name   HN)   (resid  33 and name  HD#)   4.715    2.915    2.915  
assign (resid  27 and name  HE#)   (resid   9 and name  HD#)   5.160    3.360    3.360  
assign (resid  27 and name  HE#)   (resid   9 and name  HB#)   5.155    3.355    3.355  
assign (resid  27 and name  HE#)   (resid   9 and name  HE#)   5.160    3.360    3.360  
assign (resid  27 and name  HD#)   (resid   9 and name  HD#)   5.155    3.355    3.355  
assign (resid   7 and name   HA)   (resid   8 and name  HD1)   2.610    0.810    0.810  
assign (resid   7 and name   HA)   (resid   8 and name  HD2)   2.610    0.810    0.810  
assign (resid  13 and name   HA)   (resid  22 and name  HB1)   2.860    1.060    1.060  
assign (resid  13 and name   HA)   (resid  22 and name  HB2)   2.860    1.060    1.060  
assign (resid   9 and name  HB#)   (resid   9 and name  HE#)   4.530    2.730    2.730  
assign (resid  21 and name HG11)   (resid  23 and name  HD#)   4.090    2.290    2.290  
assign (resid  21 and name HG12)   (resid  23 and name  HD#)   4.090    2.290    2.290  
assign (resid  21 and name HG12)   (resid  31 and name   HA)   3.555    1.755    1.755  
assign (resid  21 and name HG11)   (resid  31 and name   HA)   3.555    1.755    1.755  
assign (resid  36 and name  HG#)   (resid  37 and name  HD#)   5.160    3.360    3.360  
assign (resid  16 and name  HB1)   (resid  17 and name  HD1)   3.590    1.790    1.790  
assign (resid  16 and name  HB2)   (resid  17 and name  HD1)   3.590    1.790    1.790  
assign (resid  16 and name  HB1)   (resid  17 and name  HD2)   3.590    1.790    1.790  
assign (resid  16 and name  HB2)   (resid  17 and name  HD2)   3.590    1.790    1.790  
assign (resid  28 and name  HB#)   (resid   8 and name  HD2)   4.090    2.290    2.290  
assign (resid  28 and name  HB#)   (resid   8 and name  HD1)   4.090    2.290    2.290  
assign (resid  21 and name   HN)   (resid  21 and name HD1#)   3.775    1.975    1.975  
assign (resid  21 and name   HN)   (resid  21 and name HG2#)   3.510    1.710    1.710  
assign (resid  21 and name HG2#)   (resid  22 and name   HN)   3.510    1.710    1.710  
assign (resid  21 and name HD1#)   (resid  22 and name   HN)   3.880    2.080    2.080  
assign (resid  31 and name   HN)   (resid  31 and name  HB#)   2.905    1.105    1.105  
assign (resid  21 and name HD1#)   (resid  31 and name   HN)   4.160    2.360    2.360  
assign (resid  21 and name HG2#)   (resid  31 and name   HN)   4.160    2.360    2.360  
assign (resid  32 and name   HN)   (resid  32 and name HG2#)   3.510    1.710    1.710  
assign (resid  32 and name   HN)   (resid  32 and name HD1#)   3.880    2.080    2.080  
assign (resid  32 and name HG2#)   (resid  32 and name HD1#)   4.670    2.870    2.870  
assign (resid  34 and name   HN)   (resid  34 and name  HB#)   2.825    1.025    1.025  
assign (resid  35 and name   HN)   (resid  35 and name  HB#)   2.905    1.105    1.105  
assign (resid  38 and name   HN)   (resid  38 and name  HB#)   2.780    0.980    0.980  
assign (resid  38 and name  HB#)   (resid  39 and name   HN)   3.400    1.600    1.600  
assign (resid   3 and name   HN)   (resid   3 and name  HB#)   2.920    1.120    1.120  
assign (resid   3 and name  HB#)   (resid   4 and name   HN)   3.370    1.570    1.570  
assign (resid   4 and name   HN)   (resid   4 and name HG2#)   3.540    1.740    1.740  
assign (resid   4 and name   HN)   (resid   4 and name HD1#)   4.160    2.360    2.360  
assign (resid   4 and name   HA)   (resid   4 and name HD1#)   3.635    1.835    1.835  
assign (resid   6 and name   HN)   (resid   6 and name  HB#)   2.920    1.120    1.120  
assign (resid   7 and name   HN)   (resid   7 and name  HB#)   2.840    1.040    1.040  
assign (resid  28 and name   HN)   (resid   7 and name  HB#)   3.925    2.125    2.125  
assign (resid  21 and name HD1#)   (resid  23 and name   HN)   4.160    2.360    2.360  
assign (resid   4 and name HG2#)   (resid   6 and name   HN)   4.130    2.330    2.330  
assign (resid   4 and name HG2#)   (resid   5 and name   HN)   3.665    1.865    1.865  
assign (resid   3 and name  HB#)   (resid   5 and name   HN)   3.710    1.910    1.910  
assign (resid  32 and name HG2#)   (resid  33 and name   HN)   3.785    1.985    1.985  
assign (resid  21 and name HD1#)   (resid  31 and name   HA)   3.245    1.445    1.445  
assign (resid  21 and name HD1#)   (resid  23 and name  HD#)   4.370    2.570    2.570  
assign (resid  21 and name HG2#)   (resid  23 and name  HD#)   4.600    2.800    2.800  
assign (resid  13 and name  HB1)   (resid  21 and name HD1#)   4.160    2.360    2.360  
assign (resid  13 and name  HB2)   (resid  21 and name HD1#)   4.160    2.360    2.360  
assign (resid  21 and name HG2#)   (resid  31 and name   HA)   3.820    2.020    2.020  
assign (resid  21 and name   HA)   (resid  21 and name HD1#)   3.620    1.820    1.820  
assign (resid  21 and name   HA)   (resid  21 and name HG2#)   2.905    1.105    1.105  
assign (resid  21 and name HG2#)   (resid  31 and name  HB#)   4.530    2.730    2.730  
assign (resid   7 and name  HB#)   (resid   8 and name  HD1)   3.585    1.785    1.785  
assign (resid  21 and name HD1#)   (resid  23 and name   HE)   4.160    2.360    2.360  
assign (resid   4 and name HG2#)   (resid   5 and name  HD#)   5.225    3.425    3.425  
assign (resid  30 and name   HN)   (resid  38 and name  HB#)   4.160    2.360    2.360  
assign (resid  38 and name  HB#)   (resid   1 and name   HN)   4.160    2.360    2.360  
assign (resid   4 and name HG2#)   (resid   5 and name  HE#)   5.225    3.425    3.425  
assign (resid   4 and name HD1#)   (resid   5 and name  HE#)   5.225    3.425    3.425  
assign (resid  32 and name HG2#)   (resid  33 and name  HD#)   5.225    3.425    3.425  
assign (resid  37 and name  HD#)   (resid  38 and name  HB#)   5.225    3.425    3.425  
assign (resid  32 and name   HA)   (resid  32 and name HD1#)   3.620    1.820    1.820  
assign (resid  20 and name   HA)   (resid  21 and name HG2#)   4.130    2.330    2.330  
assign (resid   7 and name  HB#)   (resid   8 and name  HD2)   3.585    1.785    1.785  
assign (resid   6 and name   HA)   (resid   7 and name  HB#)   3.910    2.110    2.110  
assign (resid   4 and name HG2#)   (resid   5 and name   HA)   3.975    2.175    2.175  
assign (resid  21 and name HD1#)   (resid  23 and name   HA)   3.820    2.020    2.020  
assign (resid  18 and name  HA#)   (resid  19 and name  HB#)   4.600    2.800    2.800  
assign (resid  35 and name  HB#)   (resid  36 and name  HD1)   3.510    1.710    1.710  
assign (resid  35 and name  HB#)   (resid  36 and name  HD2)   3.510    1.710    1.710  
assign (resid  33 and name   HN)   (resid  34 and name  HB#)   3.540    1.740    1.740  
assign (resid   5 and name  HD#)   (resid   6 and name  HB#)   5.225    3.425    3.425  
assign (resid   5 and name  HE#)   (resid   6 and name  HB#)   5.225    3.425    3.425  
assign (resid  33 and name  HD#)   (resid  34 and name  HB#)   5.145    3.345    3.345  
assign (resid  35 and name  HB#)   (resid  37 and name  HE#)   5.225    3.425    3.425  
assign (resid   4 and name HG2#)   (resid   7 and name  HB#)   4.670    2.870    2.870  
assign (resid  10 and name   HN)   (resid  10 and name  HB#)   2.585    0.785    0.785  
assign (resid  10 and name   HA)   (resid  10 and name  HB#)   2.190    0.390    0.390  
assign (resid  10 and name  HB#)   (resid  11 and name   HN)   2.530    0.730    0.730  
assign (resid  10 and name  HB#)   (resid  22 and name  HB#)   2.945    1.145    1.145  
assign (resid  10 and name  HB#)   (resid  28 and name   HN)   3.570    1.770    1.770  
assign (resid  10 and name  HB#)   (resid  28 and name   HA)   3.570    1.770    1.770  
assign (resid  11 and name   HN)   (resid  11 and name  HB#)   2.445    0.645    0.645  
assign (resid  11 and name  HB#)   (resid  11 and name   HE)   3.275    1.475    1.475  
assign (resid  11 and name  HB#)   (resid  12 and name   HN)   2.650    0.850    0.850  
assign (resid  12 and name   HN)   (resid  12 and name  HB#)   2.515    0.715    0.715  
assign (resid  12 and name   HN)   (resid  12 and name  HG#)   2.755    0.955    0.955  
assign (resid  12 and name  HB#)   (resid  12 and name   HE)   3.100    1.300    1.300  
assign (resid  12 and name  HB#)   (resid  13 and name   HN)   2.275    0.475    0.475  
assign (resid  12 and name  HB#)   (resid  14 and name   HN)   2.590    0.790    0.790  
assign (resid  12 and name  HB#)   (resid  15 and name   HN)   2.755    0.955    0.955  
assign (resid  12 and name  HG#)   (resid  14 and name   HN)   2.710    0.910    0.910  
assign (resid  12 and name  HG#)   (resid  15 and name   HN)   2.955    1.155    1.155  
assign (resid  12 and name  HD#)   (resid  14 and name  HB#)   3.910    2.110    2.110  
assign (resid  13 and name   HN)   (resid  13 and name  HB#)   2.245    0.445    0.445  
assign (resid  13 and name   HA)   (resid  22 and name  HB#)   2.600    0.800    0.800  
assign (resid  13 and name  HB#)   (resid  14 and name   HN)   2.345    0.545    0.545  
assign (resid  13 and name  HB#)   (resid  21 and name   HB)   3.325    1.525    1.525  
assign (resid  13 and name  HB#)   (resid  21 and name HG2#)   3.555    1.755    1.755  
assign (resid  13 and name  HB#)   (resid  22 and name  HB#)   3.370    1.570    1.570  
assign (resid  14 and name   HN)   (resid  14 and name  HB#)   2.255    0.455    0.455  
assign (resid  14 and name  HB#)   (resid  15 and name   HN)   2.650    0.850    0.850  
assign (resid  16 and name   HN)   (resid  16 and name  HB#)   2.400    0.600    0.600  
assign (resid  16 and name   HN)   (resid  17 and name  HD#)   3.575    1.775    1.775  
assign (resid  16 and name   HA)   (resid  17 and name  HD#)   2.350    0.550    0.550  
assign (resid  16 and name  HB#)   (resid  17 and name  HD#)   2.780    0.980    0.980  
assign (resid  16 and name  HB#)   (resid  20 and name  HB#)   2.695    0.895    0.895  
assign (resid  16 and name  HB#)   (resid  21 and name   HA)   3.005    1.205    1.205  
assign (resid  16 and name  HB#)   (resid  29 and name   HN)   3.570    1.770    1.770  
assign (resid  17 and name  HB#)   (resid  18 and name   HN)   2.650    0.850    0.850  
assign (resid  17 and name  HD#)   (resid  28 and name  HB#)   3.985    2.185    2.185  
assign (resid  19 and name   HN)   (resid  20 and name  HB#)   3.120    1.320    1.320  
assign (resid  20 and name   HN)   (resid  20 and name  HB#)   2.275    0.475    0.475  
assign (resid  20 and name  HB#)   (resid  21 and name   HN)   2.435    0.635    0.635  
assign (resid  20 and name  HB#)   (resid  28 and name   HA)   3.570    1.770    1.770  
assign (resid  20 and name  HB#)   (resid  29 and name   HN)   2.915    1.115    1.115  
assign (resid  21 and name   HN)   (resid  21 and name HG1#)   2.645    0.845    0.845  
assign (resid  21 and name HG1#)   (resid  22 and name   HN)   3.570    1.770    1.770  
assign (resid  21 and name HG1#)   (resid  31 and name   HN)   3.570    1.770    1.770  
assign (resid  21 and name HG1#)   (resid  31 and name   HA)   3.145    1.345    1.345  
assign (resid  21 and name HD1#)   (resid  23 and name  HG#)   4.030    2.230    2.230  
assign (resid  23 and name   HN)   (resid  23 and name  HB#)   2.255    0.455    0.455  
assign (resid  23 and name   HN)   (resid  23 and name  HG#)   2.385    0.585    0.585  
assign (resid  23 and name   HA)   (resid  23 and name  HG#)   2.575    0.775    0.775  
assign (resid  23 and name  HB#)   (resid  23 and name   HE)   3.230    1.430    1.430  
assign (resid  23 and name  HB#)   (resid  24 and name   HN)   2.275    0.475    0.475  
assign (resid  23 and name  HB#)   (resid  25 and name   HN)   2.445    0.645    0.645  
assign (resid  23 and name  HB#)   (resid  27 and name   HN)   2.675    0.875    0.875  
assign (resid  23 and name  HG#)   (resid  29 and name   HN)   3.245    1.445    1.445  
assign (resid  25 and name   HN)   (resid  25 and name  HB#)   2.435    0.635    0.635  
assign (resid  25 and name   HN)   (resid  26 and name  HA#)   3.135    1.335    1.335  
assign (resid  25 and name  HB#)   (resid  25 and name HD2#)   2.410    0.610    0.610  
assign (resid  25 and name  HB#)   (resid  27 and name  HD#)   4.555    2.755    2.755  
assign (resid  25 and name  HB#)   (resid  27 and name  HE#)   4.560    2.760    2.760  
assign (resid  25 and name HD2#)   (resid  27 and name  HB#)   3.215    1.415    1.415  
assign (resid  25 and name HD2#)   (resid  27 and name  HD#)   4.555    2.755    2.755  
assign (resid  26 and name   HN)   (resid  26 and name  HA#)   2.180    0.380    0.380  
assign (resid  26 and name   HN)   (resid  27 and name  HB#)   2.855    1.055    1.055  
assign (resid  26 and name  HA#)   (resid  27 and name  HD#)   4.555    2.755    2.755  
assign (resid  27 and name   HN)   (resid  27 and name  HB#)   2.365    0.565    0.565  
assign (resid  27 and name  HB#)   (resid  28 and name   HN)   2.365    0.565    0.565  
assign (resid  27 and name  HB#)   (resid   7 and name  HB#)   3.205    1.405    1.405  
assign (resid  27 and name  HD#)   (resid   9 and name  HG#)   4.015    2.215    2.215  
assign (resid  27 and name  HE#)   (resid   9 and name  HG#)   4.075    2.275    2.275  
assign (resid  28 and name   HN)   (resid   8 and name  HD#)   3.575    1.775    1.775  
assign (resid  28 and name   HA)   (resid  29 and name  HA#)   3.045    1.245    1.245  
assign (resid  29 and name  HA#)   (resid  30 and name   HN)   2.050    0.250    0.250  
assign (resid  30 and name   HN)   (resid  30 and name  HB#)   2.215    0.415    0.415  
assign (resid  32 and name   HN)   (resid  32 and name HG1#)   2.590    0.790    0.790  
assign (resid  35 and name   HA)   (resid  36 and name  HD#)   2.485    0.685    0.685  
assign (resid  35 and name  HB#)   (resid  36 and name  HD#)   3.075    1.275    1.275  
assign (resid  36 and name  HB#)   (resid  37 and name   HN)   2.660    0.860    0.860  
assign (resid  36 and name  HB#)   (resid  37 and name  HD#)   4.555    2.755    2.755  
assign (resid  36 and name  HD#)   (resid  37 and name   HN)   3.365    1.565    1.565  
assign (resid  39 and name   HN)   (resid  39 and name  HB#)   2.395    0.595    0.595  
assign (resid  39 and name   HA)   (resid  39 and name  HG#)   2.545    0.745    0.745  
assign (resid  39 and name  HB#)   (resid  39 and name   HE)   3.320    1.520    1.520  
assign (resid  39 and name  HB#)   (resid   1 and name   HN)   2.545    0.745    0.745  
assign (resid  39 and name  HB#)   (resid   2 and name   HN)   3.005    1.205    1.205  
assign (resid   2 and name   HN)   (resid   2 and name  HB#)   2.485    0.685    0.685  
assign (resid   4 and name   HN)   (resid   4 and name HG1#)   2.725    0.925    0.925  
assign (resid   4 and name HG1#)   (resid   5 and name   HN)   3.270    1.470    1.470  
assign (resid   5 and name   HN)   (resid   5 and name  HB#)   2.300    0.500    0.500  
assign (resid   5 and name  HB#)   (resid   6 and name   HN)   2.470    0.670    0.670  
assign (resid   7 and name   HN)   (resid   8 and name  HD#)   3.230    1.430    1.430  
assign (resid   7 and name   HA)   (resid   8 and name  HD#)   2.360    0.560    0.560  
assign (resid   7 and name  HB#)   (resid   8 and name  HD#)   3.155    1.355    1.355  
assign (resid   9 and name   HN)   (resid   9 and name  HG#)   2.760    0.960    0.960  
assign (resid  10 and name   HN)   (resid  26 and name    O)   1.900    0.100    0.100  
assign (resid  10 and name    N)   (resid  26 and name    O)   2.400    0.600    0.600  
assign (resid  11 and name   HN)   (resid  15 and name  OD1)   1.900    0.100    0.100  
assign (resid  11 and name    N)   (resid  15 and name  OD1)   2.400    0.600    0.600  
assign (resid  12 and name   HN)   (resid  15 and name  OD1)   1.900    0.100    0.100  
assign (resid  12 and name    N)   (resid  15 and name  OD1)   2.400    0.600    0.600  
assign (resid  15 and name   HN)   (resid  12 and name    O)   1.900    0.100    0.100  
assign (resid  15 and name    N)   (resid  12 and name    O)   2.400    0.600    0.600  
assign (resid  16 and name   HN)   (resid  13 and name    O)   1.900    0.100    0.100  
assign (resid  16 and name    N)   (resid  13 and name    O)   2.400    0.600    0.600  
assign (resid  20 and name   HN)   (resid  17 and name    O)   1.900    0.100    0.100  
assign (resid  20 and name    N)   (resid  17 and name    O)   2.400    0.600    0.600  
assign (resid  21 and name   HN)   (resid  29 and name    O)   1.900    0.100    0.100  
assign (resid  21 and name    N)   (resid  29 and name    O)   2.400    0.600    0.600  
assign (resid  22 and name   HN)   (resid  13 and name  OD1)   1.900    0.100    0.100  
assign (resid  22 and name    N)   (resid  13 and name  OD1)   2.400    0.600    0.600  
assign (resid  23 and name   HN)   (resid  27 and name    O)   1.900    0.100    0.100  
assign (resid  23 and name    N)   (resid  27 and name    O)   2.400    0.600    0.600  
assign (resid  26 and name   HN)   (resid  23 and name    O)   1.900    0.100    0.100  
assign (resid  26 and name    N)   (resid  23 and name    O)   2.400    0.600    0.600  
assign (resid  27 and name   HN)   (resid  25 and name  OD1)   1.900    0.100    0.100  
assign (resid  27 and name    N)   (resid  25 and name  OD1)   2.400    0.600    0.600  
assign (resid  28 and name   HN)   (resid   8 and name    O)   1.900    0.100    0.100  
assign (resid  28 and name    N)   (resid   8 and name    O)   2.400    0.600    0.600  
assign (resid  29 and name   HN)   (resid  21 and name    O)   1.900    0.100    0.100  
assign (resid  29 and name    N)   (resid  21 and name    O)   2.400    0.600    0.600  

!#
!# Dihedral Angle Restraints
!#

assign (resid  10  and name c ) (resid  11  and name n ) (resid  11  and name ca) (resid  11  and name c )   1.0  -120.0 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 c ) (resid  13  and name n ) (resid  13  and name ca) (resid  13  and name c )   1.0  -65.0 15.0 2
assign (resid  15  and name c ) (resid  16  and name n ) (resid  16  and name ca) (resid  16  and name c )   1.0  -120.0 30.0 2
assign (resid  20  and name c ) (resid  21  and name n ) (resid  21  and name ca) (resid  21  and name c )   1.0  -120.0 30.0 2
assign (resid  21  and name c ) (resid  22  and name n ) (resid  22  and name ca) (resid  22  and name c )   1.0  -120.0 30.0 2
assign (resid  24  and name c ) (resid  25  and name n ) (resid  25  and name ca) (resid  25  and name c )   1.0  -120.0 30.0 2
assign (resid  26  and name c ) (resid  27  and name n ) (resid  27  and name ca) (resid  27  and name c )   1.0  -120.0 30.0 2
assign (resid  27  and name c ) (resid  28  and name n ) (resid  28  and name ca) (resid  28  and name c )   1.0  -65.0 15.0 2
assign (resid  17  and name c ) (resid  18  and name n ) (resid  18  and name ca) (resid  18  and name c )   1.0  50.0 40.0 2
assign (resid  29  and name c ) (resid  30  and name n ) (resid  30  and name ca) (resid  30  and name c )   1.0  -65.0 15.0 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  39  and name c ) (resid   1  and name n ) (resid   1  and name ca) (resid   1  and name c )   1.0  -100.0 80.0 2
assign (resid  38  and name c ) (resid  39  and name n ) (resid  39  and name ca) (resid  39  and name c )   1.0  -100.0 80.0 2
assign (resid   2  and name c ) (resid   3  and name n ) (resid   3  and name ca) (resid   3  and name c )   1.0  -100.0 80.0 2
assign (resid  32  and name c ) (resid  33  and name n ) (resid  33  and name ca) (resid  33  and name c )   1.0  -100.0 80.0 2
assign (resid   4  and name c ) (resid   5  and name n ) (resid   5  and name ca) (resid   5  and name c )   1.0  -120.0 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  -65.0 15.0 2
assign (resid  36  and name c ) (resid  37  and name n ) (resid  37  and name ca) (resid  37  and name c )   1.0  -120.0 30.0 2
assign (resid   1  and name c ) (resid   2  and name n ) (resid   2  and name ca) (resid   2  and name c )   1.0  -120.0 30.0 2
assign (resid  34  and name c ) (resid  35  and name n ) (resid  35  and name ca) (resid  35  and name c )   1.0  -65.0 15.0 2
assign (resid  30  and name c ) (resid  31  and name n ) (resid  31  and name ca) (resid  31  and name c )   1.0  -65.0 15.0 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 80.0 2
assign (resid  31  and name c ) (resid  32  and name n ) (resid  32  and name ca) (resid  32  and name c )   1.0  -100.0 80.0 2
assign (resid  11  and name n ) (resid  11  and name ca ) (resid  11  and name cb) (resid  11  and name cg )   1.0  -60.0 30.0 2   
assign (resid  13  and name n ) (resid  13  and name ca ) (resid  13  and name cb) (resid  13  and name cg )   1.0  -60.0 30.0 2   
assign (resid  14  and name n ) (resid  14  and name ca ) (resid  14  and name cb) (resid  14  and name og )   1.0  60.0 15.0 2   
assign (resid  23  and name n ) (resid  23  and name ca ) (resid  23  and name cb) (resid  23  and name cg )   1.0  -60.0 30.0 2   
assign (resid  25  and name n ) (resid  25  and name ca ) (resid  25  and name cb) (resid  25  and name cg )   1.0  60.0 15.0 2   
assign (resid  27  and name n ) (resid  27  and name ca ) (resid  27  and name cb) (resid  27  and name cg )   1.0  -60.0 30.0 2   
assign (resid  10  and name n ) (resid  10  and name ca ) (resid  10  and name cb) (resid  10  and name sg )   1.0  60.0 15.0 2   
assign (resid  16  and name n ) (resid  16  and name ca ) (resid  16  and name cb) (resid  16  and name sg )   1.0  -60.0 30.0 2   
assign (resid  20  and name n ) (resid  20  and name ca ) (resid  20  and name cb) (resid  20  and name sg )   1.0  -60.0 30.0 2   
assign (resid  22  and name n ) (resid  22  and name ca ) (resid  22  and name cb) (resid  22  and name sg )   1.0  -180.0 15.0 2   
assign (resid  28  and name n ) (resid  28  and name ca ) (resid  28  and name cb) (resid  28  and name sg )   1.0  -60.0 30.0 2   
assign (resid  39  and name n ) (resid  39  and name ca ) (resid  39  and name cb) (resid  39  and name cg )   1.0  -60.0 30.0 2   
assign (resid  30  and name n ) (resid  30  and name ca ) (resid  30  and name cb) (resid  30  and name cg )   1.0  -180.0 15.0 2   

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   CYS   1           H        CYS   1  -3.916   1.802   1.398
    2    HA   CYS   1           HA       CYS   1  -3.485   3.276   3.845
    3    HB2  CYS   1           HB2      CYS   1  -1.196   2.381   4.208
    4    HB3  CYS   1           HB3      CYS   1  -2.443   1.171   4.480
    5    H    GLU   2           H        GLU   2  -4.024   3.899   1.108
    6    HA   GLU   2           HA       GLU   2  -1.474   4.708   0.049
    7    HB2  GLU   2           HB2      GLU   2  -4.178   5.310  -1.137
    8    HB3  GLU   2           HB3      GLU   2  -2.627   5.441  -1.921
    9    HG2  GLU   2           HG2      GLU   2  -3.572   3.510  -2.845
   10    HG3  GLU   2           HG3      GLU   2  -2.423   2.913  -1.653
   11    H    ALA   3           H        ALA   3  -0.781   6.796  -0.031
   12    HA   ALA   3           HA       ALA   3  -2.354   8.948   0.925
   13    HB1  ALA   3           HB1      ALA   3  -1.607   7.973   3.035
   14    HB2  ALA   3           HB2      ALA   3  -0.656   9.422   2.689
   15    HB3  ALA   3           HB3      ALA   3   0.033   7.828   2.409
   16    H    ILE   4           H        ILE   4  -1.187  10.795   0.491
   17    HA   ILE   4           HA       ILE   4   0.816  10.359  -1.600
   18    HB   ILE   4           HB       ILE   4  -0.795  12.893  -1.145
   19   HG12  ILE   4          HG12      ILE   4  -1.259  10.717  -3.203
   20   HG13  ILE   4          HG13      ILE   4  -2.246  10.965  -1.769
   21   HG21  ILE   4          HG21      ILE   4   0.919  12.005  -3.464
   22   HG22  ILE   4          HG22      ILE   4   1.280  13.300  -2.320
   23   HG23  ILE   4          HG23      ILE   4  -0.080  13.456  -3.432
   24   HD11  ILE   4          HD11      ILE   4  -2.893  13.175  -2.624
   25   HD12  ILE   4          HD12      ILE   4  -3.324  11.883  -3.739
   26   HD13  ILE   4          HD13      ILE   4  -1.913  12.892  -4.062
   27    H    TYR   5           H        TYR   5   0.214  12.206   1.283
   28    HA   TYR   5           HA       TYR   5   2.799  13.522   1.053
   29    HB2  TYR   5           HB2      TYR   5   0.753  14.700   1.845
   30    HB3  TYR   5           HB3      TYR   5   0.740  13.662   3.245
   31    HD1  TYR   5           HD2      TYR   5   2.776  16.268   1.559
   32    HD2  TYR   5           HD1      TYR   5   2.039  14.116   5.156
   33    HE1  TYR   5           HE2      TYR   5   4.284  17.770   2.761
   34    HE2  TYR   5           HE1      TYR   5   3.540  15.613   6.367
   35    HH   TYR   5           HH       TYR   5   5.489  17.073   5.793
   36    H    ALA   6           H        ALA   6   1.185  11.203   2.965
   37    HA   ALA   6           HA       ALA   6   3.690  10.592   4.447
   38    HB1  ALA   6           HB1      ALA   6   2.311   9.887   6.338
   39    HB2  ALA   6           HB2      ALA   6   0.852  10.255   5.423
   40    HB3  ALA   6           HB3      ALA   6   1.949  11.556   5.891
   41    H    ALA   7           H        ALA   7   3.473   9.412   2.133
   42    HA   ALA   7           HA       ALA   7   1.998   6.960   2.185
   43    HB1  ALA   7           HB1      ALA   7   2.374   8.166   0.119
   44    HB2  ALA   7           HB2      ALA   7   3.090   6.552   0.045
   45    HB3  ALA   7           HB3      ALA   7   4.114   7.960   0.306
   46    HA   PRO   8           HA       PRO   8   5.417   4.744   4.178
   47    HB2  PRO   8           HB2      PRO   8   3.803   2.343   3.959
   48    HB3  PRO   8           HB3      PRO   8   4.238   3.233   5.418
   49    HG2  PRO   8           HG2      PRO   8   1.691   3.092   4.404
   50    HG3  PRO   8           HG3      PRO   8   2.278   4.404   5.433
   51    HD2  PRO   8           HD2      PRO   8   1.901   4.322   2.481
   52    HD3  PRO   8           HD3      PRO   8   1.654   5.663   3.626
   53    H    LYS   9           H        LYS   9   7.082   4.151   2.891
   54    HA   LYS   9           HA       LYS   9   6.575   3.154   0.277
   55    HB2  LYS   9           HB2      LYS   9   9.002   3.121  -0.030
   56    HB3  LYS   9           HB3      LYS   9   8.437   4.660   0.588
   57    HG2  LYS   9           HG2      LYS   9   9.215   4.012   2.832
   58    HG3  LYS   9           HG3      LYS   9   9.811   2.492   2.158
   59    HD2  LYS   9           HD2      LYS   9  11.253   3.741   0.631
   60    HD3  LYS   9           HD3      LYS   9  10.676   5.254   1.327
   61    HE2  LYS   9           HE2      LYS   9  11.582   4.605   3.493
   62    HE3  LYS   9           HE3      LYS   9  12.147   3.083   2.811
   63    HZ1  LYS   9           HZ1      LYS   9  13.568   4.356   1.302
   64    HZ2  LYS   9           HZ2      LYS   9  13.928   4.677   2.917
   65    HZ3  LYS   9           HZ3      LYS   9  13.050   5.794   2.021
   66    H    CYS  10           H        CYS  10   7.602   1.178  -0.580
   67    HA   CYS  10           HA       CYS  10   7.416  -0.934   1.450
   68    HB2  CYS  10           HB2      CYS  10   6.496  -2.373  -0.312
   69    HB3  CYS  10           HB3      CYS  10   5.471  -0.987   0.041
   70    H    ARG  11           H        ARG  11   8.770  -2.649   1.284
   71    HA   ARG  11           HA       ARG  11  10.861  -2.527  -0.790
   72    HB2  ARG  11           HB2      ARG  11  10.808  -4.170   1.743
   73    HB3  ARG  11           HB3      ARG  11  12.163  -3.965   0.659
   74    HG2  ARG  11           HG2      ARG  11  12.444  -1.678   1.345
   75    HG3  ARG  11           HG3      ARG  11  10.986  -1.765   2.341
   76    HD2  ARG  11           HD2      ARG  11  13.546  -3.314   2.722
   77    HD3  ARG  11           HD3      ARG  11  12.898  -2.051   3.774
   78    HE   ARG  11           HE       ARG  11  10.966  -4.061   3.529
   79   HH11  ARG  11          HH11      ARG  11  14.142  -3.683   5.075
   80   HH12  ARG  11          HH12      ARG  11  13.835  -4.939   6.199
   81   HH21  ARG  11          HH21      ARG  11  10.605  -5.660   4.986
   82   HH22  ARG  11          HH22      ARG  11  11.784  -6.084   6.168
   83    H    ARG  12           H        ARG  12   8.695  -4.528   1.152
   84    HA   ARG  12           HA       ARG  12   7.981  -6.080  -1.182
   85    HB2  ARG  12           HB2      ARG  12   8.074  -8.152   0.142
   86    HB3  ARG  12           HB3      ARG  12   9.653  -7.544  -0.338
   87    HG2  ARG  12           HG2      ARG  12   9.861  -6.646   1.992
   88    HG3  ARG  12           HG3      ARG  12   8.336  -7.451   2.371
   89    HD2  ARG  12           HD2      ARG  12  10.862  -8.783   1.402
   90    HD3  ARG  12           HD3      ARG  12  10.219  -8.828   3.045
   91    HE   ARG  12           HE       ARG  12   8.173  -9.786   1.756
   92   HH11  ARG  12          HH11      ARG  12  11.599 -10.603   1.308
   93   HH12  ARG  12          HH12      ARG  12  11.299 -12.157   0.717
   94   HH21  ARG  12          HH21      ARG  12   7.761 -11.923   0.962
   95   HH22  ARG  12          HH22      ARG  12   9.048 -12.953   0.534
   96    H    ASP  13           H        ASP  13   6.154  -7.367  -0.876
   97    HA   ASP  13           HA       ASP  13   4.073  -5.719  -0.187
   98    HB2  ASP  13           HB2      ASP  13   4.240  -8.684  -0.564
   99    HB3  ASP  13           HB3      ASP  13   2.752  -7.769  -0.452
  100    H    SER  14           H        SER  14   5.683  -8.225   1.549
  101    HA   SER  14           HA       SER  14   3.789  -8.463   3.614
  102    HB2  SER  14           HB2      SER  14   5.620  -9.561   4.850
  103    HB3  SER  14           HB3      SER  14   5.244 -10.292   3.280
  104    HG   SER  14           HG       SER  14   7.504  -9.880   3.980
  105    H    ASP  15           H        ASP  15   6.407  -6.227   3.120
  106    HA   ASP  15           HA       ASP  15   6.114  -5.393   5.874
  107    HB2  ASP  15           HB2      ASP  15   7.887  -3.609   5.440
  108    HB3  ASP  15           HB3      ASP  15   8.412  -5.273   5.413
  109    H    CYS  16           H        CYS  16   4.182  -4.978   3.547
  110    HA   CYS  16           HA       CYS  16   3.685  -2.200   4.083
  111    HB2  CYS  16           HB2      CYS  16   2.450  -4.220   2.242
  112    HB3  CYS  16           HB3      CYS  16   1.779  -2.608   2.485
  113    HA   PRO  17           HA       PRO  17   1.079  -2.965   7.554
  114    HB2  PRO  17           HB2      PRO  17  -0.577  -0.785   7.328
  115    HB3  PRO  17           HB3      PRO  17   1.065  -0.715   7.977
  116    HG2  PRO  17           HG2      PRO  17   0.098  -0.088   5.212
  117    HG3  PRO  17           HG3      PRO  17   1.236   0.818   6.228
  118    HD2  PRO  17           HD2      PRO  17   2.112  -0.752   4.273
  119    HD3  PRO  17           HD3      PRO  17   2.972  -0.674   5.827
  120    H    GLY  18           H        GLY  18  -0.947  -3.691   8.144
  121    HA2  GLY  18           HA2      GLY  18  -2.998  -4.672   7.924
  122    HA3  GLY  18           HA3      GLY  18  -3.288  -3.566   6.586
  123    H    ALA  19           H        ALA  19  -3.603  -4.472   4.719
  124    HA   ALA  19           HA       ALA  19  -2.266  -7.012   4.126
  125    HB1  ALA  19           HB1      ALA  19  -5.064  -6.207   3.302
  126    HB2  ALA  19           HB2      ALA  19  -4.657  -7.399   4.536
  127    HB3  ALA  19           HB3      ALA  19  -4.240  -7.698   2.849
  128    H    CYS  20           H        CYS  20  -1.870  -3.988   3.582
  129    HA   CYS  20           HA       CYS  20  -2.284  -3.441   0.880
  130    HB2  CYS  20           HB2      CYS  20  -0.199  -2.469   2.810
  131    HB3  CYS  20           HB3      CYS  20  -0.407  -1.819   1.192
  132    H    ILE  21           H        ILE  21  -0.795  -3.402  -0.823
  133    HA   ILE  21           HA       ILE  21   1.318  -5.408  -0.626
  134    HB   ILE  21           HB       ILE  21   1.043  -5.782  -3.015
  135   HG12  ILE  21          HG12      ILE  21  -1.267  -3.818  -2.913
  136   HG13  ILE  21          HG13      ILE  21   0.312  -3.482  -3.611
  137   HG21  ILE  21          HG21      ILE  21  -1.210  -6.799  -3.020
  138   HG22  ILE  21          HG22      ILE  21  -1.579  -5.930  -1.529
  139   HG23  ILE  21          HG23      ILE  21  -0.303  -7.148  -1.548
  140   HD11  ILE  21          HD11      ILE  21  -1.636  -5.569  -4.578
  141   HD12  ILE  21          HD12      ILE  21  -0.063  -5.214  -5.292
  142   HD13  ILE  21          HD13      ILE  21  -1.340  -4.000  -5.326
  143    H    CYS  22           H        CYS  22   2.990  -4.909  -2.382
  144    HA   CYS  22           HA       CYS  22   3.841  -2.154  -1.989
  145    HB2  CYS  22           HB2      CYS  22   5.463  -3.949  -1.542
  146    HB3  CYS  22           HB3      CYS  22   5.265  -4.574  -3.164
  147    H    ARG  23           H        ARG  23   2.862  -0.784  -3.428
  148    HA   ARG  23           HA       ARG  23   1.975  -1.684  -5.950
  149    HB2  ARG  23           HB2      ARG  23   2.198   1.079  -4.806
  150    HB3  ARG  23           HB3      ARG  23   1.309   0.637  -6.243
  151    HG2  ARG  23           HG2      ARG  23   0.743  -0.347  -3.477
  152    HG3  ARG  23           HG3      ARG  23  -0.125   0.946  -4.279
  153    HD2  ARG  23           HD2      ARG  23  -0.010  -1.981  -5.033
  154    HD3  ARG  23           HD3      ARG  23  -1.411  -1.094  -4.448
  155    HE   ARG  23           HE       ARG  23  -0.232  -0.275  -6.995
  156   HH11  ARG  23          HH11      ARG  23  -2.966  -1.708  -5.277
  157   HH12  ARG  23          HH12      ARG  23  -3.883  -1.974  -6.671
  158   HH21  ARG  23          HH21      ARG  23  -1.538  -0.595  -8.927
  159   HH22  ARG  23          HH22      ARG  23  -3.089  -1.291  -8.768
  160    H    GLY  24           H        GLY  24   2.486  -0.387  -7.900
  161    HA2  GLY  24           HA2      GLY  24   5.243  -0.721  -8.537
  162    HA3  GLY  24           HA3      GLY  24   3.992  -0.102  -9.595
  163    H    ASN  25           H        ASN  25   3.775   1.803  -7.012
  164    HA   ASN  25           HA       ASN  25   5.434   3.851  -8.221
  165    HB2  ASN  25           HB2      ASN  25   4.287   5.432  -6.774
  166    HB3  ASN  25           HB3      ASN  25   3.095   4.390  -7.533
  167   HD21  ASN  25          HD21      ASN  25   2.873   5.972  -5.147
  168   HD22  ASN  25          HD22      ASN  25   2.471   4.912  -3.858
  169    H    GLY  26           H        GLY  26   5.522   1.607  -5.652
  170    HA2  GLY  26           HA2      GLY  26   7.641   1.064  -4.665
  171    HA3  GLY  26           HA3      GLY  26   8.076   2.770  -4.753
  172    H    TYR  27           H        TYR  27   4.868   2.237  -3.863
  173    HA   TYR  27           HA       TYR  27   5.508   2.537  -1.065
  174    HB2  TYR  27           HB2      TYR  27   3.717   4.035  -2.858
  175    HB3  TYR  27           HB3      TYR  27   3.457   4.083  -1.101
  176    HD1  TYR  27           HD2      TYR  27   5.336   5.061   0.295
  177    HD2  TYR  27           HD1      TYR  27   5.301   5.412  -3.934
  178    HE1  TYR  27           HE2      TYR  27   6.957   6.862   0.449
  179    HE2  TYR  27           HE1      TYR  27   6.946   7.236  -3.797
  180    HH   TYR  27           HH       TYR  27   8.629   7.957  -0.900
  181    H    CYS  28           H        CYS  28   3.704   1.988   0.288
  182    HA   CYS  28           HA       CYS  28   2.485  -0.450  -0.588
  183    HB2  CYS  28           HB2      CYS  28   2.333   1.054   2.015
  184    HB3  CYS  28           HB3      CYS  28   1.658  -0.548   1.732
  185    H    GLY  29           H        GLY  29   0.381  -0.830  -0.989
  186    HA2  GLY  29           HA2      GLY  29  -1.690   0.980  -0.232
  187    HA3  GLY  29           HA3      GLY  29  -1.350   0.999  -1.966
  188    H    GLU  30           H        GLU  30  -3.775   0.104  -0.868
  189    HA   GLU  30           HA       GLU  30  -3.895  -2.668  -0.674
  190    HB2  GLU  30           HB2      GLU  30  -5.652  -1.301   0.163
  191    HB3  GLU  30           HB3      GLU  30  -5.981  -0.601  -1.423
  192    HG2  GLU  30           HG2      GLU  30  -7.723  -2.134  -0.673
  193    HG3  GLU  30           HG3      GLU  30  -6.917  -2.752  -2.108
  194    H    ALA  31           H        ALA  31  -5.033  -4.053  -2.293
  195    HA   ALA  31           HA       ALA  31  -3.651  -3.854  -4.811
  196    HB1  ALA  31           HB1      ALA  31  -3.938  -6.030  -3.694
  197    HB2  ALA  31           HB2      ALA  31  -4.607  -6.027  -5.324
  198    HB3  ALA  31           HB3      ALA  31  -5.681  -5.912  -3.934
  199    H    ILE  32           H        ILE  32  -7.027  -3.890  -3.797
  200    HA   ILE  32           HA       ILE  32  -7.641  -2.535  -6.320
  201    HB   ILE  32           HB       ILE  32  -9.609  -3.915  -4.554
  202   HG12  ILE  32          HG12      ILE  32  -8.085  -5.651  -5.401
  203   HG13  ILE  32          HG13      ILE  32  -9.670  -5.827  -6.143
  204   HG21  ILE  32          HG21      ILE  32  -9.846  -2.974  -7.409
  205   HG22  ILE  32          HG22      ILE  32 -10.598  -2.251  -5.988
  206   HG23  ILE  32          HG23      ILE  32 -11.105  -3.849  -6.535
  207   HD11  ILE  32          HD11      ILE  32  -8.817  -4.718  -8.154
  208   HD12  ILE  32          HD12      ILE  32  -7.919  -6.185  -7.765
  209   HD13  ILE  32          HD13      ILE  32  -7.224  -4.602  -7.405
  210    H    TYR  33           H        TYR  33  -8.228  -0.546  -6.030
  211    HA   TYR  33           HA       TYR  33  -8.236   0.643  -3.428
  212    HB2  TYR  33           HB2      TYR  33  -8.918   1.929  -6.070
  213    HB3  TYR  33           HB3      TYR  33  -8.506   2.742  -4.569
  214    HD1  TYR  33           HD1      TYR  33  -6.133   1.829  -3.557
  215    HD2  TYR  33           HD2      TYR  33  -7.273   1.875  -7.656
  216    HE1  TYR  33           HE1      TYR  33  -3.777   1.822  -4.210
  217    HE2  TYR  33           HE2      TYR  33  -4.931   1.867  -8.317
  218    HH   TYR  33           HH       TYR  33  -2.779   2.469  -7.406
  219    H    ALA  34           H        ALA  34 -10.624  -0.264  -5.754
  220    HA   ALA  34           HA       ALA  34 -12.818   1.103  -4.606
  221    HB1  ALA  34           HB1      ALA  34 -14.208  -0.347  -5.995
  222    HB2  ALA  34           HB2      ALA  34 -12.818  -1.381  -6.318
  223    HB3  ALA  34           HB3      ALA  34 -12.841   0.277  -6.919
  224    H    ALA  35           H        ALA  35 -11.207  -1.849  -3.908
  225    HA   ALA  35           HA       ALA  35 -13.314  -2.958  -2.306
  226    HB1  ALA  35           HB1      ALA  35 -10.452  -3.836  -2.624
  227    HB2  ALA  35           HB2      ALA  35 -11.811  -4.410  -3.592
  228    HB3  ALA  35           HB3      ALA  35 -11.748  -4.753  -1.861
  229    HA   PRO  36           HA       PRO  36 -11.570  -0.773   1.225
  230    HB2  PRO  36           HB2      PRO  36 -13.931  -1.383   2.686
  231    HB3  PRO  36           HB3      PRO  36 -13.388   0.194   2.103
  232    HG2  PRO  36           HG2      PRO  36 -15.628  -1.128   1.130
  233    HG3  PRO  36           HG3      PRO  36 -14.717   0.094   0.227
  234    HD2  PRO  36           HD2      PRO  36 -14.614  -2.883   0.022
  235    HD3  PRO  36           HD3      PRO  36 -14.479  -1.649  -1.252
  236    H    PHE  37           H        PHE  37 -10.139  -2.293   1.699
  237    HA   PHE  37           HA       PHE  37 -11.003  -4.180   3.737
  238    HB2  PHE  37           HB2      PHE  37 -10.616  -5.443   1.586
  239    HB3  PHE  37           HB3      PHE  37  -8.932  -4.936   1.659
  240    HD1  PHE  37           HD1      PHE  37 -11.536  -6.882   3.402
  241    HD2  PHE  37           HD2      PHE  37  -7.380  -6.096   3.026
  242    HE1  PHE  37           HE1      PHE  37 -11.053  -8.813   4.833
  243    HE2  PHE  37           HE2      PHE  37  -6.883  -8.034   4.458
  244    HZ   PHE  37           HZ       PHE  37  -8.724  -9.395   5.367
  245    H    ALA  38           H        ALA  38  -7.824  -3.467   2.314
  246    HA   ALA  38           HA       ALA  38  -7.240  -2.006   4.746
  247    HB1  ALA  38           HB1      ALA  38  -5.456  -4.189   3.706
  248    HB2  ALA  38           HB2      ALA  38  -6.515  -4.327   5.107
  249    HB3  ALA  38           HB3      ALA  38  -5.172  -3.182   5.129
  250    H    ARG  39           H        ARG  39  -7.284  -0.177   3.540
  251    HA   ARG  39           HA       ARG  39  -5.354   0.104   1.372
  252    HB2  ARG  39           HB2      ARG  39  -7.571   1.921   2.334
  253    HB3  ARG  39           HB3      ARG  39  -6.485   2.256   0.993
  254    HG2  ARG  39           HG2      ARG  39  -7.364   0.330  -0.214
  255    HG3  ARG  39           HG3      ARG  39  -8.439  -0.028   1.136
  256    HD2  ARG  39           HD2      ARG  39  -9.666   1.122  -0.589
  257    HD3  ARG  39           HD3      ARG  39  -9.503   2.161   0.822
  258    HE   ARG  39           HE       ARG  39  -7.426   2.674  -1.049
  259   HH11  ARG  39          HH11      ARG  39 -10.882   3.259  -0.480
  260   HH12  ARG  39          HH12      ARG  39 -10.967   4.645  -1.465
  261   HH21  ARG  39          HH21      ARG  39  -7.566   4.631  -2.380
  262   HH22  ARG  39          HH22      ARG  39  -9.037   5.463  -2.548
  Start of MODEL    2
    1    H1   CYS   1           H        CYS   1  -3.470   2.286   2.804
    2    HA   CYS   1           HA       CYS   1  -1.736   2.895   5.103
    3    HB2  CYS   1           HB2      CYS   1  -1.066   1.331   2.579
    4    HB3  CYS   1           HB3      CYS   1   0.079   1.727   3.856
    5    H    GLU   2           H        GLU   2  -3.284   4.567   3.462
    6    HA   GLU   2           HA       GLU   2  -1.478   5.867   1.606
    7    HB2  GLU   2           HB2      GLU   2  -4.335   6.442   2.325
    8    HB3  GLU   2           HB3      GLU   2  -3.433   7.177   1.015
    9    HG2  GLU   2           HG2      GLU   2  -3.264   5.110  -0.170
   10    HG3  GLU   2           HG3      GLU   2  -3.956   4.220   1.185
   11    H    ALA   3           H        ALA   3  -0.753   7.898   1.931
   12    HA   ALA   3           HA       ALA   3  -1.362   9.433   4.240
   13    HB1  ALA   3           HB1      ALA   3   1.268   7.972   4.007
   14    HB2  ALA   3           HB2      ALA   3   0.070   7.777   5.284
   15    HB3  ALA   3           HB3      ALA   3   0.970   9.285   5.136
   16    H    ILE   4           H        ILE   4  -0.954  11.459   3.708
   17    HA   ILE   4           HA       ILE   4   0.187  11.871   1.078
   18    HB   ILE   4           HB       ILE   4  -1.408  13.826   2.774
   19   HG12  ILE   4          HG12      ILE   4  -2.244  12.137   0.400
   20   HG13  ILE   4          HG13      ILE   4  -2.685  11.830   2.073
   21   HG21  ILE   4          HG21      ILE   4  -0.615  13.995  -0.145
   22   HG22  ILE   4          HG22      ILE   4   0.054  14.978   1.154
   23   HG23  ILE   4          HG23      ILE   4  -1.646  15.142   0.711
   24   HD11  ILE   4          HD11      ILE   4  -3.946  13.918   2.120
   25   HD12  ILE   4          HD12      ILE   4  -4.504  12.865   0.820
   26   HD13  ILE   4          HD13      ILE   4  -3.464  14.245   0.458
   27    H    TYR   5           H        TYR   5   1.009  12.626   4.363
   28    HA   TYR   5           HA       TYR   5   3.040  14.511   3.445
   29    HB2  TYR   5           HB2      TYR   5   1.814  14.858   5.621
   30    HB3  TYR   5           HB3      TYR   5   2.626  13.435   6.233
   31    HD1  TYR   5           HD1      TYR   5   3.283  16.847   4.923
   32    HD2  TYR   5           HD2      TYR   5   4.830  13.541   7.109
   33    HE1  TYR   5           HE1      TYR   5   5.209  18.193   5.578
   34    HE2  TYR   5           HE2      TYR   5   6.764  14.886   7.774
   35    HH   TYR   5           HH       TYR   5   6.861  18.181   7.510
   36    H    ALA   6           H        ALA   6   2.777  11.397   4.870
   37    HA   ALA   6           HA       ALA   6   5.459  10.820   3.859
   38    HB1  ALA   6           HB1      ALA   6   4.609  10.132   6.675
   39    HB2  ALA   6           HB2      ALA   6   5.768  11.383   6.225
   40    HB3  ALA   6           HB3      ALA   6   6.136   9.686   5.915
   41    H    ALA   7           H        ALA   7   4.467   9.701   2.238
   42    HA   ALA   7           HA       ALA   7   2.676   7.569   2.720
   43    HB1  ALA   7           HB1      ALA   7   4.406   8.163   0.317
   44    HB2  ALA   7           HB2      ALA   7   2.754   8.732   0.569
   45    HB3  ALA   7           HB3      ALA   7   3.076   7.009   0.364
   46    HA   PRO   8           HA       PRO   8   5.772   4.755   4.206
   47    HB2  PRO   8           HB2      PRO   8   4.205   2.518   4.147
   48    HB3  PRO   8           HB3      PRO   8   4.175   3.705   5.455
   49    HG2  PRO   8           HG2      PRO   8   2.331   3.379   3.136
   50    HG3  PRO   8           HG3      PRO   8   1.952   3.792   4.814
   51    HD2  PRO   8           HD2      PRO   8   2.032   5.627   2.849
   52    HD3  PRO   8           HD3      PRO   8   2.495   6.008   4.520
   53    H    LYS   9           H        LYS   9   7.266   4.378   2.799
   54    HA   LYS   9           HA       LYS   9   6.728   3.210   0.228
   55    HB2  LYS   9           HB2      LYS   9   9.230   3.371  -0.049
   56    HB3  LYS   9           HB3      LYS   9   8.387   4.892   0.208
   57    HG2  LYS   9           HG2      LYS   9   9.077   4.854   2.554
   58    HG3  LYS   9           HG3      LYS   9   9.950   3.352   2.272
   59    HD2  LYS   9           HD2      LYS   9  11.349   4.499   0.606
   60    HD3  LYS   9           HD3      LYS   9  10.467   5.997   0.908
   61    HE2  LYS   9           HE2      LYS   9  12.579   5.970   2.105
   62    HE3  LYS   9           HE3      LYS   9  11.224   5.971   3.235
   63    HZ1  LYS   9           HZ1      LYS   9  12.816   3.610   2.421
   64    HZ2  LYS   9           HZ2      LYS   9  11.525   3.565   3.483
   65    HZ3  LYS   9           HZ3      LYS   9  12.929   4.399   3.907
   66    H    CYS  10           H        CYS  10   7.719   1.268  -0.557
   67    HA   CYS  10           HA       CYS  10   8.279  -0.694   1.540
   68    HB2  CYS  10           HB2      CYS  10   6.820  -2.284   0.311
   69    HB3  CYS  10           HB3      CYS  10   5.950  -0.943   1.055
   70    H    ARG  11           H        ARG  11   9.509  -2.428   0.882
   71    HA   ARG  11           HA       ARG  11  10.935  -2.173  -1.688
   72    HB2  ARG  11           HB2      ARG  11  11.516  -3.894   0.720
   73    HB3  ARG  11           HB3      ARG  11  12.591  -3.561  -0.627
   74    HG2  ARG  11           HG2      ARG  11  13.032  -1.393   0.119
   75    HG3  ARG  11           HG3      ARG  11  11.622  -1.387   1.187
   76    HD2  ARG  11           HD2      ARG  11  14.069  -3.111   1.491
   77    HD3  ARG  11           HD3      ARG  11  13.667  -1.694   2.470
   78    HE   ARG  11           HE       ARG  11  11.476  -3.222   2.772
   79   HH11  ARG  11          HH11      ARG  11  14.898  -4.062   3.065
   80   HH12  ARG  11          HH12      ARG  11  14.646  -5.208   4.295
   81   HH21  ARG  11          HH21      ARG  11  11.137  -4.760   4.430
   82   HH22  ARG  11          HH22      ARG  11  12.445  -5.655   5.092
   83    H    ARG  12           H        ARG  12   9.120  -4.148   0.521
   84    HA   ARG  12           HA       ARG  12   8.325  -6.036  -1.561
   85    HB2  ARG  12           HB2      ARG  12   8.480  -7.797   0.223
   86    HB3  ARG  12           HB3      ARG  12  10.002  -7.263  -0.464
   87    HG2  ARG  12           HG2      ARG  12  10.261  -5.774   1.538
   88    HG3  ARG  12           HG3      ARG  12   8.818  -6.531   2.207
   89    HD2  ARG  12           HD2      ARG  12  10.858  -7.530   3.095
   90    HD3  ARG  12           HD3      ARG  12   9.922  -8.699   2.164
   91    HE   ARG  12           HE       ARG  12  11.564  -7.969   0.300
   92   HH11  ARG  12          HH11      ARG  12  12.447  -8.323   3.747
   93   HH12  ARG  12          HH12      ARG  12  14.011  -8.870   3.386
   94   HH21  ARG  12          HH21      ARG  12  13.696  -8.682  -0.128
   95   HH22  ARG  12          HH22      ARG  12  14.746  -9.095   1.153
   96    H    ASP  13           H        ASP  13   6.465  -7.245  -0.940
   97    HA   ASP  13           HA       ASP  13   4.379  -5.507  -0.270
   98    HB2  ASP  13           HB2      ASP  13   4.582  -8.454  -0.697
   99    HB3  ASP  13           HB3      ASP  13   3.089  -7.669  -0.249
  100    H    SER  14           H        SER  14   6.186  -7.804   1.483
  101    HA   SER  14           HA       SER  14   4.475  -7.966   3.724
  102    HB2  SER  14           HB2      SER  14   6.602  -8.790   4.837
  103    HB3  SER  14           HB3      SER  14   5.918  -9.717   3.477
  104    HG   SER  14           HG       SER  14   7.733  -9.481   2.576
  105    H    ASP  15           H        ASP  15   6.583  -5.562   2.710
  106    HA   ASP  15           HA       ASP  15   7.059  -4.307   5.280
  107    HB2  ASP  15           HB2      ASP  15   7.156  -3.055   2.512
  108    HB3  ASP  15           HB3      ASP  15   7.564  -2.200   3.985
  109    H    CYS  16           H        CYS  16   4.397  -4.599   3.236
  110    HA   CYS  16           HA       CYS  16   3.114  -2.237   4.282
  111    HB2  CYS  16           HB2      CYS  16   2.274  -4.209   2.164
  112    HB3  CYS  16           HB3      CYS  16   1.503  -2.669   2.539
  113    HA   PRO  17           HA       PRO  17   1.062  -5.176   7.003
  114    HB2  PRO  17           HB2      PRO  17   0.103  -3.433   8.734
  115    HB3  PRO  17           HB3      PRO  17   1.849  -3.692   8.602
  116    HG2  PRO  17           HG2      PRO  17   0.175  -1.459   7.544
  117    HG3  PRO  17           HG3      PRO  17   1.789  -1.408   8.273
  118    HD2  PRO  17           HD2      PRO  17   1.236  -1.414   5.529
  119    HD3  PRO  17           HD3      PRO  17   2.803  -1.785   6.280
  120    H    GLY  18           H        GLY  18  -1.191  -5.049   8.146
  121    HA2  GLY  18           HA2      GLY  18  -3.464  -5.023   8.044
  122    HA3  GLY  18           HA3      GLY  18  -3.328  -3.643   6.961
  123    H    ALA  19           H        ALA  19  -3.657  -3.910   4.890
  124    HA   ALA  19           HA       ALA  19  -3.838  -6.608   3.794
  125    HB1  ALA  19           HB1      ALA  19  -5.977  -6.084   2.766
  126    HB2  ALA  19           HB2      ALA  19  -5.964  -4.489   3.515
  127    HB3  ALA  19           HB3      ALA  19  -6.089  -5.933   4.519
  128    H    CYS  20           H        CYS  20  -2.184  -3.970   3.666
  129    HA   CYS  20           HA       CYS  20  -2.656  -3.094   0.964
  130    HB2  CYS  20           HB2      CYS  20  -0.548  -2.327   2.973
  131    HB3  CYS  20           HB3      CYS  20  -0.920  -1.489   1.471
  132    H    ILE  21           H        ILE  21  -1.090  -3.200  -0.646
  133    HA   ILE  21           HA       ILE  21   0.953  -5.256  -0.286
  134    HB   ILE  21           HB       ILE  21   0.721  -5.748  -2.696
  135   HG12  ILE  21          HG12      ILE  21  -1.679  -3.888  -2.607
  136   HG13  ILE  21          HG13      ILE  21  -0.157  -3.546  -3.421
  137   HG21  ILE  21          HG21      ILE  21  -1.847  -5.990  -1.149
  138   HG22  ILE  21          HG22      ILE  21  -0.492  -7.114  -1.108
  139   HG23  ILE  21          HG23      ILE  21  -1.440  -6.928  -2.587
  140   HD11  ILE  21          HD11      ILE  21  -0.548  -5.443  -4.913
  141   HD12  ILE  21          HD12      ILE  21  -1.843  -4.248  -5.009
  142   HD13  ILE  21          HD13      ILE  21  -2.086  -5.748  -4.111
  143    H    CYS  22           H        CYS  22   2.671  -4.882  -2.097
  144    HA   CYS  22           HA       CYS  22   3.430  -2.078  -1.793
  145    HB2  CYS  22           HB2      CYS  22   5.045  -3.816  -1.080
  146    HB3  CYS  22           HB3      CYS  22   5.088  -4.444  -2.726
  147    H    ARG  23           H        ARG  23   2.730  -0.820  -3.385
  148    HA   ARG  23           HA       ARG  23   1.944  -1.859  -5.911
  149    HB2  ARG  23           HB2      ARG  23   2.260   0.975  -4.955
  150    HB3  ARG  23           HB3      ARG  23   1.416   0.465  -6.396
  151    HG2  ARG  23           HG2      ARG  23   0.613  -0.387  -3.629
  152    HG3  ARG  23           HG3      ARG  23  -0.059   1.016  -4.442
  153    HD2  ARG  23           HD2      ARG  23  -0.232  -1.870  -5.341
  154    HD3  ARG  23           HD3      ARG  23  -1.546  -0.897  -4.685
  155    HE   ARG  23           HE       ARG  23  -0.210  -0.126  -7.183
  156   HH11  ARG  23          HH11      ARG  23  -3.231  -0.927  -5.489
  157   HH12  ARG  23          HH12      ARG  23  -4.191  -0.686  -6.884
  158   HH21  ARG  23          HH21      ARG  23  -1.557   0.232  -9.020
  159   HH22  ARG  23          HH22      ARG  23  -3.248   0.007  -8.894
  160    H    GLY  24           H        GLY  24   2.709  -0.721  -7.926
  161    HA2  GLY  24           HA2      GLY  24   5.438  -1.391  -8.348
  162    HA3  GLY  24           HA3      GLY  24   4.376  -0.634  -9.512
  163    H    ASN  25           H        ASN  25   4.177   1.430  -7.114
  164    HA   ASN  25           HA       ASN  25   6.217   3.183  -8.221
  165    HB2  ASN  25           HB2      ASN  25   5.101   4.953  -6.976
  166    HB3  ASN  25           HB3      ASN  25   3.925   4.046  -7.912
  167   HD21  ASN  25          HD21      ASN  25   3.328   5.696  -5.738
  168   HD22  ASN  25          HD22      ASN  25   2.661   4.727  -4.474
  169    H    GLY  26           H        GLY  26   5.656   1.204  -5.483
  170    HA2  GLY  26           HA2      GLY  26   7.493   0.502  -4.152
  171    HA3  GLY  26           HA3      GLY  26   8.234   2.078  -4.411
  172    H    TYR  27           H        TYR  27   4.855   1.969  -3.759
  173    HA   TYR  27           HA       TYR  27   5.333   2.665  -0.983
  174    HB2  TYR  27           HB2      TYR  27   3.665   3.891  -3.082
  175    HB3  TYR  27           HB3      TYR  27   3.284   4.180  -1.371
  176    HD1  TYR  27           HD2      TYR  27   5.210   5.234   0.024
  177    HD2  TYR  27           HD1      TYR  27   5.200   5.199  -4.222
  178    HE1  TYR  27           HE2      TYR  27   6.851   7.043   0.015
  179    HE2  TYR  27           HE1      TYR  27   6.839   7.000  -4.255
  180    HH   TYR  27           HH       TYR  27   8.545   7.991  -1.460
  181    H    CYS  28           H        CYS  28   3.682   2.129   0.432
  182    HA   CYS  28           HA       CYS  28   2.315  -0.293  -0.249
  183    HB2  CYS  28           HB2      CYS  28   2.433   1.321   2.286
  184    HB3  CYS  28           HB3      CYS  28   1.539  -0.186   2.127
  185    H    GLY  29           H        GLY  29   0.309  -0.524  -0.861
  186    HA2  GLY  29           HA2      GLY  29  -1.735   1.326  -0.056
  187    HA3  GLY  29           HA3      GLY  29  -1.348   1.326  -1.781
  188    H    GLU  30           H        GLU  30  -3.847   0.550  -1.017
  189    HA   GLU  30           HA       GLU  30  -3.890  -2.249  -0.792
  190    HB2  GLU  30           HB2      GLU  30  -5.599  -0.935   0.261
  191    HB3  GLU  30           HB3      GLU  30  -6.049  -0.163  -1.251
  192    HG2  GLU  30           HG2      GLU  30  -7.704  -1.772  -0.425
  193    HG3  GLU  30           HG3      GLU  30  -7.083  -2.252  -1.988
  194    H    ALA  31           H        ALA  31  -5.179  -3.462  -2.485
  195    HA   ALA  31           HA       ALA  31  -3.988  -3.117  -5.089
  196    HB1  ALA  31           HB1      ALA  31  -4.533  -5.355  -4.197
  197    HB2  ALA  31           HB2      ALA  31  -5.299  -5.051  -5.760
  198    HB3  ALA  31           HB3      ALA  31  -6.250  -4.944  -4.285
  199    H    ILE  32           H        ILE  32  -6.663  -1.999  -3.528
  200    HA   ILE  32           HA       ILE  32  -8.079  -1.144  -5.911
  201    HB   ILE  32           HB       ILE  32  -8.774  -0.744  -2.967
  202   HG12  ILE  32          HG12      ILE  32  -9.866  -2.797  -4.910
  203   HG13  ILE  32          HG13      ILE  32  -8.748  -3.134  -3.598
  204   HG21  ILE  32          HG21      ILE  32  -9.838   0.905  -4.440
  205   HG22  ILE  32          HG22      ILE  32 -11.024  -0.195  -3.739
  206   HG23  ILE  32          HG23      ILE  32 -10.517  -0.404  -5.412
  207   HD11  ILE  32          HD11      ILE  32 -11.024  -3.778  -3.029
  208   HD12  ILE  32          HD12      ILE  32 -11.568  -2.121  -3.295
  209   HD13  ILE  32          HD13      ILE  32 -10.454  -2.482  -1.978
  210    H    TYR  33           H        TYR  33  -8.343   1.200  -6.190
  211    HA   TYR  33           HA       TYR  33  -5.996   2.627  -5.726
  212    HB2  TYR  33           HB2      TYR  33  -8.717   3.572  -6.615
  213    HB3  TYR  33           HB3      TYR  33  -7.268   4.572  -6.639
  214    HD1  TYR  33           HD1      TYR  33  -5.407   4.009  -8.177
  215    HD2  TYR  33           HD2      TYR  33  -9.088   1.882  -8.292
  216    HE1  TYR  33           HE1      TYR  33  -4.812   3.106 -10.368
  217    HE2  TYR  33           HE2      TYR  33  -8.507   0.973 -10.475
  218    HH   TYR  33           HH       TYR  33  -7.053   1.535 -12.358
  219    H    ALA  34           H        ALA  34  -9.191   3.314  -4.368
  220    HA   ALA  34           HA       ALA  34  -7.838   4.561  -2.096
  221    HB1  ALA  34           HB1      ALA  34 -10.088   5.326  -1.431
  222    HB2  ALA  34           HB2      ALA  34 -10.790   4.440  -2.782
  223    HB3  ALA  34           HB3      ALA  34  -9.729   5.816  -3.088
  224    H    ALA  35           H        ALA  35  -7.553   3.396  -0.292
  225    HA   ALA  35           HA       ALA  35  -8.381   0.674  -0.330
  226    HB1  ALA  35           HB1      ALA  35  -6.918   2.334   1.701
  227    HB2  ALA  35           HB2      ALA  35  -6.249   1.134   0.602
  228    HB3  ALA  35           HB3      ALA  35  -7.278   0.628   1.942
  229    HA   PRO  36           HA       PRO  36 -12.407   1.176   1.425
  230    HB2  PRO  36           HB2      PRO  36 -11.902  -1.484   2.639
  231    HB3  PRO  36           HB3      PRO  36 -13.238  -0.946   1.621
  232    HG2  PRO  36           HG2      PRO  36 -11.338  -2.499   0.620
  233    HG3  PRO  36           HG3      PRO  36 -12.035  -1.179  -0.336
  234    HD2  PRO  36           HD2      PRO  36  -9.404  -1.326   1.063
  235    HD3  PRO  36           HD3      PRO  36  -9.836  -0.595  -0.501
  236    H    PHE  37           H        PHE  37  -9.991  -0.196   3.653
  237    HA   PHE  37           HA       PHE  37 -10.892   1.669   5.668
  238    HB2  PHE  37           HB2      PHE  37 -12.353  -0.322   5.932
  239    HB3  PHE  37           HB3      PHE  37 -10.917  -1.293   6.210
  240    HD1  PHE  37           HD1      PHE  37 -12.920   1.482   7.590
  241    HD2  PHE  37           HD2      PHE  37  -9.841  -1.365   8.321
  242    HE1  PHE  37           HE1      PHE  37 -12.963   2.044   9.981
  243    HE2  PHE  37           HE2      PHE  37  -9.884  -0.803  10.707
  244    HZ   PHE  37           HZ       PHE  37 -11.446   0.904  11.539
  245    H    ALA  38           H        ALA  38  -8.911  -1.187   5.065
  246    HA   ALA  38           HA       ALA  38  -6.864  -0.208   6.818
  247    HB1  ALA  38           HB1      ALA  38  -7.259  -2.639   6.591
  248    HB2  ALA  38           HB2      ALA  38  -5.598  -2.193   6.199
  249    HB3  ALA  38           HB3      ALA  38  -6.736  -2.554   4.908
  250    H    ARG  39           H        ARG  39  -6.892   1.762   5.647
  251    HA   ARG  39           HA       ARG  39  -5.532   1.914   3.128
  252    HB2  ARG  39           HB2      ARG  39  -5.964   4.189   5.048
  253    HB3  ARG  39           HB3      ARG  39  -5.704   4.268   3.323
  254    HG2  ARG  39           HG2      ARG  39  -7.960   3.162   3.007
  255    HG3  ARG  39           HG3      ARG  39  -8.170   3.305   4.744
  256    HD2  ARG  39           HD2      ARG  39  -9.276   5.127   3.636
  257    HD3  ARG  39           HD3      ARG  39  -7.911   5.733   4.571
  258    HE   ARG  39           HE       ARG  39  -7.236   5.224   1.823
  259   HH11  ARG  39          HH11      ARG  39  -8.667   7.624   4.015
  260   HH12  ARG  39          HH12      ARG  39  -8.397   8.941   2.961
  261   HH21  ARG  39          HH21      ARG  39  -6.860   7.049   0.382
  262   HH22  ARG  39          HH22      ARG  39  -7.364   8.604   0.838
  Start of MODEL    3
    1    H1   CYS   1           H        CYS   1  -4.521   1.985   3.222
    2    HA   CYS   1           HA       CYS   1  -3.023   2.098   5.648
    3    HB2  CYS   1           HB2      CYS   1  -1.825   1.553   2.901
    4    HB3  CYS   1           HB3      CYS   1  -0.916   1.890   4.367
    5    H    GLU   2           H        GLU   2  -2.881   4.185   5.929
    6    HA   GLU   2           HA       GLU   2  -3.679   5.959   3.793
    7    HB2  GLU   2           HB2      GLU   2  -3.004   6.611   6.653
    8    HB3  GLU   2           HB3      GLU   2  -3.718   7.716   5.490
    9    HG2  GLU   2           HG2      GLU   2  -4.960   5.247   6.662
   10    HG3  GLU   2           HG3      GLU   2  -5.443   6.920   6.929
   11    H    ALA   3           H        ALA   3  -2.467   7.595   2.984
   12    HA   ALA   3           HA       ALA   3   0.410   7.550   3.565
   13    HB1  ALA   3           HB1      ALA   3  -0.909   7.482   0.846
   14    HB2  ALA   3           HB2      ALA   3  -0.038   6.149   1.602
   15    HB3  ALA   3           HB3      ALA   3   0.825   7.615   1.135
   16    H    ILE   4           H        ILE   4  -1.464   9.383   4.507
   17    HA   ILE   4           HA       ILE   4  -1.420  11.643   2.681
   18    HB   ILE   4           HB       ILE   4  -2.736  11.391   5.398
   19   HG12  ILE   4          HG12      ILE   4  -3.959  11.264   2.631
   20   HG13  ILE   4          HG13      ILE   4  -3.669   9.882   3.675
   21   HG21  ILE   4          HG21      ILE   4  -3.018  13.545   3.295
   22   HG22  ILE   4          HG22      ILE   4  -2.236  13.720   4.866
   23   HG23  ILE   4          HG23      ILE   4  -3.973  13.429   4.773
   24   HD11  ILE   4          HD11      ILE   4  -5.245  10.756   5.296
   25   HD12  ILE   4          HD12      ILE   4  -6.004  10.604   3.706
   26   HD13  ILE   4          HD13      ILE   4  -5.493  12.185   4.298
   27    H    TYR   5           H        TYR   5  -0.414  10.886   5.948
   28    HA   TYR   5           HA       TYR   5   1.114  13.396   6.006
   29    HB2  TYR   5           HB2      TYR   5  -0.344  12.663   7.919
   30    HB3  TYR   5           HB3      TYR   5   0.777  11.349   8.181
   31    HD1  TYR   5           HD1      TYR   5   0.552  15.041   8.169
   32    HD2  TYR   5           HD2      TYR   5   2.782  11.644   9.408
   33    HE1  TYR   5           HE1      TYR   5   1.965  16.485   9.550
   34    HE2  TYR   5           HE2      TYR   5   4.202  13.078  10.794
   35    HH   TYR   5           HH       TYR   5   3.416  16.256  11.547
   36    H    ALA   6           H        ALA   6   1.366  10.028   6.001
   37    HA   ALA   6           HA       ALA   6   4.199  10.114   5.403
   38    HB1  ALA   6           HB1      ALA   6   4.156   9.909   7.848
   39    HB2  ALA   6           HB2      ALA   6   4.779   8.439   7.101
   40    HB3  ALA   6           HB3      ALA   6   3.127   8.484   7.714
   41    H    ALA   7           H        ALA   7   4.071   9.180   3.530
   42    HA   ALA   7           HA       ALA   7   2.185   7.121   2.898
   43    HB1  ALA   7           HB1      ALA   7   3.175   7.212   0.678
   44    HB2  ALA   7           HB2      ALA   7   4.478   8.222   1.296
   45    HB3  ALA   7           HB3      ALA   7   2.825   8.836   1.273
   46    HA   PRO   8           HA       PRO   8   4.910   3.910   4.454
   47    HB2  PRO   8           HB2      PRO   8   2.953   2.090   3.235
   48    HB3  PRO   8           HB3      PRO   8   3.446   2.218   4.923
   49    HG2  PRO   8           HG2      PRO   8   1.025   3.032   4.089
   50    HG3  PRO   8           HG3      PRO   8   1.895   3.858   5.390
   51    HD2  PRO   8           HD2      PRO   8   1.568   4.648   2.528
   52    HD3  PRO   8           HD3      PRO   8   1.556   5.644   4.003
   53    H    LYS   9           H        LYS   9   6.659   3.561   3.341
   54    HA   LYS   9           HA       LYS   9   6.621   3.006   0.463
   55    HB2  LYS   9           HB2      LYS   9   8.919   3.354   2.415
   56    HB3  LYS   9           HB3      LYS   9   9.069   3.200   0.675
   57    HG2  LYS   9           HG2      LYS   9   7.972   5.327   0.349
   58    HG3  LYS   9           HG3      LYS   9   7.669   5.469   2.081
   59    HD2  LYS   9           HD2      LYS   9  10.115   5.449   2.475
   60    HD3  LYS   9           HD3      LYS   9  10.369   5.374   0.734
   61    HE2  LYS   9           HE2      LYS   9   8.940   7.617   2.163
   62    HE3  LYS   9           HE3      LYS   9  10.635   7.653   1.700
   63    HZ1  LYS   9           HZ1      LYS   9   9.325   8.805   0.071
   64    HZ2  LYS   9           HZ2      LYS   9   8.313   7.506  -0.187
   65    HZ3  LYS   9           HZ3      LYS   9   9.934   7.412  -0.616
   66    H    CYS  10           H        CYS  10   7.828   1.135  -0.333
   67    HA   CYS  10           HA       CYS  10   8.276  -1.016   1.564
   68    HB2  CYS  10           HB2      CYS  10   6.821  -2.527   0.235
   69    HB3  CYS  10           HB3      CYS  10   5.944  -1.270   1.104
   70    H    ARG  11           H        ARG  11   9.422  -2.735   0.686
   71    HA   ARG  11           HA       ARG  11  10.404  -2.442  -2.076
   72    HB2  ARG  11           HB2      ARG  11  11.736  -3.724   0.317
   73    HB3  ARG  11           HB3      ARG  11  12.343  -3.840  -1.325
   74    HG2  ARG  11           HG2      ARG  11  12.691  -1.445  -1.392
   75    HG3  ARG  11           HG3      ARG  11  12.028  -1.292   0.240
   76    HD2  ARG  11           HD2      ARG  11  14.461  -1.282   0.269
   77    HD3  ARG  11           HD3      ARG  11  13.814  -2.698   1.091
   78    HE   ARG  11           HE       ARG  11  14.456  -3.132  -1.671
   79   HH11  ARG  11          HH11      ARG  11  15.667  -3.200   1.630
   80   HH12  ARG  11          HH12      ARG  11  16.977  -4.230   1.292
   81   HH21  ARG  11          HH21      ARG  11  16.232  -4.593  -2.153
   82   HH22  ARG  11          HH22      ARG  11  17.286  -5.078  -0.919
   83    H    ARG  12           H        ARG  12   9.247  -4.490   0.496
   84    HA   ARG  12           HA       ARG  12   8.289  -6.389  -1.494
   85    HB2  ARG  12           HB2      ARG  12   8.460  -8.077   0.391
   86    HB3  ARG  12           HB3      ARG  12   9.958  -7.619  -0.395
   87    HG2  ARG  12           HG2      ARG  12  10.346  -6.012   1.475
   88    HG3  ARG  12           HG3      ARG  12   8.895  -6.637   2.247
   89    HD2  ARG  12           HD2      ARG  12   9.915  -8.831   2.412
   90    HD3  ARG  12           HD3      ARG  12  11.355  -8.240   1.576
   91    HE   ARG  12           HE       ARG  12  10.740  -6.646   3.815
   92   HH11  ARG  12          HH11      ARG  12  12.151  -9.775   2.960
   93   HH12  ARG  12          HH12      ARG  12  13.212  -9.851   4.288
   94   HH21  ARG  12          HH21      ARG  12  12.238  -6.720   5.647
   95   HH22  ARG  12          HH22      ARG  12  13.268  -8.069   5.856
   96    H    ASP  13           H        ASP  13   6.402  -7.485  -0.857
   97    HA   ASP  13           HA       ASP  13   4.382  -5.674  -0.210
   98    HB2  ASP  13           HB2      ASP  13   4.479  -8.646  -0.499
   99    HB3  ASP  13           HB3      ASP  13   3.005  -7.768  -0.184
  100    H    SER  14           H        SER  14   6.091  -8.042   1.538
  101    HA   SER  14           HA       SER  14   4.472  -8.191   3.814
  102    HB2  SER  14           HB2      SER  14   6.654  -9.052   4.825
  103    HB3  SER  14           HB3      SER  14   5.891  -9.951   3.489
  104    HG   SER  14           HG       SER  14   7.570  -9.563   2.314
  105    H    ASP  15           H        ASP  15   6.574  -5.776   2.793
  106    HA   ASP  15           HA       ASP  15   7.137  -4.591   5.395
  107    HB2  ASP  15           HB2      ASP  15   7.229  -3.217   2.693
  108    HB3  ASP  15           HB3      ASP  15   7.847  -2.564   4.194
  109    H    CYS  16           H        CYS  16   4.454  -4.741   3.383
  110    HA   CYS  16           HA       CYS  16   3.450  -2.148   4.081
  111    HB2  CYS  16           HB2      CYS  16   2.416  -4.352   2.339
  112    HB3  CYS  16           HB3      CYS  16   1.593  -2.815   2.596
  113    HA   PRO  17           HA       PRO  17   1.163  -3.812   7.487
  114    HB2  PRO  17           HB2      PRO  17  -0.189  -1.570   8.133
  115    HB3  PRO  17           HB3      PRO  17   1.538  -1.746   8.467
  116    HG2  PRO  17           HG2      PRO  17   0.178  -0.302   6.233
  117    HG3  PRO  17           HG3      PRO  17   1.572   0.202   7.205
  118    HD2  PRO  17           HD2      PRO  17   1.788  -0.870   4.711
  119    HD3  PRO  17           HD3      PRO  17   3.045  -1.029   5.953
  120    H    GLY  18           H        GLY  18  -1.205  -3.615   8.222
  121    HA2  GLY  18           HA2      GLY  18  -3.400  -4.103   7.882
  122    HA3  GLY  18           HA3      GLY  18  -3.300  -3.062   6.467
  123    H    ALA  19           H        ALA  19  -3.813  -3.993   4.686
  124    HA   ALA  19           HA       ALA  19  -2.912  -6.730   4.207
  125    HB1  ALA  19           HB1      ALA  19  -5.624  -5.614   3.500
  126    HB2  ALA  19           HB2      ALA  19  -5.300  -6.747   4.810
  127    HB3  ALA  19           HB3      ALA  19  -5.037  -7.239   3.137
  128    H    CYS  20           H        CYS  20  -2.076  -3.926   3.554
  129    HA   CYS  20           HA       CYS  20  -2.726  -3.467   0.802
  130    HB2  CYS  20           HB2      CYS  20  -0.615  -2.247   2.564
  131    HB3  CYS  20           HB3      CYS  20  -1.195  -1.618   1.029
  132    H    ILE  21           H        ILE  21  -1.250  -3.618  -0.927
  133    HA   ILE  21           HA       ILE  21   1.067  -5.327  -0.403
  134    HB   ILE  21           HB       ILE  21   1.037  -5.829  -2.836
  135   HG12  ILE  21          HG12      ILE  21  -1.682  -4.480  -2.809
  136   HG13  ILE  21          HG13      ILE  21  -0.235  -3.837  -3.567
  137   HG21  ILE  21          HG21      ILE  21  -0.868  -7.406  -2.765
  138   HG22  ILE  21          HG22      ILE  21  -1.397  -6.639  -1.262
  139   HG23  ILE  21          HG23      ILE  21   0.162  -7.451  -1.337
  140   HD11  ILE  21          HD11      ILE  21  -0.200  -5.675  -5.129
  141   HD12  ILE  21          HD12      ILE  21  -1.773  -4.870  -5.166
  142   HD13  ILE  21          HD13      ILE  21  -1.584  -6.409  -4.326
  143    H    CYS  22           H        CYS  22   2.749  -4.913  -2.215
  144    HA   CYS  22           HA       CYS  22   3.462  -2.111  -1.934
  145    HB2  CYS  22           HB2      CYS  22   5.042  -3.996  -1.349
  146    HB3  CYS  22           HB3      CYS  22   5.088  -4.401  -3.062
  147    H    ARG  23           H        ARG  23   2.981  -0.751  -3.566
  148    HA   ARG  23           HA       ARG  23   2.236  -1.812  -6.128
  149    HB2  ARG  23           HB2      ARG  23   2.255   0.992  -5.032
  150    HB3  ARG  23           HB3      ARG  23   1.558   0.493  -6.564
  151    HG2  ARG  23           HG2      ARG  23  -0.014  -0.960  -5.370
  152    HG3  ARG  23           HG3      ARG  23   0.676  -0.429  -3.845
  153    HD2  ARG  23           HD2      ARG  23   0.002   1.835  -4.224
  154    HD3  ARG  23           HD3      ARG  23  -0.542   1.447  -5.852
  155    HE   ARG  23           HE       ARG  23  -1.949  -0.181  -4.126
  156   HH11  ARG  23          HH11      ARG  23  -1.593   3.297  -4.669
  157   HH12  ARG  23          HH12      ARG  23  -3.210   3.690  -4.356
  158   HH21  ARG  23          HH21      ARG  23  -4.243   0.357  -3.589
  159   HH22  ARG  23          HH22      ARG  23  -4.733   1.986  -3.735
  160    H    GLY  24           H        GLY  24   3.007  -0.431  -8.056
  161    HA2  GLY  24           HA2      GLY  24   5.804  -0.884  -8.362
  162    HA3  GLY  24           HA3      GLY  24   4.750  -0.140  -9.545
  163    H    ASN  25           H        ASN  25   4.252   1.745  -7.044
  164    HA   ASN  25           HA       ASN  25   6.302   3.652  -7.783
  165    HB2  ASN  25           HB2      ASN  25   5.033   5.199  -6.196
  166    HB3  ASN  25           HB3      ASN  25   4.168   4.686  -7.632
  167   HD21  ASN  25          HD21      ASN  25   2.267   5.251  -6.513
  168   HD22  ASN  25          HD22      ASN  25   1.556   4.210  -5.332
  169    H    GLY  26           H        GLY  26   5.706   1.360  -5.360
  170    HA2  GLY  26           HA2      GLY  26   7.383   0.627  -3.889
  171    HA3  GLY  26           HA3      GLY  26   8.126   2.222  -3.966
  172    H    TYR  27           H        TYR  27   4.756   2.025  -3.658
  173    HA   TYR  27           HA       TYR  27   4.853   2.638  -0.823
  174    HB2  TYR  27           HB2      TYR  27   3.315   3.778  -3.074
  175    HB3  TYR  27           HB3      TYR  27   2.750   3.978  -1.403
  176    HD1  TYR  27           HD2      TYR  27   4.621   4.882   0.199
  177    HD2  TYR  27           HD1      TYR  27   4.626   5.394  -4.004
  178    HE1  TYR  27           HE2      TYR  27   6.112   6.783   0.451
  179    HE2  TYR  27           HE1      TYR  27   6.140   7.304  -3.777
  180    HH   TYR  27           HH       TYR  27   6.699   8.940  -2.027
  181    H    CYS  28           H        CYS  28   3.253   1.864   0.363
  182    HA   CYS  28           HA       CYS  28   2.007  -0.554  -0.537
  183    HB2  CYS  28           HB2      CYS  28   1.826   0.881   2.091
  184    HB3  CYS  28           HB3      CYS  28   1.284  -0.759   1.764
  185    H    GLY  29           H        GLY  29  -0.083  -0.919  -0.985
  186    HA2  GLY  29           HA2      GLY  29  -2.164   0.820  -0.052
  187    HA3  GLY  29           HA3      GLY  29  -1.894   0.918  -1.793
  188    H    GLU  30           H        GLU  30  -4.180  -0.175  -0.194
  189    HA   GLU  30           HA       GLU  30  -4.152  -2.938  -0.641
  190    HB2  GLU  30           HB2      GLU  30  -5.532  -2.067   1.116
  191    HB3  GLU  30           HB3      GLU  30  -6.366  -0.971   0.031
  192    HG2  GLU  30           HG2      GLU  30  -7.796  -2.804   0.769
  193    HG3  GLU  30           HG3      GLU  30  -7.540  -2.872  -0.965
  194    H    ALA  31           H        ALA  31  -5.809  -3.939  -2.114
  195    HA   ALA  31           HA       ALA  31  -5.215  -3.240  -4.812
  196    HB1  ALA  31           HB1      ALA  31  -5.652  -5.553  -4.115
  197    HB2  ALA  31           HB2      ALA  31  -6.711  -5.063  -5.435
  198    HB3  ALA  31           HB3      ALA  31  -7.331  -5.130  -3.784
  199    H    ILE  32           H        ILE  32  -7.870  -2.662  -2.693
  200    HA   ILE  32           HA       ILE  32  -9.012  -1.012  -4.768
  201    HB   ILE  32           HB       ILE  32 -10.502  -2.262  -2.457
  202   HG12  ILE  32          HG12      ILE  32 -10.541  -3.011  -5.398
  203   HG13  ILE  32          HG13      ILE  32  -9.867  -3.977  -4.092
  204   HG21  ILE  32          HG21      ILE  32 -11.496  -0.151  -3.126
  205   HG22  ILE  32          HG22      ILE  32 -12.553  -1.485  -3.583
  206   HG23  ILE  32          HG23      ILE  32 -11.566  -0.690  -4.806
  207   HD11  ILE  32          HD11      ILE  32 -12.121  -4.266  -3.169
  208   HD12  ILE  32          HD12      ILE  32 -12.010  -4.840  -4.831
  209   HD13  ILE  32          HD13      ILE  32 -12.768  -3.286  -4.482
  210    H    TYR  33           H        TYR  33  -9.361   1.035  -4.169
  211    HA   TYR  33           HA       TYR  33  -7.822   1.975  -1.922
  212    HB2  TYR  33           HB2      TYR  33  -7.854   3.160  -4.125
  213    HB3  TYR  33           HB3      TYR  33  -9.521   3.609  -3.822
  214    HD1  TYR  33           HD1      TYR  33  -6.156   3.877  -2.221
  215    HD2  TYR  33           HD2      TYR  33  -9.936   5.718  -2.889
  216    HE1  TYR  33           HE1      TYR  33  -5.363   5.900  -1.092
  217    HE2  TYR  33           HE2      TYR  33  -9.154   7.749  -1.762
  218    HH   TYR  33           HH       TYR  33  -5.872   8.272  -1.047
  219    H    ALA  34           H        ALA  34 -11.172   1.654  -2.698
  220    HA   ALA  34           HA       ALA  34 -12.113   3.149  -0.433
  221    HB1  ALA  34           HB1      ALA  34 -14.322   2.525  -1.211
  222    HB2  ALA  34           HB2      ALA  34 -13.607   1.392  -2.358
  223    HB3  ALA  34           HB3      ALA  34 -13.329   3.125  -2.539
  224    H    ALA  35           H        ALA  35 -10.482   0.602  -0.020
  225    HA   ALA  35           HA       ALA  35 -12.185  -1.329   1.164
  226    HB1  ALA  35           HB1      ALA  35  -9.261  -0.747   1.693
  227    HB2  ALA  35           HB2      ALA  35  -9.896  -1.880   0.501
  228    HB3  ALA  35           HB3      ALA  35 -10.125  -2.189   2.221
  229    HA   PRO  36           HA       PRO  36 -13.633   1.120   4.571
  230    HB2  PRO  36           HB2      PRO  36 -13.817  -1.525   5.920
  231    HB3  PRO  36           HB3      PRO  36 -15.030  -0.250   5.747
  232    HG2  PRO  36           HG2      PRO  36 -15.150  -2.439   4.253
  233    HG3  PRO  36           HG3      PRO  36 -15.561  -0.850   3.586
  234    HD2  PRO  36           HD2      PRO  36 -13.124  -2.509   3.161
  235    HD3  PRO  36           HD3      PRO  36 -13.970  -1.409   2.055
  236    H    PHE  37           H        PHE  37 -11.569  -1.558   5.599
  237    HA   PHE  37           HA       PHE  37 -10.296   0.294   7.476
  238    HB2  PHE  37           HB2      PHE  37 -11.833  -1.095   8.746
  239    HB3  PHE  37           HB3      PHE  37 -11.129  -2.550   8.062
  240    HD1  PHE  37           HD2      PHE  37 -10.460   0.312  10.296
  241    HD2  PHE  37           HD1      PHE  37  -9.225  -3.545   9.033
  242    HE1  PHE  37           HE2      PHE  37  -8.866   0.207  12.167
  243    HE2  PHE  37           HE1      PHE  37  -7.637  -3.661  10.893
  244    HZ   PHE  37           HZ       PHE  37  -7.455  -1.773  12.468
  245    H    ALA  38           H        ALA  38  -9.936  -2.315   5.227
  246    HA   ALA  38           HA       ALA  38  -7.308  -3.115   6.016
  247    HB1  ALA  38           HB1      ALA  38  -8.911  -4.649   4.960
  248    HB2  ALA  38           HB2      ALA  38  -7.387  -4.568   4.077
  249    HB3  ALA  38           HB3      ALA  38  -8.803  -3.713   3.470
  250    H    ARG  39           H        ARG  39  -7.629  -0.385   5.360
  251    HA   ARG  39           HA       ARG  39  -6.042   0.076   2.941
  252    HB2  ARG  39           HB2      ARG  39  -7.564   1.866   4.775
  253    HB3  ARG  39           HB3      ARG  39  -6.340   2.524   3.706
  254    HG2  ARG  39           HG2      ARG  39  -7.544   1.708   1.788
  255    HG3  ARG  39           HG3      ARG  39  -8.721   0.920   2.847
  256    HD2  ARG  39           HD2      ARG  39  -9.540   3.059   1.958
  257    HD3  ARG  39           HD3      ARG  39  -9.444   3.031   3.712
  258    HE   ARG  39           HE       ARG  39  -7.394   4.361   3.529
  259   HH11  ARG  39          HH11      ARG  39  -9.461   4.261   0.693
  260   HH12  ARG  39          HH12      ARG  39  -9.150   5.856   0.215
  261   HH21  ARG  39          HH21      ARG  39  -6.895   6.532   2.873
  262   HH22  ARG  39          HH22      ARG  39  -7.589   7.179   1.455
  Start of MODEL    4
    1    H1   CYS   1           H        CYS   1  -3.305   1.850   2.792
    2    HA   CYS   1           HA       CYS   1  -1.623   3.334   4.661
    3    HB2  CYS   1           HB2      CYS   1  -0.802   2.004   2.081
    4    HB3  CYS   1           HB3      CYS   1   0.257   2.855   3.196
    5    H    GLU   2           H        GLU   2  -2.988   5.102   4.359
    6    HA   GLU   2           HA       GLU   2  -3.056   6.248   1.716
    7    HB2  GLU   2           HB2      GLU   2  -4.381   7.019   4.289
    8    HB3  GLU   2           HB3      GLU   2  -4.468   8.019   2.852
    9    HG2  GLU   2           HG2      GLU   2  -5.473   5.196   3.143
   10    HG3  GLU   2           HG3      GLU   2  -6.441   6.665   2.983
   11    H    ALA   3           H        ALA   3  -2.381   8.294   1.259
   12    HA   ALA   3           HA       ALA   3   0.109   8.917   2.554
   13    HB1  ALA   3           HB1      ALA   3   0.043   8.781   0.098
   14    HB2  ALA   3           HB2      ALA   3   0.484  10.396   0.651
   15    HB3  ALA   3           HB3      ALA   3  -1.150  10.079   0.067
   16    H    ILE   4           H        ILE   4  -0.512   9.801   4.406
   17    HA   ILE   4           HA       ILE   4  -2.287  12.106   4.403
   18    HB   ILE   4           HB       ILE   4  -0.655  11.001   6.725
   19   HG12  ILE   4          HG12      ILE   4  -2.137   9.235   5.883
   20   HG13  ILE   4          HG13      ILE   4  -2.678   9.805   7.455
   21   HG21  ILE   4          HG21      ILE   4  -3.103  12.753   6.722
   22   HG22  ILE   4          HG22      ILE   4  -1.454  13.274   7.044
   23   HG23  ILE   4          HG23      ILE   4  -2.256  12.158   8.153
   24   HD11  ILE   4          HD11      ILE   4  -3.860  10.542   4.790
   25   HD12  ILE   4          HD12      ILE   4  -4.409  11.137   6.356
   26   HD13  ILE   4          HD13      ILE   4  -4.551   9.420   5.964
   27    H    TYR   5           H        TYR   5   0.885  11.473   5.704
   28    HA   TYR   5           HA       TYR   5   1.767  14.145   4.921
   29    HB2  TYR   5           HB2      TYR   5   2.164  13.210   7.221
   30    HB3  TYR   5           HB3      TYR   5   3.182  11.994   6.486
   31    HD1  TYR   5           HD2      TYR   5   2.862  15.655   6.957
   32    HD2  TYR   5           HD1      TYR   5   5.440  12.413   6.010
   33    HE1  TYR   5           HE2      TYR   5   4.781  17.147   7.099
   34    HE2  TYR   5           HE1      TYR   5   7.365  13.889   6.155
   35    HH   TYR   5           HH       TYR   5   7.836  16.294   5.961
   36    H    ALA   6           H        ALA   6   2.138  10.793   4.461
   37    HA   ALA   6           HA       ALA   6   3.144  10.827   1.836
   38    HB1  ALA   6           HB1      ALA   6   5.213  10.171   3.956
   39    HB2  ALA   6           HB2      ALA   6   5.252  11.570   2.884
   40    HB3  ALA   6           HB3      ALA   6   5.421   9.945   2.218
   41    H    ALA   7           H        ALA   7   3.186   8.687   1.007
   42    HA   ALA   7           HA       ALA   7   1.824   6.779   2.670
   43    HB1  ALA   7           HB1      ALA   7   1.161   6.986   0.328
   44    HB2  ALA   7           HB2      ALA   7   1.811   5.374   0.624
   45    HB3  ALA   7           HB3      ALA   7   2.796   6.588  -0.190
   46    HA   PRO   8           HA       PRO   8   5.534   4.686   4.105
   47    HB2  PRO   8           HB2      PRO   8   3.879   2.223   3.828
   48    HB3  PRO   8           HB3      PRO   8   4.753   2.827   5.240
   49    HG2  PRO   8           HG2      PRO   8   2.099   2.993   5.104
   50    HG3  PRO   8           HG3      PRO   8   3.064   4.289   5.831
   51    HD2  PRO   8           HD2      PRO   8   1.740   4.190   3.153
   52    HD3  PRO   8           HD3      PRO   8   1.938   5.549   4.280
   53    H    LYS   9           H        LYS   9   7.211   3.948   2.935
   54    HA   LYS   9           HA       LYS   9   6.778   3.131   0.174
   55    HB2  LYS   9           HB2      LYS   9   9.333   3.634   1.717
   56    HB3  LYS   9           HB3      LYS   9   9.210   3.388  -0.023
   57    HG2  LYS   9           HG2      LYS   9   7.875   5.408  -0.231
   58    HG3  LYS   9           HG3      LYS   9   7.951   5.647   1.512
   59    HD2  LYS   9           HD2      LYS   9  10.387   5.896   1.357
   60    HD3  LYS   9           HD3      LYS   9  10.290   5.666  -0.391
   61    HE2  LYS   9           HE2      LYS   9   8.869   7.640  -0.586
   62    HE3  LYS   9           HE3      LYS   9   8.926   7.866   1.157
   63    HZ1  LYS   9           HZ1      LYS   9  11.267   7.982  -0.658
   64    HZ2  LYS   9           HZ2      LYS   9  11.280   8.294   1.007
   65    HZ3  LYS   9           HZ3      LYS   9  10.443   9.312  -0.042
   66    H    CYS  10           H        CYS  10   7.558   1.198  -0.696
   67    HA   CYS  10           HA       CYS  10   7.986  -0.903   1.318
   68    HB2  CYS  10           HB2      CYS  10   6.639  -2.390  -0.047
   69    HB3  CYS  10           HB3      CYS  10   5.709  -0.990   0.474
   70    H    ARG  11           H        ARG  11   9.229  -2.609   0.702
   71    HA   ARG  11           HA       ARG  11  10.480  -2.528  -1.951
   72    HB2  ARG  11           HB2      ARG  11  11.602  -3.658   0.631
   73    HB3  ARG  11           HB3      ARG  11  12.378  -3.791  -0.938
   74    HG2  ARG  11           HG2      ARG  11  11.879  -1.265   0.636
   75    HG3  ARG  11           HG3      ARG  11  13.439  -2.036   0.341
   76    HD2  ARG  11           HD2      ARG  11  13.210  -1.597  -2.043
   77    HD3  ARG  11           HD3      ARG  11  11.617  -0.900  -1.773
   78    HE   ARG  11           HE       ARG  11  14.138   0.246  -0.823
   79   HH11  ARG  11          HH11      ARG  11  10.718   0.663  -1.739
   80   HH12  ARG  11          HH12      ARG  11  10.838   2.344  -1.937
   81   HH21  ARG  11          HH21      ARG  11  14.259   2.615  -1.089
   82   HH22  ARG  11          HH22      ARG  11  12.879   3.473  -1.556
   83    H    ARG  12           H        ARG  12   9.021  -4.356   0.594
   84    HA   ARG  12           HA       ARG  12   8.211  -6.480  -1.282
   85    HB2  ARG  12           HB2      ARG  12   8.314  -7.967   0.735
   86    HB3  ARG  12           HB3      ARG  12   9.870  -7.518   0.057
   87    HG2  ARG  12           HG2      ARG  12   9.988  -5.703   1.760
   88    HG3  ARG  12           HG3      ARG  12   8.477  -6.286   2.425
   89    HD2  ARG  12           HD2      ARG  12   9.590  -8.401   2.966
   90    HD3  ARG  12           HD3      ARG  12  11.121  -7.716   2.384
   91    HE   ARG  12           HE       ARG  12  10.165  -5.853   4.099
   92   HH11  ARG  12          HH11      ARG  12  10.945  -9.301   4.455
   93   HH12  ARG  12          HH12      ARG  12  11.250  -9.163   6.129
   94   HH21  ARG  12          HH21      ARG  12  10.630  -5.701   6.354
   95   HH22  ARG  12          HH22      ARG  12  11.067  -7.104   7.227
   96    H    ASP  13           H        ASP  13   6.274  -7.545  -0.552
   97    HA   ASP  13           HA       ASP  13   4.257  -5.665  -0.008
   98    HB2  ASP  13           HB2      ASP  13   4.293  -8.653  -0.097
   99    HB3  ASP  13           HB3      ASP  13   2.859  -7.718   0.230
  100    H    SER  14           H        SER  14   6.004  -7.921   1.864
  101    HA   SER  14           HA       SER  14   4.371  -7.871   4.154
  102    HB2  SER  14           HB2      SER  14   6.491  -8.764   5.226
  103    HB3  SER  14           HB3      SER  14   5.696  -9.712   3.939
  104    HG   SER  14           HG       SER  14   8.075  -9.337   3.923
  105    H    ASP  15           H        ASP  15   6.491  -5.609   2.956
  106    HA   ASP  15           HA       ASP  15   7.157  -4.281   5.448
  107    HB2  ASP  15           HB2      ASP  15   6.991  -3.094   2.665
  108    HB3  ASP  15           HB3      ASP  15   7.543  -2.222   4.081
  109    H    CYS  16           H        CYS  16   4.492  -4.401   3.329
  110    HA   CYS  16           HA       CYS  16   3.259  -2.006   4.344
  111    HB2  CYS  16           HB2      CYS  16   2.326  -4.041   2.329
  112    HB3  CYS  16           HB3      CYS  16   1.680  -2.422   2.588
  113    HA   PRO  17           HA       PRO  17   1.137  -4.527   7.323
  114    HB2  PRO  17           HB2      PRO  17  -0.502  -2.686   8.360
  115    HB3  PRO  17           HB3      PRO  17   1.244  -2.649   8.640
  116    HG2  PRO  17           HG2      PRO  17  -0.398  -1.057   6.711
  117    HG3  PRO  17           HG3      PRO  17   0.934  -0.521   7.749
  118    HD2  PRO  17           HD2      PRO  17   1.221  -1.107   5.090
  119    HD3  PRO  17           HD3      PRO  17   2.532  -1.246   6.278
  120    H    GLY  18           H        GLY  18  -0.511  -5.847   7.312
  121    HA2  GLY  18           HA2      GLY  18  -2.489  -6.853   6.945
  122    HA3  GLY  18           HA3      GLY  18  -3.183  -5.256   7.055
  123    H    ALA  19           H        ALA  19  -3.909  -4.278   5.223
  124    HA   ALA  19           HA       ALA  19  -4.358  -6.128   3.035
  125    HB1  ALA  19           HB1      ALA  19  -6.273  -5.097   4.139
  126    HB2  ALA  19           HB2      ALA  19  -6.190  -4.686   2.429
  127    HB3  ALA  19           HB3      ALA  19  -5.695  -3.505   3.645
  128    H    CYS  20           H        CYS  20  -2.248  -3.631   3.705
  129    HA   CYS  20           HA       CYS  20  -2.186  -2.518   1.078
  130    HB2  CYS  20           HB2      CYS  20  -0.204  -2.406   3.306
  131    HB3  CYS  20           HB3      CYS  20  -0.130  -1.479   1.826
  132    H    ILE  21           H        ILE  21  -0.876  -3.013  -0.468
  133    HA   ILE  21           HA       ILE  21   1.061  -5.184  -0.094
  134    HB   ILE  21           HB       ILE  21   0.728  -5.807  -2.464
  135   HG12  ILE  21          HG12      ILE  21  -1.621  -3.886  -2.439
  136   HG13  ILE  21          HG13      ILE  21  -0.093  -3.591  -3.260
  137   HG21  ILE  21          HG21      ILE  21  -0.485  -7.058  -0.796
  138   HG22  ILE  21          HG22      ILE  21  -1.476  -6.890  -2.246
  139   HG23  ILE  21          HG23      ILE  21  -1.802  -5.888  -0.832
  140   HD11  ILE  21          HD11      ILE  21  -0.496  -5.519  -4.693
  141   HD12  ILE  21          HD12      ILE  21  -1.806  -4.339  -4.814
  142   HD13  ILE  21          HD13      ILE  21  -2.024  -5.816  -3.869
  143    H    CYS  22           H        CYS  22   2.720  -4.999  -1.988
  144    HA   CYS  22           HA       CYS  22   3.661  -2.243  -1.838
  145    HB2  CYS  22           HB2      CYS  22   5.223  -4.110  -1.300
  146    HB3  CYS  22           HB3      CYS  22   5.052  -4.699  -2.950
  147    H    ARG  23           H        ARG  23   3.101  -0.871  -3.433
  148    HA   ARG  23           HA       ARG  23   2.155  -1.987  -5.913
  149    HB2  ARG  23           HB2      ARG  23   2.260   0.868  -4.978
  150    HB3  ARG  23           HB3      ARG  23   1.405   0.251  -6.367
  151    HG2  ARG  23           HG2      ARG  23  -0.039  -1.092  -4.864
  152    HG3  ARG  23           HG3      ARG  23   0.769  -0.349  -3.483
  153    HD2  ARG  23           HD2      ARG  23  -1.339   0.792  -3.980
  154    HD3  ARG  23           HD3      ARG  23   0.038   1.867  -4.246
  155    HE   ARG  23           HE       ARG  23  -0.575   0.537  -6.625
  156   HH11  ARG  23          HH11      ARG  23  -1.977   3.076  -4.594
  157   HH12  ARG  23          HH12      ARG  23  -2.745   3.870  -5.886
  158   HH21  ARG  23          HH21      ARG  23  -1.605   1.558  -8.349
  159   HH22  ARG  23          HH22      ARG  23  -2.538   2.969  -8.111
  160    H    GLY  24           H        GLY  24   2.836  -0.825  -7.932
  161    HA2  GLY  24           HA2      GLY  24   5.639  -1.154  -8.245
  162    HA3  GLY  24           HA3      GLY  24   4.512  -0.628  -9.479
  163    H    ASN  25           H        ASN  25   4.024   1.461  -7.072
  164    HA   ASN  25           HA       ASN  25   5.782   3.458  -8.249
  165    HB2  ASN  25           HB2      ASN  25   4.470   5.099  -6.996
  166    HB3  ASN  25           HB3      ASN  25   3.384   4.015  -7.852
  167   HD21  ASN  25          HD21      ASN  25   2.800   5.660  -5.593
  168   HD22  ASN  25          HD22      ASN  25   2.268   4.615  -4.338
  169    H    GLY  26           H        GLY  26   5.622   1.346  -5.611
  170    HA2  GLY  26           HA2      GLY  26   7.557   0.834  -4.371
  171    HA3  GLY  26           HA3      GLY  26   8.095   2.500  -4.577
  172    H    TYR  27           H        TYR  27   4.808   2.101  -3.867
  173    HA   TYR  27           HA       TYR  27   5.282   2.759  -1.084
  174    HB2  TYR  27           HB2      TYR  27   3.503   3.882  -3.146
  175    HB3  TYR  27           HB3      TYR  27   3.163   4.168  -1.423
  176    HD1  TYR  27           HD2      TYR  27   5.283   4.959  -4.307
  177    HD2  TYR  27           HD1      TYR  27   4.717   5.640  -0.160
  178    HE1  TYR  27           HE2      TYR  27   6.823   6.842  -4.415
  179    HE2  TYR  27           HE1      TYR  27   6.242   7.520  -0.249
  180    HH   TYR  27           HH       TYR  27   7.354   8.827  -3.224
  181    H    CYS  28           H        CYS  28   3.704   2.107   0.286
  182    HA   CYS  28           HA       CYS  28   2.401  -0.362  -0.350
  183    HB2  CYS  28           HB2      CYS  28   2.513   1.322   2.142
  184    HB3  CYS  28           HB3      CYS  28   1.703  -0.235   2.040
  185    H    GLY  29           H        GLY  29   0.309  -0.628  -0.779
  186    HA2  GLY  29           HA2      GLY  29  -1.615   1.337   0.112
  187    HA3  GLY  29           HA3      GLY  29  -1.423   1.207  -1.634
  188    H    GLU  30           H        GLU  30  -3.651   0.472   0.291
  189    HA   GLU  30           HA       GLU  30  -3.980  -2.281   0.183
  190    HB2  GLU  30           HB2      GLU  30  -5.324  -0.871   1.581
  191    HB3  GLU  30           HB3      GLU  30  -6.057  -0.095   0.157
  192    HG2  GLU  30           HG2      GLU  30  -6.775  -2.523  -0.405
  193    HG3  GLU  30           HG3      GLU  30  -6.450  -2.818   1.305
  194    H    ALA  31           H        ALA  31  -5.041  -3.435  -1.230
  195    HA   ALA  31           HA       ALA  31  -5.055  -2.506  -3.984
  196    HB1  ALA  31           HB1      ALA  31  -5.811  -5.226  -2.904
  197    HB2  ALA  31           HB2      ALA  31  -4.248  -4.780  -3.591
  198    HB3  ALA  31           HB3      ALA  31  -5.685  -4.817  -4.614
  199    H    ILE  32           H        ILE  32  -7.573  -4.599  -2.709
  200    HA   ILE  32           HA       ILE  32  -9.549  -2.459  -2.656
  201    HB   ILE  32           HB       ILE  32 -10.167  -5.023  -3.921
  202   HG12  ILE  32          HG12      ILE  32  -9.449  -2.540  -5.533
  203   HG13  ILE  32          HG13      ILE  32  -8.504  -4.022  -5.458
  204   HG21  ILE  32          HG21      ILE  32 -12.157  -3.738  -4.867
  205   HG22  ILE  32          HG22      ILE  32 -11.553  -2.321  -4.010
  206   HG23  ILE  32          HG23      ILE  32 -12.062  -3.745  -3.105
  207   HD11  ILE  32          HD11      ILE  32 -10.314  -5.220  -6.587
  208   HD12  ILE  32          HD12      ILE  32  -9.722  -3.866  -7.547
  209   HD13  ILE  32          HD13      ILE  32 -11.246  -3.724  -6.669
  210    H    TYR  33           H        TYR  33  -9.619  -2.881  -0.568
  211    HA   TYR  33           HA       TYR  33 -10.797  -5.377   0.307
  212    HB2  TYR  33           HB2      TYR  33  -8.418  -3.965   1.488
  213    HB3  TYR  33           HB3      TYR  33  -9.356  -5.189   2.312
  214    HD1  TYR  33           HD1      TYR  33  -9.472  -7.519   1.108
  215    HD2  TYR  33           HD2      TYR  33  -6.563  -4.561   0.199
  216    HE1  TYR  33           HE1      TYR  33  -8.049  -9.229   0.103
  217    HE2  TYR  33           HE2      TYR  33  -5.126  -6.265  -0.809
  218    HH   TYR  33           HH       TYR  33  -4.790  -8.756  -0.705
  219    H    ALA  34           H        ALA  34 -11.002  -4.731   2.972
  220    HA   ALA  34           HA       ALA  34 -12.440  -2.169   3.023
  221    HB1  ALA  34           HB1      ALA  34 -14.053  -3.999   2.736
  222    HB2  ALA  34           HB2      ALA  34 -14.210  -3.272   4.336
  223    HB3  ALA  34           HB3      ALA  34 -13.383  -4.817   4.147
  224    H    ALA  35           H        ALA  35  -9.803  -2.717   3.870
  225    HA   ALA  35           HA       ALA  35  -9.667  -3.403   6.625
  226    HB1  ALA  35           HB1      ALA  35  -7.657  -2.028   4.864
  227    HB2  ALA  35           HB2      ALA  35  -7.792  -3.768   5.141
  228    HB3  ALA  35           HB3      ALA  35  -7.357  -2.685   6.468
  229    HA   PRO  36           HA       PRO  36 -11.011   0.629   8.117
  230    HB2  PRO  36           HB2      PRO  36 -10.204  -0.477  10.722
  231    HB3  PRO  36           HB3      PRO  36 -11.761   0.168  10.204
  232    HG2  PRO  36           HG2      PRO  36 -11.398  -2.454  10.573
  233    HG3  PRO  36           HG3      PRO  36 -12.442  -1.827   9.285
  234    HD2  PRO  36           HD2      PRO  36  -9.674  -2.936   9.111
  235    HD3  PRO  36           HD3      PRO  36 -11.056  -3.126   8.012
  236    H    PHE  37           H        PHE  37  -7.995  -0.904   9.108
  237    HA   PHE  37           HA       PHE  37  -6.870   1.781   9.352
  238    HB2  PHE  37           HB2      PHE  37  -7.312   0.928  11.612
  239    HB3  PHE  37           HB3      PHE  37  -6.312  -0.480  11.282
  240    HD1  PHE  37           HD2      PHE  37  -6.117   3.248  11.254
  241    HD2  PHE  37           HD1      PHE  37  -4.104  -0.437  11.988
  242    HE1  PHE  37           HE2      PHE  37  -4.145   4.483  12.050
  243    HE2  PHE  37           HE1      PHE  37  -2.135   0.798  12.783
  244    HZ   PHE  37           HZ       PHE  37  -2.155   3.259  12.815
  245    H    ALA  38           H        ALA  38  -6.495  -1.422   8.195
  246    HA   ALA  38           HA       ALA  38  -3.661  -1.174   7.785
  247    HB1  ALA  38           HB1      ALA  38  -4.706  -3.371   8.278
  248    HB2  ALA  38           HB2      ALA  38  -3.747  -3.330   6.795
  249    HB3  ALA  38           HB3      ALA  38  -5.497  -3.299   6.691
  250    H    ARG  39           H        ARG  39  -5.243   0.810   6.574
  251    HA   ARG  39           HA       ARG  39  -4.563   0.379   3.773
  252    HB2  ARG  39           HB2      ARG  39  -6.412   2.362   5.059
  253    HB3  ARG  39           HB3      ARG  39  -5.873   2.492   3.402
  254    HG2  ARG  39           HG2      ARG  39  -6.846   0.283   2.923
  255    HG3  ARG  39           HG3      ARG  39  -7.448   0.223   4.578
  256    HD2  ARG  39           HD2      ARG  39  -8.841   2.141   4.190
  257    HD3  ARG  39           HD3      ARG  39  -8.163   2.353   2.572
  258    HE   ARG  39           HE       ARG  39  -9.076  -0.188   2.585
  259   HH11  ARG  39          HH11      ARG  39 -10.614   2.940   3.190
  260   HH12  ARG  39          HH12      ARG  39 -12.151   2.447   2.628
  261   HH21  ARG  39          HH21      ARG  39 -11.127  -0.843   1.805
  262   HH22  ARG  39          HH22      ARG  39 -12.451   0.220   1.828
  Start of MODEL    5
    1    H1   CYS   1           H        CYS   1  -3.841   1.629   3.511
    2    HA   CYS   1           HA       CYS   1  -2.680   3.546   5.088
    3    HB2  CYS   1           HB2      CYS   1  -0.357   2.733   5.294
    4    HB3  CYS   1           HB3      CYS   1  -1.428   1.637   6.133
    5    H    GLU   2           H        GLU   2  -2.964   4.908   3.490
    6    HA   GLU   2           HA       GLU   2  -1.983   4.166   0.823
    7    HB2  GLU   2           HB2      GLU   2  -4.325   5.938   1.558
    8    HB3  GLU   2           HB3      GLU   2  -3.811   5.520  -0.067
    9    HG2  GLU   2           HG2      GLU   2  -4.499   3.297   0.140
   10    HG3  GLU   2           HG3      GLU   2  -4.572   3.393   1.896
   11    H    ALA   3           H        ALA   3  -1.143   5.947  -0.392
   12    HA   ALA   3           HA       ALA   3   0.360   7.700   1.341
   13    HB1  ALA   3           HB1      ALA   3   1.504   6.482  -0.473
   14    HB2  ALA   3           HB2      ALA   3   1.707   8.229  -0.609
   15    HB3  ALA   3           HB3      ALA   3   0.562   7.388  -1.655
   16    H    ILE   4           H        ILE   4  -1.917   8.533   1.734
   17    HA   ILE   4           HA       ILE   4  -2.106  11.026   0.195
   18    HB   ILE   4           HB       ILE   4  -4.394   9.694   1.700
   19   HG12  ILE   4          HG12      ILE   4  -3.973   9.914  -1.297
   20   HG13  ILE   4          HG13      ILE   4  -3.744   8.446  -0.358
   21   HG21  ILE   4          HG21      ILE   4  -4.562  12.124   1.645
   22   HG22  ILE   4          HG22      ILE   4  -5.801  11.393   0.623
   23   HG23  ILE   4          HG23      ILE   4  -4.365  12.112  -0.108
   24   HD11  ILE   4          HD11      ILE   4  -5.875   8.439  -1.525
   25   HD12  ILE   4          HD12      ILE   4  -6.340   9.931  -0.708
   26   HD13  ILE   4          HD13      ILE   4  -6.117   8.449   0.221
   27    H    TYR   5           H        TYR   5  -2.804   9.592   3.322
   28    HA   TYR   5           HA       TYR   5  -2.425  12.168   4.632
   29    HB2  TYR   5           HB2      TYR   5  -4.220  10.420   5.204
   30    HB3  TYR   5           HB3      TYR   5  -2.928   9.509   5.943
   31    HD1  TYR   5           HD1      TYR   5  -4.657  12.761   6.102
   32    HD2  TYR   5           HD2      TYR   5  -2.228   9.950   8.157
   33    HE1  TYR   5           HE1      TYR   5  -4.958  14.035   8.159
   34    HE2  TYR   5           HE2      TYR   5  -2.518  11.216  10.242
   35    HH   TYR   5           HH       TYR   5  -4.866  13.637  10.545
   36    H    ALA   6           H        ALA   6  -0.929   9.110   4.222
   37    HA   ALA   6           HA       ALA   6   1.607  10.126   5.202
   38    HB1  ALA   6           HB1      ALA   6   1.992   8.228   6.719
   39    HB2  ALA   6           HB2      ALA   6   0.359   7.643   6.404
   40    HB3  ALA   6           HB3      ALA   6   0.598   9.179   7.234
   41    H    ALA   7           H        ALA   7   3.019   9.591   3.717
   42    HA   ALA   7           HA       ALA   7   2.434   7.604   1.732
   43    HB1  ALA   7           HB1      ALA   7   4.480   8.379   0.681
   44    HB2  ALA   7           HB2      ALA   7   4.851   9.359   2.100
   45    HB3  ALA   7           HB3      ALA   7   3.436   9.733   1.114
   46    HA   PRO   8           HA       PRO   8   5.051   4.650   3.935
   47    HB2  PRO   8           HB2      PRO   8   3.571   2.465   3.357
   48    HB3  PRO   8           HB3      PRO   8   3.139   3.581   4.649
   49    HG2  PRO   8           HG2      PRO   8   1.787   3.136   2.088
   50    HG3  PRO   8           HG3      PRO   8   1.209   3.997   3.519
   51    HD2  PRO   8           HD2      PRO   8   2.397   5.065   1.075
   52    HD3  PRO   8           HD3      PRO   8   1.560   5.920   2.391
   53    H    LYS   9           H        LYS   9   6.858   3.893   2.951
   54    HA   LYS   9           HA       LYS   9   6.762   3.236   0.081
   55    HB2  LYS   9           HB2      LYS   9   9.116   3.672   1.934
   56    HB3  LYS   9           HB3      LYS   9   9.222   3.385   0.208
   57    HG2  LYS   9           HG2      LYS   9   7.924   5.780   1.510
   58    HG3  LYS   9           HG3      LYS   9   9.532   5.748   0.795
   59    HD2  LYS   9           HD2      LYS   9   6.947   5.237  -0.693
   60    HD3  LYS   9           HD3      LYS   9   7.836   6.754  -0.690
   61    HE2  LYS   9           HE2      LYS   9   8.859   4.105  -1.728
   62    HE3  LYS   9           HE3      LYS   9   8.282   5.443  -2.708
   63    HZ1  LYS   9           HZ1      LYS   9  10.707   5.391  -2.570
   64    HZ2  LYS   9           HZ2      LYS   9  10.638   5.566  -0.900
   65    HZ3  LYS   9           HZ3      LYS   9  10.085   6.803  -1.894
   66    H    CYS  10           H        CYS  10   7.626   1.285  -0.671
   67    HA   CYS  10           HA       CYS  10   7.894  -0.805   1.386
   68    HB2  CYS  10           HB2      CYS  10   6.649  -2.312  -0.069
   69    HB3  CYS  10           HB3      CYS  10   5.679  -0.932   0.426
   70    H    ARG  11           H        ARG  11   9.114  -2.608   0.796
   71    HA   ARG  11           HA       ARG  11  10.808  -2.361  -1.608
   72    HB2  ARG  11           HB2      ARG  11  11.305  -3.966   0.910
   73    HB3  ARG  11           HB3      ARG  11  12.442  -3.654  -0.388
   74    HG2  ARG  11           HG2      ARG  11  12.757  -1.423   0.289
   75    HG3  ARG  11           HG3      ARG  11  11.337  -1.470   1.342
   76    HD2  ARG  11           HD2      ARG  11  13.882  -3.038   1.708
   77    HD3  ARG  11           HD3      ARG  11  13.354  -1.656   2.674
   78    HE   ARG  11           HE       ARG  11  11.278  -3.351   2.894
   79   HH11  ARG  11          HH11      ARG  11  14.754  -3.854   3.426
   80   HH12  ARG  11          HH12      ARG  11  14.510  -5.057   4.602
   81   HH21  ARG  11          HH21      ARG  11  10.995  -4.956   4.488
   82   HH22  ARG  11          HH22      ARG  11  12.357  -5.738   5.191
   83    H    ARG  12           H        ARG  12   9.302  -4.496   0.738
   84    HA   ARG  12           HA       ARG  12   8.375  -6.319  -1.366
   85    HB2  ARG  12           HB2      ARG  12   8.468  -8.052   0.517
   86    HB3  ARG  12           HB3      ARG  12   9.963  -7.663  -0.311
   87    HG2  ARG  12           HG2      ARG  12  10.422  -6.078   1.635
   88    HG3  ARG  12           HG3      ARG  12   9.039  -6.820   2.432
   89    HD2  ARG  12           HD2      ARG  12  11.486  -8.321   1.472
   90    HD3  ARG  12           HD3      ARG  12  11.218  -7.787   3.127
   91    HE   ARG  12           HE       ARG  12   9.100  -9.414   2.118
   92   HH11  ARG  12          HH11      ARG  12  12.360  -9.582   3.524
   93   HH12  ARG  12          HH12      ARG  12  12.085 -11.101   4.253
   94   HH21  ARG  12          HH21      ARG  12   8.768 -11.499   3.155
   95   HH22  ARG  12          HH22      ARG  12  10.054 -12.181   4.052
   96    H    ASP  13           H        ASP  13   6.441  -7.479  -0.835
   97    HA   ASP  13           HA       ASP  13   4.438  -5.652  -0.193
   98    HB2  ASP  13           HB2      ASP  13   4.538  -8.575  -0.677
   99    HB3  ASP  13           HB3      ASP  13   3.068  -7.837  -0.088
  100    H    SER  14           H        SER  14   6.124  -7.941   1.687
  101    HA   SER  14           HA       SER  14   4.350  -8.145   3.870
  102    HB2  SER  14           HB2      SER  14   6.476  -8.857   5.049
  103    HB3  SER  14           HB3      SER  14   5.999  -9.800   3.623
  104    HG   SER  14           HG       SER  14   8.147  -8.216   4.070
  105    H    ASP  15           H        ASP  15   6.578  -5.700   2.888
  106    HA   ASP  15           HA       ASP  15   6.986  -4.435   5.427
  107    HB2  ASP  15           HB2      ASP  15   7.103  -3.212   2.656
  108    HB3  ASP  15           HB3      ASP  15   7.625  -2.407   4.122
  109    H    CYS  16           H        CYS  16   4.382  -4.602   3.259
  110    HA   CYS  16           HA       CYS  16   3.196  -2.132   4.151
  111    HB2  CYS  16           HB2      CYS  16   2.312  -4.169   2.125
  112    HB3  CYS  16           HB3      CYS  16   1.640  -2.558   2.360
  113    HA   PRO  17           HA       PRO  17   1.147  -4.597   7.232
  114    HB2  PRO  17           HB2      PRO  17  -0.254  -2.599   8.406
  115    HB3  PRO  17           HB3      PRO  17   1.472  -2.860   8.665
  116    HG2  PRO  17           HG2      PRO  17   0.104  -0.854   6.936
  117    HG3  PRO  17           HG3      PRO  17   1.582  -0.695   7.891
  118    HD2  PRO  17           HD2      PRO  17   1.509  -1.100   5.174
  119    HD3  PRO  17           HD3      PRO  17   2.884  -1.511   6.215
  120    H    GLY  18           H        GLY  18  -0.602  -5.729   7.364
  121    HA2  GLY  18           HA2      GLY  18  -2.775  -6.378   7.339
  122    HA3  GLY  18           HA3      GLY  18  -3.206  -4.707   7.036
  123    H    ALA  19           H        ALA  19  -3.935  -4.167   5.085
  124    HA   ALA  19           HA       ALA  19  -4.136  -6.328   3.137
  125    HB1  ALA  19           HB1      ALA  19  -6.256  -5.494   4.008
  126    HB2  ALA  19           HB2      ALA  19  -6.089  -5.085   2.300
  127    HB3  ALA  19           HB3      ALA  19  -5.818  -3.857   3.532
  128    H    CYS  20           H        CYS  20  -2.341  -3.652   3.813
  129    HA   CYS  20           HA       CYS  20  -2.270  -2.481   1.243
  130    HB2  CYS  20           HB2      CYS  20  -0.220  -2.454   3.427
  131    HB3  CYS  20           HB3      CYS  20  -0.262  -1.411   2.030
  132    H    ILE  21           H        ILE  21  -0.959  -2.942  -0.334
  133    HA   ILE  21           HA       ILE  21   1.022  -5.067   0.000
  134    HB   ILE  21           HB       ILE  21   0.605  -5.695  -2.379
  135   HG12  ILE  21          HG12      ILE  21  -1.831  -3.911  -2.108
  136   HG13  ILE  21          HG13      ILE  21  -0.435  -3.591  -3.130
  137   HG21  ILE  21          HG21      ILE  21  -1.759  -5.992  -0.535
  138   HG22  ILE  21          HG22      ILE  21  -0.343  -7.042  -0.612
  139   HG23  ILE  21          HG23      ILE  21  -1.461  -6.967  -1.974
  140   HD11  ILE  21          HD11      ILE  21  -0.956  -5.558  -4.459
  141   HD12  ILE  21          HD12      ILE  21  -2.323  -4.442  -4.406
  142   HD13  ILE  21          HD13      ILE  21  -2.332  -5.905  -3.416
  143    H    CYS  22           H        CYS  22   2.632  -4.898  -1.935
  144    HA   CYS  22           HA       CYS  22   3.539  -2.128  -1.825
  145    HB2  CYS  22           HB2      CYS  22   5.142  -3.846  -1.136
  146    HB3  CYS  22           HB3      CYS  22   4.989  -4.654  -2.688
  147    H    ARG  23           H        ARG  23   3.095  -0.822  -3.479
  148    HA   ARG  23           HA       ARG  23   2.199  -1.987  -5.956
  149    HB2  ARG  23           HB2      ARG  23   2.332   0.903  -5.110
  150    HB3  ARG  23           HB3      ARG  23   1.422   0.226  -6.445
  151    HG2  ARG  23           HG2      ARG  23  -0.031  -0.979  -4.940
  152    HG3  ARG  23           HG3      ARG  23   0.920  -0.454  -3.557
  153    HD2  ARG  23           HD2      ARG  23  -1.001   0.923  -3.603
  154    HD3  ARG  23           HD3      ARG  23   0.341   1.898  -4.192
  155    HE   ARG  23           HE       ARG  23  -0.779   0.905  -6.454
  156   HH11  ARG  23          HH11      ARG  23  -1.990   2.781  -3.712
  157   HH12  ARG  23          HH12      ARG  23  -3.266   3.502  -4.556
  158   HH21  ARG  23          HH21      ARG  23  -2.591   1.875  -7.634
  159   HH22  ARG  23          HH22      ARG  23  -3.635   2.955  -6.821
  160    H    GLY  24           H        GLY  24   2.985  -0.943  -7.950
  161    HA2  GLY  24           HA2      GLY  24   5.818  -1.340  -8.136
  162    HA3  GLY  24           HA3      GLY  24   4.745  -0.914  -9.456
  163    H    ASN  25           H        ASN  25   4.127   1.306  -7.270
  164    HA   ASN  25           HA       ASN  25   5.966   3.204  -8.424
  165    HB2  ASN  25           HB2      ASN  25   4.609   4.914  -7.145
  166    HB3  ASN  25           HB3      ASN  25   3.742   4.020  -8.383
  167   HD21  ASN  25          HD21      ASN  25   1.777   4.443  -7.425
  168   HD22  ASN  25          HD22      ASN  25   1.273   3.715  -5.945
  169    H    GLY  26           H        GLY  26   5.633   1.389  -5.558
  170    HA2  GLY  26           HA2      GLY  26   7.675   1.085  -4.281
  171    HA3  GLY  26           HA3      GLY  26   7.994   2.800  -4.503
  172    H    TYR  27           H        TYR  27   4.793   2.381  -4.017
  173    HA   TYR  27           HA       TYR  27   5.008   3.116  -1.205
  174    HB2  TYR  27           HB2      TYR  27   3.048   3.703  -3.356
  175    HB3  TYR  27           HB3      TYR  27   2.733   4.130  -1.665
  176    HD1  TYR  27           HD1      TYR  27   4.122   5.956  -0.643
  177    HD2  TYR  27           HD2      TYR  27   4.441   4.961  -4.755
  178    HE1  TYR  27           HE1      TYR  27   5.244   8.110  -1.085
  179    HE2  TYR  27           HE2      TYR  27   5.558   7.092  -5.199
  180    HH   TYR  27           HH       TYR  27   5.725   9.295  -4.225
  181    H    CYS  28           H        CYS  28   3.705   2.141   0.218
  182    HA   CYS  28           HA       CYS  28   2.427  -0.364  -0.445
  183    HB2  CYS  28           HB2      CYS  28   2.600   1.204   2.131
  184    HB3  CYS  28           HB3      CYS  28   1.757  -0.327   1.977
  185    H    GLY  29           H        GLY  29   0.215  -0.721  -0.401
  186    HA2  GLY  29           HA2      GLY  29  -1.574   1.216   0.620
  187    HA3  GLY  29           HA3      GLY  29  -1.456   1.329  -1.129
  188    H    GLU  30           H        GLU  30  -3.658   0.576   0.644
  189    HA   GLU  30           HA       GLU  30  -4.495  -2.011   0.451
  190    HB2  GLU  30           HB2      GLU  30  -5.757  -0.333   1.561
  191    HB3  GLU  30           HB3      GLU  30  -5.915   0.571   0.038
  192    HG2  GLU  30           HG2      GLU  30  -8.020  -0.443   0.636
  193    HG3  GLU  30           HG3      GLU  30  -7.369  -1.192  -0.817
  194    H    ALA  31           H        ALA  31  -5.397  -3.075  -1.025
  195    HA   ALA  31           HA       ALA  31  -4.808  -2.426  -3.814
  196    HB1  ALA  31           HB1      ALA  31  -4.200  -4.681  -3.042
  197    HB2  ALA  31           HB2      ALA  31  -5.355  -4.742  -4.375
  198    HB3  ALA  31           HB3      ALA  31  -5.899  -5.026  -2.722
  199    H    ILE  32           H        ILE  32  -7.565  -4.293  -2.732
  200    HA   ILE  32           HA       ILE  32  -9.501  -2.271  -3.433
  201    HB   ILE  32           HB       ILE  32  -9.638  -4.973  -4.611
  202   HG12  ILE  32          HG12      ILE  32  -8.834  -2.485  -6.161
  203   HG13  ILE  32          HG13      ILE  32  -7.781  -3.842  -5.796
  204   HG21  ILE  32          HG21      ILE  32 -11.775  -3.923  -4.299
  205   HG22  ILE  32          HG22      ILE  32 -11.462  -3.994  -6.033
  206   HG23  ILE  32          HG23      ILE  32 -11.242  -2.477  -5.160
  207   HD11  ILE  32          HD11      ILE  32  -8.509  -3.891  -8.108
  208   HD12  ILE  32          HD12      ILE  32 -10.194  -3.895  -7.593
  209   HD13  ILE  32          HD13      ILE  32  -9.159  -5.275  -7.229
  210    H    TYR  33           H        TYR  33 -10.369  -2.448  -1.606
  211    HA   TYR  33           HA       TYR  33 -11.965  -4.573  -0.679
  212    HB2  TYR  33           HB2      TYR  33  -9.606  -5.540  -0.258
  213    HB3  TYR  33           HB3      TYR  33  -9.467  -4.331   1.010
  214    HD1  TYR  33           HD1      TYR  33 -11.023  -4.460   2.989
  215    HD2  TYR  33           HD2      TYR  33 -10.824  -7.505   0.044
  216    HE1  TYR  33           HE1      TYR  33 -12.118  -6.013   4.534
  217    HE2  TYR  33           HE2      TYR  33 -11.922  -9.068   1.566
  218    HH   TYR  33           HH       TYR  33 -13.492  -8.168   4.366
  219    H    ALA  34           H        ALA  34  -9.761  -2.095   0.433
  220    HA   ALA  34           HA       ALA  34  -9.887  -0.323   1.741
  221    HB1  ALA  34           HB1      ALA  34 -12.879  -0.430   1.300
  222    HB2  ALA  34           HB2      ALA  34 -11.723   0.449   0.291
  223    HB3  ALA  34           HB3      ALA  34 -11.981   0.934   1.966
  224    H    ALA  35           H        ALA  35  -9.261  -2.209   3.074
  225    HA   ALA  35           HA       ALA  35 -11.033  -3.118   5.101
  226    HB1  ALA  35           HB1      ALA  35  -8.954  -4.066   6.058
  227    HB2  ALA  35           HB2      ALA  35  -8.050  -3.180   4.817
  228    HB3  ALA  35           HB3      ALA  35  -9.178  -4.445   4.350
  229    HA   PRO  36           HA       PRO  36 -11.290   0.575   7.629
  230    HB2  PRO  36           HB2      PRO  36 -11.365  -1.561   9.721
  231    HB3  PRO  36           HB3      PRO  36 -12.365  -0.109   9.574
  232    HG2  PRO  36           HG2      PRO  36 -13.344  -2.421   8.793
  233    HG3  PRO  36           HG3      PRO  36 -13.592  -0.980   7.791
  234    HD2  PRO  36           HD2      PRO  36 -11.764  -3.295   7.353
  235    HD3  PRO  36           HD3      PRO  36 -12.628  -2.288   6.174
  236    H    PHE  37           H        PHE  37  -9.224  -1.973   8.960
  237    HA   PHE  37           HA       PHE  37  -7.556   0.147  10.109
  238    HB2  PHE  37           HB2      PHE  37  -8.507  -1.387  11.776
  239    HB3  PHE  37           HB3      PHE  37  -7.792  -2.754  10.939
  240    HD1  PHE  37           HD2      PHE  37  -6.809   0.454  12.579
  241    HD2  PHE  37           HD1      PHE  37  -5.756  -3.573  11.680
  242    HE1  PHE  37           HE2      PHE  37  -4.784   0.682  13.942
  243    HE2  PHE  37           HE1      PHE  37  -3.726  -3.345  13.047
  244    HZ   PHE  37           HZ       PHE  37  -3.238  -1.215  14.179
  245    H    ALA  38           H        ALA  38  -7.616  -2.201   7.702
  246    HA   ALA  38           HA       ALA  38  -4.749  -2.605   7.815
  247    HB1  ALA  38           HB1      ALA  38  -6.743  -3.941   6.044
  248    HB2  ALA  38           HB2      ALA  38  -6.208  -4.566   7.610
  249    HB3  ALA  38           HB3      ALA  38  -5.069  -4.405   6.265
  250    H    ARG  39           H        ARG  39  -6.163  -0.274   6.860
  251    HA   ARG  39           HA       ARG  39  -5.144  -0.038   4.121
  252    HB2  ARG  39           HB2      ARG  39  -6.997   1.634   5.743
  253    HB3  ARG  39           HB3      ARG  39  -6.126   2.369   4.417
  254    HG2  ARG  39           HG2      ARG  39  -7.161   0.935   2.826
  255    HG3  ARG  39           HG3      ARG  39  -7.853  -0.072   4.102
  256    HD2  ARG  39           HD2      ARG  39  -9.499   1.481   3.090
  257    HD3  ARG  39           HD3      ARG  39  -9.272   1.717   4.820
  258    HE   ARG  39           HE       ARG  39  -7.788   3.459   2.977
  259   HH11  ARG  39          HH11      ARG  39 -10.526   3.087   5.185
  260   HH12  ARG  39          HH12      ARG  39 -10.736   4.742   5.478
  261   HH21  ARG  39          HH21      ARG  39  -8.020   5.693   3.332
  262   HH22  ARG  39          HH22      ARG  39  -9.219   6.320   4.384
  Start of MODEL    6
    1    H1   CYS   1           H        CYS   1  -3.591   1.937   2.540
    2    HA   CYS   1           HA       CYS   1  -2.704   2.978   5.143
    3    HB2  CYS   1           HB2      CYS   1  -0.452   2.008   4.531
    4    HB3  CYS   1           HB3      CYS   1  -1.711   0.825   4.871
    5    H    GLU   2           H        GLU   2  -3.798   4.537   3.228
    6    HA   GLU   2           HA       GLU   2  -1.693   5.825   1.701
    7    HB2  GLU   2           HB2      GLU   2  -4.628   6.444   2.024
    8    HB3  GLU   2           HB3      GLU   2  -3.545   7.275   0.923
    9    HG2  GLU   2           HG2      GLU   2  -3.199   5.272  -0.348
   10    HG3  GLU   2           HG3      GLU   2  -4.114   4.342   0.838
   11    H    ALA   3           H        ALA   3  -1.115   8.024   2.066
   12    HA   ALA   3           HA       ALA   3  -1.968   9.381   4.390
   13    HB1  ALA   3           HB1      ALA   3   0.763   8.112   4.286
   14    HB2  ALA   3           HB2      ALA   3  -0.518   7.741   5.442
   15    HB3  ALA   3           HB3      ALA   3   0.251   9.332   5.445
   16    H    ILE   4           H        ILE   4  -1.349  11.413   4.222
   17    HA   ILE   4           HA       ILE   4   0.014  12.183   1.747
   18    HB   ILE   4           HB       ILE   4  -1.686  13.920   3.579
   19   HG12  ILE   4          HG12      ILE   4  -2.399  12.669   0.917
   20   HG13  ILE   4          HG13      ILE   4  -2.966  12.097   2.479
   21   HG21  ILE   4          HG21      ILE   4  -0.637  14.475   0.796
   22   HG22  ILE   4          HG22      ILE   4  -0.074  15.234   2.285
   23   HG23  ILE   4          HG23      ILE   4  -1.719  15.525   1.715
   24   HD11  ILE   4          HD11      ILE   4  -4.146  14.219   2.808
   25   HD12  ILE   4          HD12      ILE   4  -4.671  13.399   1.339
   26   HD13  ILE   4          HD13      ILE   4  -3.573  14.775   1.237
   27    H    TYR   5           H        TYR   5   0.389  12.224   5.150
   28    HA   TYR   5           HA       TYR   5   2.472  14.241   5.054
   29    HB2  TYR   5           HB2      TYR   5   0.830  14.005   6.964
   30    HB3  TYR   5           HB3      TYR   5   1.659  12.532   7.390
   31    HD1  TYR   5           HD1      TYR   5   2.452  16.125   6.753
   32    HD2  TYR   5           HD2      TYR   5   3.394  12.605   8.950
   33    HE1  TYR   5           HE1      TYR   5   4.076  17.392   8.060
   34    HE2  TYR   5           HE2      TYR   5   5.031  13.863  10.270
   35    HH   TYR   5           HH       TYR   5   5.154  17.243  10.270
   36    H    ALA   6           H        ALA   6   2.126  10.826   5.608
   37    HA   ALA   6           HA       ALA   6   4.863  10.421   4.753
   38    HB1  ALA   6           HB1      ALA   6   5.117  10.817   7.160
   39    HB2  ALA   6           HB2      ALA   6   5.604   9.187   6.698
   40    HB3  ALA   6           HB3      ALA   6   4.050   9.451   7.490
   41    H    ALA   7           H        ALA   7   3.991   9.321   3.057
   42    HA   ALA   7           HA       ALA   7   2.338   7.001   3.474
   43    HB1  ALA   7           HB1      ALA   7   3.712   8.001   0.974
   44    HB2  ALA   7           HB2      ALA   7   2.044   8.334   1.448
   45    HB3  ALA   7           HB3      ALA   7   2.532   6.693   1.034
   46    HA   PRO   8           HA       PRO   8   5.851   4.334   4.311
   47    HB2  PRO   8           HB2      PRO   8   3.988   2.129   3.725
   48    HB3  PRO   8           HB3      PRO   8   4.862   2.485   5.216
   49    HG2  PRO   8           HG2      PRO   8   2.214   2.847   5.028
   50    HG3  PRO   8           HG3      PRO   8   3.236   3.938   5.978
   51    HD2  PRO   8           HD2      PRO   8   2.063   4.330   3.256
   52    HD3  PRO   8           HD3      PRO   8   2.217   5.470   4.615
   53    H    LYS   9           H        LYS   9   7.382   4.062   2.828
   54    HA   LYS   9           HA       LYS   9   6.779   3.180   0.143
   55    HB2  LYS   9           HB2      LYS   9   9.403   3.830   1.505
   56    HB3  LYS   9           HB3      LYS   9   9.260   3.330  -0.172
   57    HG2  LYS   9           HG2      LYS   9   7.887   5.322  -0.622
   58    HG3  LYS   9           HG3      LYS   9   8.116   5.830   1.052
   59    HD2  LYS   9           HD2      LYS   9  10.505   5.988   0.720
   60    HD3  LYS   9           HD3      LYS   9  10.353   5.348  -0.916
   61    HE2  LYS   9           HE2      LYS   9   8.997   7.311  -1.531
   62    HE3  LYS   9           HE3      LYS   9   9.208   7.950   0.097
   63    HZ1  LYS   9           HZ1      LYS   9  11.565   8.153  -0.287
   64    HZ2  LYS   9           HZ2      LYS   9  10.758   8.874  -1.599
   65    HZ3  LYS   9           HZ3      LYS   9  11.431   7.362  -1.768
   66    H    CYS  10           H        CYS  10   7.164   1.171  -0.641
   67    HA   CYS  10           HA       CYS  10   7.628  -0.865   1.408
   68    HB2  CYS  10           HB2      CYS  10   6.567  -2.396  -0.210
   69    HB3  CYS  10           HB3      CYS  10   5.527  -1.061   0.267
   70    H    ARG  11           H        ARG  11   9.119  -2.471   1.162
   71    HA   ARG  11           HA       ARG  11  10.826  -2.336  -1.216
   72    HB2  ARG  11           HB2      ARG  11  11.336  -3.429   1.554
   73    HB3  ARG  11           HB3      ARG  11  12.392  -3.776   0.191
   74    HG2  ARG  11           HG2      ARG  11  12.828  -1.389  -0.068
   75    HG3  ARG  11           HG3      ARG  11  11.776  -1.052   1.303
   76    HD2  ARG  11           HD2      ARG  11  14.233  -2.788   1.446
   77    HD3  ARG  11           HD3      ARG  11  14.225  -1.068   1.812
   78    HE   ARG  11           HE       ARG  11  12.275  -2.507   3.325
   79   HH11  ARG  11          HH11      ARG  11  15.686  -1.616   3.212
   80   HH12  ARG  11          HH12      ARG  11  15.979  -1.830   4.868
   81   HH21  ARG  11          HH21      ARG  11  12.650  -2.812   5.631
   82   HH22  ARG  11          HH22      ARG  11  14.197  -2.542   6.279
   83    H    ARG  12           H        ARG  12   8.768  -4.219   0.808
   84    HA   ARG  12           HA       ARG  12   8.293  -6.088  -1.332
   85    HB2  ARG  12           HB2      ARG  12   8.328  -7.936   0.345
   86    HB3  ARG  12           HB3      ARG  12   9.900  -7.334  -0.149
   87    HG2  ARG  12           HG2      ARG  12  10.002  -6.003   1.915
   88    HG3  ARG  12           HG3      ARG  12   8.412  -6.606   2.372
   89    HD2  ARG  12           HD2      ARG  12   9.314  -8.871   2.414
   90    HD3  ARG  12           HD3      ARG  12  10.907  -8.231   2.003
   91    HE   ARG  12           HE       ARG  12  10.686  -6.889   4.073
   92   HH11  ARG  12          HH11      ARG  12   8.824  -9.857   3.797
   93   HH12  ARG  12          HH12      ARG  12   9.026 -10.336   5.414
   94   HH21  ARG  12          HH21      ARG  12  10.922  -7.493   6.368
   95   HH22  ARG  12          HH22      ARG  12  10.239  -8.960   6.902
   96    H    ASP  13           H        ASP  13   6.386  -7.229  -0.976
   97    HA   ASP  13           HA       ASP  13   4.214  -5.632  -0.270
   98    HB2  ASP  13           HB2      ASP  13   4.478  -8.595  -0.567
   99    HB3  ASP  13           HB3      ASP  13   2.971  -7.717  -0.487
  100    H    SER  14           H        SER  14   5.982  -8.094   1.357
  101    HA   SER  14           HA       SER  14   4.151  -8.515   3.442
  102    HB2  SER  14           HB2      SER  14   6.163  -9.740   4.373
  103    HB3  SER  14           HB3      SER  14   5.382 -10.299   2.862
  104    HG   SER  14           HG       SER  14   7.245 -10.086   1.973
  105    H    ASP  15           H        ASP  15   6.398  -6.107   2.946
  106    HA   ASP  15           HA       ASP  15   6.527  -5.632   5.842
  107    HB2  ASP  15           HB2      ASP  15   8.275  -4.047   5.629
  108    HB3  ASP  15           HB3      ASP  15   8.682  -5.345   4.532
  109    H    CYS  16           H        CYS  16   4.420  -4.982   3.523
  110    HA   CYS  16           HA       CYS  16   3.730  -2.349   4.460
  111    HB2  CYS  16           HB2      CYS  16   2.519  -4.189   2.404
  112    HB3  CYS  16           HB3      CYS  16   1.895  -2.595   2.803
  113    HA   PRO  17           HA       PRO  17   1.011  -4.143   7.481
  114    HB2  PRO  17           HB2      PRO  17  -0.177  -1.935   8.363
  115    HB3  PRO  17           HB3      PRO  17   1.553  -2.197   8.628
  116    HG2  PRO  17           HG2      PRO  17   0.194  -0.534   6.537
  117    HG3  PRO  17           HG3      PRO  17   1.582  -0.120   7.561
  118    HD2  PRO  17           HD2      PRO  17   1.821  -0.996   4.984
  119    HD3  PRO  17           HD3      PRO  17   3.062  -1.257   6.228
  120    H    GLY  18           H        GLY  18  -1.353  -3.894   8.147
  121    HA2  GLY  18           HA2      GLY  18  -3.568  -4.156   7.707
  122    HA3  GLY  18           HA3      GLY  18  -3.353  -2.954   6.441
  123    H    ALA  19           H        ALA  19  -4.031  -3.642   4.589
  124    HA   ALA  19           HA       ALA  19  -3.582  -6.445   3.832
  125    HB1  ALA  19           HB1      ALA  19  -5.964  -5.945   4.119
  126    HB2  ALA  19           HB2      ALA  19  -5.595  -6.222   2.417
  127    HB3  ALA  19           HB3      ALA  19  -5.822  -4.579   3.013
  128    H    CYS  20           H        CYS  20  -1.989  -3.886   3.582
  129    HA   CYS  20           HA       CYS  20  -2.109  -3.189   0.817
  130    HB2  CYS  20           HB2      CYS  20  -0.213  -2.406   2.989
  131    HB3  CYS  20           HB3      CYS  20  -0.277  -1.713   1.378
  132    H    ILE  21           H        ILE  21  -0.652  -3.500  -0.651
  133    HA   ILE  21           HA       ILE  21   1.470  -5.450  -0.163
  134    HB   ILE  21           HB       ILE  21   1.210  -6.111  -2.553
  135   HG12  ILE  21          HG12      ILE  21  -1.309  -4.418  -2.463
  136   HG13  ILE  21          HG13      ILE  21   0.147  -4.031  -3.369
  137   HG21  ILE  21          HG21      ILE  21   0.178  -7.481  -0.849
  138   HG22  ILE  21          HG22      ILE  21  -0.854  -7.436  -2.280
  139   HG23  ILE  21          HG23      ILE  21  -1.263  -6.465  -0.866
  140   HD11  ILE  21          HD11      ILE  21  -1.658  -6.395  -3.834
  141   HD12  ILE  21          HD12      ILE  21  -0.192  -6.023  -4.741
  142   HD13  ILE  21          HD13      ILE  21  -1.576  -4.931  -4.815
  143    H    CYS  22           H        CYS  22   3.022  -5.107  -2.286
  144    HA   CYS  22           HA       CYS  22   3.826  -2.330  -1.946
  145    HB2  CYS  22           HB2      CYS  22   5.487  -4.162  -1.592
  146    HB3  CYS  22           HB3      CYS  22   5.285  -4.624  -3.276
  147    H    ARG  23           H        ARG  23   3.255  -0.876  -3.436
  148    HA   ARG  23           HA       ARG  23   2.078  -1.810  -5.896
  149    HB2  ARG  23           HB2      ARG  23   2.386   0.992  -4.862
  150    HB3  ARG  23           HB3      ARG  23   1.249   0.419  -6.057
  151    HG2  ARG  23           HG2      ARG  23   1.228  -0.465  -3.189
  152    HG3  ARG  23           HG3      ARG  23   0.246   0.848  -3.817
  153    HD2  ARG  23           HD2      ARG  23   0.152  -1.943  -4.952
  154    HD3  ARG  23           HD3      ARG  23  -0.851  -1.447  -3.591
  155    HE   ARG  23           HE       ARG  23  -1.384   0.442  -5.375
  156   HH11  ARG  23          HH11      ARG  23  -1.174  -3.058  -5.928
  157   HH12  ARG  23          HH12      ARG  23  -2.548  -3.119  -6.911
  158   HH21  ARG  23          HH21      ARG  23  -3.285   0.339  -6.786
  159   HH22  ARG  23          HH22      ARG  23  -3.749  -1.178  -7.428
  160    H    GLY  24           H        GLY  24   2.679  -0.720  -7.855
  161    HA2  GLY  24           HA2      GLY  24   5.494  -0.876  -8.350
  162    HA3  GLY  24           HA3      GLY  24   4.265  -0.436  -9.521
  163    H    ASN  25           H        ASN  25   3.784   1.568  -7.065
  164    HA   ASN  25           HA       ASN  25   5.336   3.689  -8.290
  165    HB2  ASN  25           HB2      ASN  25   4.027   5.212  -6.725
  166    HB3  ASN  25           HB3      ASN  25   3.055   4.336  -7.895
  167   HD21  ASN  25          HD21      ASN  25   1.196   4.563  -6.641
  168   HD22  ASN  25          HD22      ASN  25   0.957   3.698  -5.175
  169    H    GLY  26           H        GLY  26   5.415   1.611  -5.560
  170    HA2  GLY  26           HA2      GLY  26   7.586   1.277  -4.570
  171    HA3  GLY  26           HA3      GLY  26   7.843   3.016  -4.670
  172    H    TYR  27           H        TYR  27   4.735   2.515  -3.868
  173    HA   TYR  27           HA       TYR  27   5.268   2.901  -1.024
  174    HB2  TYR  27           HB2      TYR  27   3.233   3.913  -2.920
  175    HB3  TYR  27           HB3      TYR  27   3.031   4.115  -1.163
  176    HD1  TYR  27           HD1      TYR  27   4.731   5.229  -4.200
  177    HD2  TYR  27           HD2      TYR  27   4.580   5.655   0.023
  178    HE1  TYR  27           HE1      TYR  27   6.057   7.272  -4.374
  179    HE2  TYR  27           HE2      TYR  27   5.902   7.702  -0.126
  180    HH   TYR  27           HH       TYR  27   6.508   9.235  -3.146
  181    H    CYS  28           H        CYS  28   3.587   2.107   0.349
  182    HA   CYS  28           HA       CYS  28   2.564  -0.444  -0.493
  183    HB2  CYS  28           HB2      CYS  28   2.230   1.088   2.087
  184    HB3  CYS  28           HB3      CYS  28   1.633  -0.544   1.812
  185    H    GLY  29           H        GLY  29   0.458  -0.951  -0.896
  186    HA2  GLY  29           HA2      GLY  29  -1.602   0.993  -0.391
  187    HA3  GLY  29           HA3      GLY  29  -1.273   0.663  -2.094
  188    H    GLU  30           H        GLU  30  -3.597   0.067  -0.378
  189    HA   GLU  30           HA       GLU  30  -3.796  -2.628   0.167
  190    HB2  GLU  30           HB2      GLU  30  -5.339  -1.005   0.979
  191    HB3  GLU  30           HB3      GLU  30  -5.908  -0.663  -0.664
  192    HG2  GLU  30           HG2      GLU  30  -6.765  -3.000  -0.732
  193    HG3  GLU  30           HG3      GLU  30  -6.302  -3.168   0.963
  194    H    ALA  31           H        ALA  31  -4.789  -4.235  -0.937
  195    HA   ALA  31           HA       ALA  31  -4.120  -4.362  -3.726
  196    HB1  ALA  31           HB1      ALA  31  -5.174  -6.418  -1.771
  197    HB2  ALA  31           HB2      ALA  31  -3.488  -6.189  -2.223
  198    HB3  ALA  31           HB3      ALA  31  -4.646  -6.764  -3.420
  199    H    ILE  32           H        ILE  32  -6.272  -6.315  -4.084
  200    HA   ILE  32           HA       ILE  32  -8.266  -4.281  -4.608
  201    HB   ILE  32           HB       ILE  32  -8.111  -7.023  -5.843
  202   HG12  ILE  32          HG12      ILE  32  -6.287  -5.583  -6.596
  203   HG13  ILE  32          HG13      ILE  32  -7.412  -5.878  -7.912
  204   HG21  ILE  32          HG21      ILE  32  -9.944  -4.731  -6.528
  205   HG22  ILE  32          HG22      ILE  32 -10.407  -6.257  -5.775
  206   HG23  ILE  32          HG23      ILE  32  -9.809  -6.238  -7.434
  207   HD11  ILE  32          HD11      ILE  32  -7.204  -3.364  -6.255
  208   HD12  ILE  32          HD12      ILE  32  -8.400  -3.649  -7.515
  209   HD13  ILE  32          HD13      ILE  32  -6.689  -3.572  -7.930
  210    H    TYR  33           H        TYR  33 -10.216  -4.375  -3.964
  211    HA   TYR  33           HA       TYR  33 -11.621  -6.454  -2.718
  212    HB2  TYR  33           HB2      TYR  33  -9.800  -5.672  -0.957
  213    HB3  TYR  33           HB3      TYR  33 -10.762  -4.211  -0.850
  214    HD1  TYR  33           HD2      TYR  33 -10.953  -7.902  -0.421
  215    HD2  TYR  33           HD1      TYR  33 -12.569  -4.132   0.652
  216    HE1  TYR  33           HE2      TYR  33 -12.309  -8.986   1.310
  217    HE2  TYR  33           HE1      TYR  33 -13.926  -5.193   2.396
  218    HH   TYR  33           HH       TYR  33 -14.862  -7.447   2.923
  219    H    ALA  34           H        ALA  34 -13.806  -5.484  -2.316
  220    HA   ALA  34           HA       ALA  34 -14.222  -3.294  -4.117
  221    HB1  ALA  34           HB1      ALA  34 -16.256  -4.640  -2.334
  222    HB2  ALA  34           HB2      ALA  34 -15.841  -5.158  -3.965
  223    HB3  ALA  34           HB3      ALA  34 -16.600  -3.588  -3.703
  224    H    ALA  35           H        ALA  35 -14.974  -3.746  -0.723
  225    HA   ALA  35           HA       ALA  35 -15.294  -0.918  -0.272
  226    HB1  ALA  35           HB1      ALA  35 -16.632  -2.543   0.972
  227    HB2  ALA  35           HB2      ALA  35 -15.621  -1.603   2.073
  228    HB3  ALA  35           HB3      ALA  35 -15.164  -3.251   1.645
  229    HA   PRO  36           HA       PRO  36 -10.970  -0.343   0.974
  230    HB2  PRO  36           HB2      PRO  36 -11.867   1.532   3.055
  231    HB3  PRO  36           HB3      PRO  36 -10.877   1.868   1.633
  232    HG2  PRO  36           HG2      PRO  36 -13.407   2.772   1.845
  233    HG3  PRO  36           HG3      PRO  36 -12.705   2.287   0.292
  234    HD2  PRO  36           HD2      PRO  36 -14.581   0.779   2.074
  235    HD3  PRO  36           HD3      PRO  36 -14.575   0.927   0.301
  236    H    PHE  37           H        PHE  37  -9.872  -1.693   2.394
  237    HA   PHE  37           HA       PHE  37 -11.426  -2.569   4.707
  238    HB2  PHE  37           HB2      PHE  37 -11.108  -4.342   3.032
  239    HB3  PHE  37           HB3      PHE  37  -9.368  -4.107   3.106
  240    HD1  PHE  37           HD2      PHE  37 -12.306  -5.099   5.152
  241    HD2  PHE  37           HD1      PHE  37  -8.083  -5.285   4.658
  242    HE1  PHE  37           HE2      PHE  37 -12.173  -6.745   6.965
  243    HE2  PHE  37           HE1      PHE  37  -7.939  -6.934   6.477
  244    HZ   PHE  37           HZ       PHE  37  -9.978  -7.668   7.634
  245    H    ALA  38           H        ALA  38  -8.202  -1.922   3.500
  246    HA   ALA  38           HA       ALA  38  -7.482  -0.784   6.023
  247    HB1  ALA  38           HB1      ALA  38  -5.945  -3.175   5.002
  248    HB2  ALA  38           HB2      ALA  38  -7.008  -3.175   6.404
  249    HB3  ALA  38           HB3      ALA  38  -5.539  -2.194   6.415
  250    H    ARG  39           H        ARG  39  -7.506   0.942   4.540
  251    HA   ARG  39           HA       ARG  39  -5.562   1.053   2.429
  252    HB2  ARG  39           HB2      ARG  39  -6.988   3.356   3.744
  253    HB3  ARG  39           HB3      ARG  39  -6.243   3.334   2.163
  254    HG2  ARG  39           HG2      ARG  39  -8.675   1.735   2.937
  255    HG3  ARG  39           HG3      ARG  39  -8.694   3.238   2.023
  256    HD2  ARG  39           HD2      ARG  39  -7.322   0.694   1.162
  257    HD3  ARG  39           HD3      ARG  39  -8.905   1.222   0.611
  258    HE   ARG  39           HE       ARG  39  -6.998   3.253   0.113
  259   HH11  ARG  39          HH11      ARG  39  -7.948   0.030  -1.098
  260   HH12  ARG  39          HH12      ARG  39  -7.422   0.355  -2.681
  261   HH21  ARG  39          HH21      ARG  39  -6.328   3.670  -1.992
  262   HH22  ARG  39          HH22      ARG  39  -6.452   2.486  -3.220
  Start of MODEL    7
    1    H1   CYS   1           H        CYS   1  -6.146   1.500   4.188
    2    HA   CYS   1           HA       CYS   1  -4.117   1.566   6.286
    3    HB2  CYS   1           HB2      CYS   1  -4.663  -0.642   5.606
    4    HB3  CYS   1           HB3      CYS   1  -4.550  -0.236   3.902
    5    H    GLU   2           H        GLU   2  -4.835   3.280   3.830
    6    HA   GLU   2           HA       GLU   2  -2.067   3.760   2.954
    7    HB2  GLU   2           HB2      GLU   2  -4.630   4.370   1.537
    8    HB3  GLU   2           HB3      GLU   2  -3.101   5.088   1.065
    9    HG2  GLU   2           HG2      GLU   2  -2.198   2.808   0.761
   10    HG3  GLU   2           HG3      GLU   2  -3.815   2.176   1.074
   11    H    ALA   3           H        ALA   3  -1.551   5.991   2.327
   12    HA   ALA   3           HA       ALA   3  -2.820   8.067   3.838
   13    HB1  ALA   3           HB1      ALA   3  -1.215   7.156   5.437
   14    HB2  ALA   3           HB2      ALA   3  -0.631   8.709   4.828
   15    HB3  ALA   3           HB3      ALA   3   0.057   7.207   4.218
   16    H    ILE   4           H        ILE   4  -2.805   9.752   2.539
   17    HA   ILE   4           HA       ILE   4  -1.284   9.565   0.056
   18    HB   ILE   4           HB       ILE   4  -3.554  11.467   0.760
   19   HG12  ILE   4          HG12      ILE   4  -3.579   8.996  -0.981
   20   HG13  ILE   4          HG13      ILE   4  -4.203   9.055   0.659
   21   HG21  ILE   4          HG21      ILE   4  -2.093  12.372  -0.987
   22   HG22  ILE   4          HG22      ILE   4  -3.665  11.915  -1.652
   23   HG23  ILE   4          HG23      ILE   4  -2.262  10.876  -1.911
   24   HD11  ILE   4          HD11      ILE   4  -5.874  10.702  -0.058
   25   HD12  ILE   4          HD12      ILE   4  -5.992   9.203  -0.982
   26   HD13  ILE   4          HD13      ILE   4  -5.233  10.626  -1.698
   27    H    TYR   5           H        TYR   5  -1.293  11.408   2.942
   28    HA   TYR   5           HA       TYR   5   0.214  13.585   1.734
   29    HB2  TYR   5           HB2      TYR   5  -1.410  14.041   3.538
   30    HB3  TYR   5           HB3      TYR   5  -0.461  13.050   4.622
   31    HD1  TYR   5           HD2      TYR   5  -0.094  16.054   2.453
   32    HD2  TYR   5           HD1      TYR   5   1.160  14.027   5.972
   33    HE1  TYR   5           HE2      TYR   5   1.289  17.966   3.054
   34    HE2  TYR   5           HE1      TYR   5   2.553  15.934   6.586
   35    HH   TYR   5           HH       TYR   5   3.653  17.850   5.460
   36    H    ALA   6           H        ALA   6   0.646  11.016   3.970
   37    HA   ALA   6           HA       ALA   6   3.540  11.210   3.539
   38    HB1  ALA   6           HB1      ALA   6   2.175  10.223   6.054
   39    HB2  ALA   6           HB2      ALA   6   2.980  11.781   5.872
   40    HB3  ALA   6           HB3      ALA   6   3.917  10.290   5.780
   41    H    ALA   7           H        ALA   7   3.345   9.904   1.761
   42    HA   ALA   7           HA       ALA   7   1.981   7.462   1.719
   43    HB1  ALA   7           HB1      ALA   7   3.143   7.064  -0.387
   44    HB2  ALA   7           HB2      ALA   7   4.252   8.387  -0.033
   45    HB3  ALA   7           HB3      ALA   7   2.541   8.719  -0.300
   46    HA   PRO   8           HA       PRO   8   5.100   5.046   3.920
   47    HB2  PRO   8           HB2      PRO   8   3.405   2.733   3.388
   48    HB3  PRO   8           HB3      PRO   8   3.748   3.500   4.937
   49    HG2  PRO   8           HG2      PRO   8   1.301   3.585   3.748
   50    HG3  PRO   8           HG3      PRO   8   1.906   4.854   4.826
   51    HD2  PRO   8           HD2      PRO   8   1.779   4.803   1.840
   52    HD3  PRO   8           HD3      PRO   8   1.459   6.129   2.985
   53    H    LYS   9           H        LYS   9   6.833   4.194   2.969
   54    HA   LYS   9           HA       LYS   9   6.591   3.272   0.200
   55    HB2  LYS   9           HB2      LYS   9   9.076   3.452   0.163
   56    HB3  LYS   9           HB3      LYS   9   8.254   4.973   0.469
   57    HG2  LYS   9           HG2      LYS   9   8.756   4.765   2.845
   58    HG3  LYS   9           HG3      LYS   9   9.568   3.228   2.543
   59    HD2  LYS   9           HD2      LYS   9  11.199   4.354   1.129
   60    HD3  LYS   9           HD3      LYS   9  10.358   5.886   1.363
   61    HE2  LYS   9           HE2      LYS   9  11.658   4.243   3.524
   62    HE3  LYS   9           HE3      LYS   9  12.327   5.704   2.802
   63    HZ1  LYS   9           HZ1      LYS   9  10.390   6.931   3.654
   64    HZ2  LYS   9           HZ2      LYS   9  11.265   6.205   4.883
   65    HZ3  LYS   9           HZ3      LYS   9   9.815   5.529   4.399
   66    H    CYS  10           H        CYS  10   7.737   1.349  -0.483
   67    HA   CYS  10           HA       CYS  10   8.181  -0.619   1.643
   68    HB2  CYS  10           HB2      CYS  10   6.808  -2.229   0.338
   69    HB3  CYS  10           HB3      CYS  10   5.882  -0.913   1.057
   70    H    ARG  11           H        ARG  11   9.390  -2.448   0.930
   71    HA   ARG  11           HA       ARG  11  10.797  -2.093  -1.630
   72    HB2  ARG  11           HB2      ARG  11  11.524  -3.640   0.866
   73    HB3  ARG  11           HB3      ARG  11  12.483  -3.598  -0.600
   74    HG2  ARG  11           HG2      ARG  11  12.969  -1.274  -0.281
   75    HG3  ARG  11           HG3      ARG  11  11.844  -1.193   1.081
   76    HD2  ARG  11           HD2      ARG  11  13.183  -2.755   2.322
   77    HD3  ARG  11           HD3      ARG  11  14.276  -2.943   0.958
   78    HE   ARG  11           HE       ARG  11  14.722  -0.491   1.286
   79   HH11  ARG  11          HH11      ARG  11  13.675  -2.491   4.017
   80   HH12  ARG  11          HH12      ARG  11  14.683  -1.732   5.150
   81   HH21  ARG  11          HH21      ARG  11  16.102   0.571   2.847
   82   HH22  ARG  11          HH22      ARG  11  16.109   0.055   4.469
   83    H    ARG  12           H        ARG  12   9.250  -4.232   0.608
   84    HA   ARG  12           HA       ARG  12   8.507  -6.136  -1.505
   85    HB2  ARG  12           HB2      ARG  12   8.604  -7.828   0.366
   86    HB3  ARG  12           HB3      ARG  12  10.149  -7.285  -0.264
   87    HG2  ARG  12           HG2      ARG  12  10.215  -5.634   1.635
   88    HG3  ARG  12           HG3      ARG  12   8.770  -6.399   2.264
   89    HD2  ARG  12           HD2      ARG  12  10.002  -8.473   2.565
   90    HD3  ARG  12           HD3      ARG  12  11.447  -7.716   1.876
   91    HE   ARG  12           HE       ARG  12  10.492  -6.115   3.954
   92   HH11  ARG  12          HH11      ARG  12  12.065  -9.271   3.558
   93   HH12  ARG  12          HH12      ARG  12  12.854  -9.233   5.062
   94   HH21  ARG  12          HH21      ARG  12  11.620  -6.065   6.044
   95   HH22  ARG  12          HH22      ARG  12  12.590  -7.378   6.491
   96    H    ASP  13           H        ASP  13   6.612  -7.245  -1.024
   97    HA   ASP  13           HA       ASP  13   4.510  -5.517  -0.390
   98    HB2  ASP  13           HB2      ASP  13   4.715  -8.460  -0.837
   99    HB3  ASP  13           HB3      ASP  13   3.198  -7.660  -0.481
  100    H    SER  14           H        SER  14   6.190  -7.921   1.368
  101    HA   SER  14           HA       SER  14   4.426  -8.217   3.514
  102    HB2  SER  14           HB2      SER  14   6.552  -9.055   4.631
  103    HB3  SER  14           HB3      SER  14   5.966  -9.899   3.179
  104    HG   SER  14           HG       SER  14   8.295  -9.011   3.563
  105    H    ASP  15           H        ASP  15   6.679  -5.716   2.748
  106    HA   ASP  15           HA       ASP  15   7.137  -4.717   5.394
  107    HB2  ASP  15           HB2      ASP  15   7.118  -3.120   2.804
  108    HB3  ASP  15           HB3      ASP  15   7.615  -2.480   4.353
  109    H    CYS  16           H        CYS  16   4.502  -4.489   3.160
  110    HA   CYS  16           HA       CYS  16   3.306  -2.273   4.557
  111    HB2  CYS  16           HB2      CYS  16   2.322  -3.904   2.225
  112    HB3  CYS  16           HB3      CYS  16   1.699  -2.355   2.782
  113    HA   PRO  17           HA       PRO  17   1.076  -5.376   6.904
  114    HB2  PRO  17           HB2      PRO  17   0.132  -3.779   8.809
  115    HB3  PRO  17           HB3      PRO  17   1.856  -4.157   8.719
  116    HG2  PRO  17           HG2      PRO  17   0.417  -1.681   7.874
  117    HG3  PRO  17           HG3      PRO  17   2.001  -1.847   8.648
  118    HD2  PRO  17           HD2      PRO  17   1.565  -1.474   5.919
  119    HD3  PRO  17           HD3      PRO  17   3.059  -2.090   6.653
  120    H    GLY  18           H        GLY  18  -1.218  -5.334   7.954
  121    HA2  GLY  18           HA2      GLY  18  -3.466  -5.340   7.681
  122    HA3  GLY  18           HA3      GLY  18  -3.287  -3.745   6.963
  123    H    ALA  19           H        ALA  19  -4.458  -3.786   5.191
  124    HA   ALA  19           HA       ALA  19  -4.403  -6.124   3.461
  125    HB1  ALA  19           HB1      ALA  19  -6.086  -3.623   3.319
  126    HB2  ALA  19           HB2      ALA  19  -6.576  -5.157   4.037
  127    HB3  ALA  19           HB3      ALA  19  -6.270  -5.053   2.303
  128    H    CYS  20           H        CYS  20  -2.273  -3.763   3.813
  129    HA   CYS  20           HA       CYS  20  -2.248  -2.772   1.135
  130    HB2  CYS  20           HB2      CYS  20  -0.461  -2.323   3.489
  131    HB3  CYS  20           HB3      CYS  20  -0.133  -1.689   1.888
  132    H    ILE  21           H        ILE  21  -0.713  -3.023  -0.271
  133    HA   ILE  21           HA       ILE  21   1.245  -5.132   0.084
  134    HB   ILE  21           HB       ILE  21   0.895  -5.699  -2.370
  135   HG12  ILE  21          HG12      ILE  21  -1.524  -5.357  -3.195
  136   HG13  ILE  21          HG13      ILE  21  -1.666  -4.131  -1.951
  137   HG21  ILE  21          HG21      ILE  21   0.237  -7.243  -0.679
  138   HG22  ILE  21          HG22      ILE  21  -0.992  -7.237  -1.946
  139   HG23  ILE  21          HG23      ILE  21  -1.284  -6.391  -0.429
  140   HD11  ILE  21          HD11      ILE  21   0.129  -2.852  -3.034
  141   HD12  ILE  21          HD12      ILE  21  -1.232  -3.134  -4.118
  142   HD13  ILE  21          HD13      ILE  21   0.243  -4.088  -4.287
  143    H    CYS  22           H        CYS  22   2.808  -4.856  -2.020
  144    HA   CYS  22           HA       CYS  22   3.576  -2.058  -1.732
  145    HB2  CYS  22           HB2      CYS  22   5.222  -3.813  -1.085
  146    HB3  CYS  22           HB3      CYS  22   5.221  -4.391  -2.752
  147    H    ARG  23           H        ARG  23   2.877  -0.788  -3.334
  148    HA   ARG  23           HA       ARG  23   1.985  -1.876  -5.792
  149    HB2  ARG  23           HB2      ARG  23   2.353   0.963  -4.885
  150    HB3  ARG  23           HB3      ARG  23   1.583   0.461  -6.378
  151    HG2  ARG  23           HG2      ARG  23  -0.125  -0.709  -5.122
  152    HG3  ARG  23           HG3      ARG  23   0.649  -0.217  -3.622
  153    HD2  ARG  23           HD2      ARG  23  -0.331   1.724  -5.695
  154    HD3  ARG  23           HD3      ARG  23  -1.278   1.243  -4.293
  155    HE   ARG  23           HE       ARG  23   1.388   2.345  -3.860
  156   HH11  ARG  23          HH11      ARG  23  -2.099   2.848  -3.801
  157   HH12  ARG  23          HH12      ARG  23  -2.099   4.092  -2.656
  158   HH21  ARG  23          HH21      ARG  23   1.457   4.229  -2.355
  159   HH22  ARG  23          HH22      ARG  23   0.007   4.958  -1.878
  160    H    GLY  24           H        GLY  24   2.643  -0.743  -7.842
  161    HA2  GLY  24           HA2      GLY  24   5.322  -1.424  -8.433
  162    HA3  GLY  24           HA3      GLY  24   4.192  -0.630  -9.517
  163    H    ASN  25           H        ASN  25   3.965   1.417  -7.246
  164    HA   ASN  25           HA       ASN  25   6.106   3.109  -8.213
  165    HB2  ASN  25           HB2      ASN  25   4.956   4.905  -6.845
  166    HB3  ASN  25           HB3      ASN  25   4.010   4.208  -8.147
  167   HD21  ASN  25          HD21      ASN  25   2.130   4.859  -7.232
  168   HD22  ASN  25          HD22      ASN  25   1.390   4.136  -5.869
  169    H    GLY  26           H        GLY  26   5.515   1.151  -5.500
  170    HA2  GLY  26           HA2      GLY  26   7.353   0.501  -4.127
  171    HA3  GLY  26           HA3      GLY  26   8.087   2.075  -4.429
  172    H    TYR  27           H        TYR  27   4.792   2.153  -3.861
  173    HA   TYR  27           HA       TYR  27   5.192   2.843  -1.070
  174    HB2  TYR  27           HB2      TYR  27   3.459   3.918  -3.217
  175    HB3  TYR  27           HB3      TYR  27   3.221   4.387  -1.512
  176    HD1  TYR  27           HD2      TYR  27   5.551   5.220  -0.420
  177    HD2  TYR  27           HD1      TYR  27   4.651   5.331  -4.570
  178    HE1  TYR  27           HE2      TYR  27   7.285   6.909  -0.746
  179    HE2  TYR  27           HE1      TYR  27   6.398   7.019  -4.911
  180    HH   TYR  27           HH       TYR  27   8.766   7.613  -2.684
  181    H    CYS  28           H        CYS  28   3.605   2.170   0.318
  182    HA   CYS  28           HA       CYS  28   2.335  -0.290  -0.320
  183    HB2  CYS  28           HB2      CYS  28   2.087   1.490   2.103
  184    HB3  CYS  28           HB3      CYS  28   1.410  -0.128   1.973
  185    H    GLY  29           H        GLY  29   0.390  -0.657  -1.045
  186    HA2  GLY  29           HA2      GLY  29  -1.613   1.483  -0.885
  187    HA3  GLY  29           HA3      GLY  29  -1.320   0.619  -2.392
  188    H    GLU  30           H        GLU  30  -3.772   0.712  -0.912
  189    HA   GLU  30           HA       GLU  30  -3.904  -1.735   0.459
  190    HB2  GLU  30           HB2      GLU  30  -5.158   0.347   1.090
  191    HB3  GLU  30           HB3      GLU  30  -6.186   0.104  -0.312
  192    HG2  GLU  30           HG2      GLU  30  -7.179  -1.806   0.645
  193    HG3  GLU  30           HG3      GLU  30  -5.913  -1.943   1.874
  194    H    ALA  31           H        ALA  31  -6.157  -2.982  -0.297
  195    HA   ALA  31           HA       ALA  31  -5.215  -4.436  -2.518
  196    HB1  ALA  31           HB1      ALA  31  -6.334  -5.470  -0.603
  197    HB2  ALA  31           HB2      ALA  31  -7.107  -5.886  -2.136
  198    HB3  ALA  31           HB3      ALA  31  -7.834  -4.679  -1.075
  199    H    ILE  32           H        ILE  32  -8.461  -3.086  -2.110
  200    HA   ILE  32           HA       ILE  32  -8.332  -2.215  -4.854
  201    HB   ILE  32           HB       ILE  32 -10.643  -3.819  -3.711
  202   HG12  ILE  32          HG12      ILE  32  -8.664  -4.643  -5.856
  203   HG13  ILE  32          HG13      ILE  32  -8.693  -5.258  -4.208
  204   HG21  ILE  32          HG21      ILE  32 -10.271  -2.758  -6.496
  205   HG22  ILE  32          HG22      ILE  32 -11.436  -2.181  -5.301
  206   HG23  ILE  32          HG23      ILE  32 -11.591  -3.807  -5.976
  207   HD11  ILE  32          HD11      ILE  32 -10.862  -5.614  -6.260
  208   HD12  ILE  32          HD12      ILE  32 -10.874  -6.267  -4.622
  209   HD13  ILE  32          HD13      ILE  32  -9.675  -6.826  -5.789
  210    H    TYR  33           H        TYR  33  -9.752  -0.383  -5.183
  211    HA   TYR  33           HA       TYR  33 -10.708   0.812  -2.723
  212    HB2  TYR  33           HB2      TYR  33 -10.533   1.982  -5.510
  213    HB3  TYR  33           HB3      TYR  33 -10.921   2.841  -4.030
  214    HD1  TYR  33           HD1      TYR  33  -9.031   2.682  -2.156
  215    HD2  TYR  33           HD2      TYR  33  -8.395   2.088  -6.305
  216    HE1  TYR  33           HE1      TYR  33  -6.637   3.188  -1.864
  217    HE2  TYR  33           HE2      TYR  33  -6.014   2.592  -6.029
  218    HH   TYR  33           HH       TYR  33  -4.596   2.855  -2.861
  219    H    ALA  34           H        ALA  34 -12.542  -0.328  -2.359
  220    HA   ALA  34           HA       ALA  34 -14.871   0.327  -3.832
  221    HB1  ALA  34           HB1      ALA  34 -14.076  -1.409  -5.352
  222    HB2  ALA  34           HB2      ALA  34 -15.506  -1.989  -4.494
  223    HB3  ALA  34           HB3      ALA  34 -13.895  -2.530  -4.010
  224    H    ALA  35           H        ALA  35 -14.320  -2.728  -2.139
  225    HA   ALA  35           HA       ALA  35 -15.949  -1.704  -0.064
  226    HB1  ALA  35           HB1      ALA  35 -15.938  -3.918   1.034
  227    HB2  ALA  35           HB2      ALA  35 -14.745  -4.518  -0.117
  228    HB3  ALA  35           HB3      ALA  35 -16.349  -4.065  -0.660
  229    HA   PRO  36           HA       PRO  36 -11.783  -1.568   2.314
  230    HB2  PRO  36           HB2      PRO  36  -9.926  -1.540   0.009
  231    HB3  PRO  36           HB3      PRO  36  -9.764  -2.403   1.539
  232    HG2  PRO  36           HG2      PRO  36 -10.301  -3.651  -0.795
  233    HG3  PRO  36           HG3      PRO  36 -10.892  -4.242   0.769
  234    HD2  PRO  36           HD2      PRO  36 -12.481  -2.736  -1.347
  235    HD3  PRO  36           HD3      PRO  36 -12.971  -3.995  -0.232
  236    H    PHE  37           H        PHE  37 -11.032   0.562   2.621
  237    HA   PHE  37           HA       PHE  37 -11.971   2.425   0.561
  238    HB2  PHE  37           HB2      PHE  37 -13.513   2.124   2.485
  239    HB3  PHE  37           HB3      PHE  37 -12.254   2.688   3.562
  240    HD1  PHE  37           HD1      PHE  37 -14.090   3.781   0.505
  241    HD2  PHE  37           HD2      PHE  37 -12.335   4.875   4.222
  242    HE1  PHE  37           HE1      PHE  37 -14.924   6.076   0.225
  243    HE2  PHE  37           HE2      PHE  37 -13.154   7.162   3.944
  244    HZ   PHE  37           HZ       PHE  37 -14.449   7.771   1.950
  245    H    ALA  38           H        ALA  38  -9.192   1.419   1.263
  246    HA   ALA  38           HA       ALA  38  -7.082   2.199   1.160
  247    HB1  ALA  38           HB1      ALA  38  -7.999   3.814  -0.517
  248    HB2  ALA  38           HB2      ALA  38  -6.624   4.448   0.385
  249    HB3  ALA  38           HB3      ALA  38  -8.258   4.965   0.795
  250    H    ARG  39           H        ARG  39  -8.188   1.749   3.532
  251    HA   ARG  39           HA       ARG  39  -7.853   3.957   5.349
  252    HB2  ARG  39           HB2      ARG  39  -8.452   1.076   5.834
  253    HB3  ARG  39           HB3      ARG  39  -8.479   2.326   7.072
  254    HG2  ARG  39           HG2      ARG  39 -10.333   3.422   5.996
  255    HG3  ARG  39           HG3      ARG  39 -10.238   2.314   4.629
  256    HD2  ARG  39           HD2      ARG  39 -10.795   0.441   6.132
  257    HD3  ARG  39           HD3      ARG  39 -10.893   1.571   7.472
  258    HE   ARG  39           HE       ARG  39 -12.738   2.617   6.396
  259   HH11  ARG  39          HH11      ARG  39 -11.891  -0.565   5.053
  260   HH12  ARG  39          HH12      ARG  39 -13.464  -0.925   4.546
  261   HH21  ARG  39          HH21      ARG  39 -14.913   2.116   5.650
  262   HH22  ARG  39          HH22      ARG  39 -15.208   0.636   4.853
  Start of MODEL    8
    1    H1   CYS   1           H        CYS   1  -3.957   2.382   3.371
    2    HA   CYS   1           HA       CYS   1  -2.534   2.704   5.957
    3    HB2  CYS   1           HB2      CYS   1  -0.920   1.003   5.200
    4    HB3  CYS   1           HB3      CYS   1  -2.553   0.336   5.272
    5    H    GLU   2           H        GLU   2  -3.194   4.292   3.506
    6    HA   GLU   2           HA       GLU   2  -0.547   4.816   2.404
    7    HB2  GLU   2           HB2      GLU   2  -3.234   5.881   1.568
    8    HB3  GLU   2           HB3      GLU   2  -1.710   6.123   0.727
    9    HG2  GLU   2           HG2      GLU   2  -1.599   3.708   0.296
   10    HG3  GLU   2           HG3      GLU   2  -3.159   3.511   1.099
   11    H    ALA   3           H        ALA   3  -0.141   7.251   1.947
   12    HA   ALA   3           HA       ALA   3  -1.211   9.175   3.631
   13    HB1  ALA   3           HB1      ALA   3   1.531   8.082   4.313
   14    HB2  ALA   3           HB2      ALA   3   0.108   7.992   5.344
   15    HB3  ALA   3           HB3      ALA   3   0.835   9.556   4.978
   16    H    ILE   4           H        ILE   4  -0.491  11.105   2.895
   17    HA   ILE   4           HA       ILE   4   1.178  10.992   0.489
   18    HB   ILE   4           HB       ILE   4  -0.813  13.156   1.293
   19   HG12  ILE   4          HG12      ILE   4  -1.064  10.969  -0.794
   20   HG13  ILE   4          HG13      ILE   4  -1.890  10.991   0.758
   21   HG21  ILE   4          HG21      ILE   4   0.668  12.743  -1.316
   22   HG22  ILE   4          HG22      ILE   4   0.983  14.020  -0.143
   23   HG23  ILE   4          HG23      ILE   4  -0.553  13.980  -1.010
   24   HD11  ILE   4          HD11      ILE   4  -2.268  12.973  -1.479
   25   HD12  ILE   4          HD12      ILE   4  -3.111  12.995   0.070
   26   HD13  ILE   4          HD13      ILE   4  -3.366  11.661  -1.054
   27    H    TYR   5           H        TYR   5   1.059  12.243   3.677
   28    HA   TYR   5           HA       TYR   5   3.117  14.242   3.178
   29    HB2  TYR   5           HB2      TYR   5   1.281  14.586   4.878
   30    HB3  TYR   5           HB3      TYR   5   1.977  13.272   5.807
   31    HD1  TYR   5           HD1      TYR   5   2.550  16.704   4.626
   32    HD2  TYR   5           HD2      TYR   5   3.930  13.597   7.176
   33    HE1  TYR   5           HE1      TYR   5   4.034  18.285   5.739
   34    HE2  TYR   5           HE2      TYR   5   5.427  15.180   8.303
   35    HH   TYR   5           HH       TYR   5   5.132  18.521   7.876
   36    H    ALA   6           H        ALA   6   2.676  11.216   4.811
   37    HA   ALA   6           HA       ALA   6   5.579  10.823   4.690
   38    HB1  ALA   6           HB1      ALA   6   4.860  11.039   7.028
   39    HB2  ALA   6           HB2      ALA   6   5.421   9.399   6.689
   40    HB3  ALA   6           HB3      ALA   6   3.693   9.738   6.793
   41    H    ALA   7           H        ALA   7   5.159  10.044   2.609
   42    HA   ALA   7           HA       ALA   7   3.356   7.975   2.072
   43    HB1  ALA   7           HB1      ALA   7   4.190   9.500   0.354
   44    HB2  ALA   7           HB2      ALA   7   4.493   7.819  -0.087
   45    HB3  ALA   7           HB3      ALA   7   5.806   8.820   0.531
   46    HA   PRO   8           HA       PRO   8   5.828   4.778   3.942
   47    HB2  PRO   8           HB2      PRO   8   4.008   2.806   3.716
   48    HB3  PRO   8           HB3      PRO   8   3.856   4.090   4.921
   49    HG2  PRO   8           HG2      PRO   8   2.448   3.753   2.316
   50    HG3  PRO   8           HG3      PRO   8   1.825   4.371   3.854
   51    HD2  PRO   8           HD2      PRO   8   2.605   5.942   1.728
   52    HD3  PRO   8           HD3      PRO   8   2.538   6.484   3.416
   53    H    LYS   9           H        LYS   9   7.407   3.870   2.863
   54    HA   LYS   9           HA       LYS   9   7.083   3.141   0.089
   55    HB2  LYS   9           HB2      LYS   9   9.510   3.100   1.870
   56    HB3  LYS   9           HB3      LYS   9   9.493   2.780   0.143
   57    HG2  LYS   9           HG2      LYS   9   8.728   5.058  -0.269
   58    HG3  LYS   9           HG3      LYS   9   8.775   5.380   1.468
   59    HD2  LYS   9           HD2      LYS   9  11.154   4.873   1.500
   60    HD3  LYS   9           HD3      LYS   9  11.098   4.522  -0.226
   61    HE2  LYS   9           HE2      LYS   9  10.464   6.831  -0.684
   62    HE3  LYS   9           HE3      LYS   9  10.488   7.176   1.048
   63    HZ1  LYS   9           HZ1      LYS   9  12.553   7.870  -0.033
   64    HZ2  LYS   9           HZ2      LYS   9  12.822   6.301  -0.560
   65    HZ3  LYS   9           HZ3      LYS   9  12.834   6.644   1.089
   66    H    CYS  10           H        CYS  10   7.952   1.080  -0.669
   67    HA   CYS  10           HA       CYS  10   7.917  -1.040   1.330
   68    HB2  CYS  10           HB2      CYS  10   6.518  -2.429  -0.130
   69    HB3  CYS  10           HB3      CYS  10   5.669  -0.971   0.370
   70    H    ARG  11           H        ARG  11   9.196  -2.776   0.818
   71    HA   ARG  11           HA       ARG  11  10.823  -2.613  -1.638
   72    HB2  ARG  11           HB2      ARG  11  11.375  -3.955   1.016
   73    HB3  ARG  11           HB3      ARG  11  12.466  -3.924  -0.361
   74    HG2  ARG  11           HG2      ARG  11  12.874  -1.623  -0.112
   75    HG3  ARG  11           HG3      ARG  11  11.503  -1.439   0.988
   76    HD2  ARG  11           HD2      ARG  11  14.000  -3.017   1.545
   77    HD3  ARG  11           HD3      ARG  11  13.618  -1.407   2.165
   78    HE   ARG  11           HE       ARG  11  11.507  -3.114   2.819
   79   HH11  ARG  11          HH11      ARG  11  14.899  -2.583   3.702
   80   HH12  ARG  11          HH12      ARG  11  14.739  -3.258   5.249
   81   HH21  ARG  11          HH21      ARG  11  11.269  -3.934   4.940
   82   HH22  ARG  11          HH22      ARG  11  12.639  -4.051   5.987
   83    H    ARG  12           H        ARG  12   9.113  -4.545   0.688
   84    HA   ARG  12           HA       ARG  12   8.288  -6.495  -1.323
   85    HB2  ARG  12           HB2      ARG  12   8.361  -8.140   0.562
   86    HB3  ARG  12           HB3      ARG  12   9.925  -7.705  -0.102
   87    HG2  ARG  12           HG2      ARG  12  10.107  -6.059   1.819
   88    HG3  ARG  12           HG3      ARG  12   8.651  -6.799   2.475
   89    HD2  ARG  12           HD2      ARG  12   9.794  -8.952   2.569
   90    HD3  ARG  12           HD3      ARG  12  11.245  -8.200   1.899
   91    HE   ARG  12           HE       ARG  12  10.075  -7.276   4.424
   92   HH11  ARG  12          HH11      ARG  12  12.843  -8.587   2.634
   93   HH12  ARG  12          HH12      ARG  12  13.951  -8.346   3.895
   94   HH21  ARG  12          HH21      ARG  12  11.601  -6.976   6.167
   95   HH22  ARG  12          HH22      ARG  12  13.213  -7.455   5.977
   96    H    ASP  13           H        ASP  13   6.375  -7.572  -0.629
   97    HA   ASP  13           HA       ASP  13   4.420  -5.625  -0.137
   98    HB2  ASP  13           HB2      ASP  13   4.397  -8.598  -0.380
   99    HB3  ASP  13           HB3      ASP  13   2.952  -7.669  -0.061
  100    H    SER  14           H        SER  14   5.991  -7.954   1.791
  101    HA   SER  14           HA       SER  14   4.267  -7.917   4.023
  102    HB2  SER  14           HB2      SER  14   6.314  -8.774   5.198
  103    HB3  SER  14           HB3      SER  14   5.737  -9.724   3.809
  104    HG   SER  14           HG       SER  14   7.784  -9.525   3.365
  105    H    ASP  15           H        ASP  15   6.559  -5.660   2.899
  106    HA   ASP  15           HA       ASP  15   7.148  -4.304   5.362
  107    HB2  ASP  15           HB2      ASP  15   7.130  -3.251   2.523
  108    HB3  ASP  15           HB3      ASP  15   7.504  -2.230   3.897
  109    H    CYS  16           H        CYS  16   4.423  -4.452   3.322
  110    HA   CYS  16           HA       CYS  16   3.282  -2.013   4.316
  111    HB2  CYS  16           HB2      CYS  16   2.259  -4.071   2.369
  112    HB3  CYS  16           HB3      CYS  16   1.559  -2.483   2.680
  113    HA   PRO  17           HA       PRO  17   1.085  -4.361   7.385
  114    HB2  PRO  17           HB2      PRO  17  -0.337  -2.403   8.459
  115    HB3  PRO  17           HB3      PRO  17   1.427  -2.392   8.589
  116    HG2  PRO  17           HG2      PRO  17  -0.351  -0.848   6.750
  117    HG3  PRO  17           HG3      PRO  17   1.096  -0.308   7.620
  118    HD2  PRO  17           HD2      PRO  17   1.057  -1.094   4.963
  119    HD3  PRO  17           HD3      PRO  17   2.495  -1.085   6.002
  120    H    GLY  18           H        GLY  18  -1.204  -4.582   8.174
  121    HA2  GLY  18           HA2      GLY  18  -3.382  -5.089   7.880
  122    HA3  GLY  18           HA3      GLY  18  -3.422  -3.741   6.752
  123    H    ALA  19           H        ALA  19  -4.261  -4.332   4.940
  124    HA   ALA  19           HA       ALA  19  -3.632  -6.991   3.841
  125    HB1  ALA  19           HB1      ALA  19  -6.005  -6.617   4.298
  126    HB2  ALA  19           HB2      ALA  19  -5.708  -6.786   2.567
  127    HB3  ALA  19           HB3      ALA  19  -5.982  -5.189   3.265
  128    H    CYS  20           H        CYS  20  -2.292  -4.175   3.672
  129    HA   CYS  20           HA       CYS  20  -2.623  -3.413   0.947
  130    HB2  CYS  20           HB2      CYS  20  -0.633  -2.576   3.033
  131    HB3  CYS  20           HB3      CYS  20  -0.892  -1.789   1.478
  132    H    ILE  21           H        ILE  21  -0.933  -3.323  -0.584
  133    HA   ILE  21           HA       ILE  21   1.097  -5.414  -0.324
  134    HB   ILE  21           HB       ILE  21   0.871  -5.814  -2.749
  135   HG12  ILE  21          HG12      ILE  21  -1.582  -4.031  -2.622
  136   HG13  ILE  21          HG13      ILE  21  -0.045  -3.570  -3.340
  137   HG21  ILE  21          HG21      ILE  21  -0.327  -7.283  -1.245
  138   HG22  ILE  21          HG22      ILE  21  -1.260  -7.039  -2.722
  139   HG23  ILE  21          HG23      ILE  21  -1.713  -6.189  -1.244
  140   HD11  ILE  21          HD11      ILE  21  -1.631  -4.219  -5.046
  141   HD12  ILE  21          HD12      ILE  21  -1.846  -5.792  -4.271
  142   HD13  ILE  21          HD13      ILE  21  -0.291  -5.363  -4.982
  143    H    CYS  22           H        CYS  22   2.739  -4.984  -2.186
  144    HA   CYS  22           HA       CYS  22   3.619  -2.227  -1.850
  145    HB2  CYS  22           HB2      CYS  22   5.210  -4.044  -1.377
  146    HB3  CYS  22           HB3      CYS  22   5.021  -4.664  -3.007
  147    H    ARG  23           H        ARG  23   3.037  -0.765  -3.387
  148    HA   ARG  23           HA       ARG  23   2.025  -1.696  -5.892
  149    HB2  ARG  23           HB2      ARG  23   2.360   1.069  -4.782
  150    HB3  ARG  23           HB3      ARG  23   1.451   0.626  -6.210
  151    HG2  ARG  23           HG2      ARG  23   0.843  -0.374  -3.463
  152    HG3  ARG  23           HG3      ARG  23   0.079   1.035  -4.168
  153    HD2  ARG  23           HD2      ARG  23  -0.046  -1.829  -5.142
  154    HD3  ARG  23           HD3      ARG  23  -1.363  -0.902  -4.434
  155    HE   ARG  23           HE       ARG  23  -0.205   0.138  -6.888
  156   HH11  ARG  23          HH11      ARG  23  -2.921  -1.531  -5.358
  157   HH12  ARG  23          HH12      ARG  23  -3.853  -1.572  -6.782
  158   HH21  ARG  23          HH21      ARG  23  -1.563   0.109  -8.824
  159   HH22  ARG  23          HH22      ARG  23  -3.095  -0.632  -8.743
  160    H    GLY  24           H        GLY  24   2.662  -0.454  -7.848
  161    HA2  GLY  24           HA2      GLY  24   5.471  -0.845  -8.319
  162    HA3  GLY  24           HA3      GLY  24   4.263  -0.377  -9.502
  163    H    ASN  25           H        ASN  25   4.029   1.586  -6.913
  164    HA   ASN  25           HA       ASN  25   5.618   3.668  -8.171
  165    HB2  ASN  25           HB2      ASN  25   4.436   5.202  -6.496
  166    HB3  ASN  25           HB3      ASN  25   3.413   4.465  -7.718
  167   HD21  ASN  25          HD21      ASN  25   1.593   4.824  -6.379
  168   HD22  ASN  25          HD22      ASN  25   1.285   3.817  -5.020
  169    H    GLY  26           H        GLY  26   5.691   1.465  -5.598
  170    HA2  GLY  26           HA2      GLY  26   7.779   0.988  -4.553
  171    HA3  GLY  26           HA3      GLY  26   8.202   2.693  -4.707
  172    H    TYR  27           H        TYR  27   5.015   2.194  -3.846
  173    HA   TYR  27           HA       TYR  27   5.563   2.710  -1.043
  174    HB2  TYR  27           HB2      TYR  27   3.721   3.968  -2.986
  175    HB3  TYR  27           HB3      TYR  27   3.570   4.246  -1.235
  176    HD1  TYR  27           HD2      TYR  27   5.747   5.226  -0.127
  177    HD2  TYR  27           HD1      TYR  27   4.992   5.334  -4.298
  178    HE1  TYR  27           HE2      TYR  27   7.389   7.024  -0.369
  179    HE2  TYR  27           HE1      TYR  27   6.630   7.117  -4.564
  180    HH   TYR  27           HH       TYR  27   7.636   8.832  -3.242
  181    H    CYS  28           H        CYS  28   3.767   2.222   0.277
  182    HA   CYS  28           HA       CYS  28   2.479  -0.256  -0.442
  183    HB2  CYS  28           HB2      CYS  28   2.401   1.402   2.071
  184    HB3  CYS  28           HB3      CYS  28   1.549  -0.126   1.875
  185    H    GLY  29           H        GLY  29   0.387  -0.646  -0.818
  186    HA2  GLY  29           HA2      GLY  29  -1.621   1.315  -0.348
  187    HA3  GLY  29           HA3      GLY  29  -1.229   1.109  -2.055
  188    H    GLU  30           H        GLU  30  -3.657   0.489  -1.514
  189    HA   GLU  30           HA       GLU  30  -4.086  -2.135  -0.653
  190    HB2  GLU  30           HB2      GLU  30  -5.703  -0.439  -0.315
  191    HB3  GLU  30           HB3      GLU  30  -5.736   0.005  -2.008
  192    HG2  GLU  30           HG2      GLU  30  -7.738  -1.059  -1.148
  193    HG3  GLU  30           HG3      GLU  30  -7.054  -1.967  -2.491
  194    H    ALA  31           H        ALA  31  -5.372  -3.604  -2.297
  195    HA   ALA  31           HA       ALA  31  -3.712  -4.209  -4.554
  196    HB1  ALA  31           HB1      ALA  31  -5.398  -5.922  -5.076
  197    HB2  ALA  31           HB2      ALA  31  -6.477  -5.226  -3.866
  198    HB3  ALA  31           HB3      ALA  31  -4.952  -5.963  -3.371
  199    H    ILE  32           H        ILE  32  -6.437  -2.370  -3.946
  200    HA   ILE  32           HA       ILE  32  -6.976  -1.771  -6.721
  201    HB   ILE  32           HB       ILE  32  -8.246  -0.604  -4.207
  202   HG12  ILE  32          HG12      ILE  32  -9.266  -2.852  -5.965
  203   HG13  ILE  32          HG13      ILE  32  -8.573  -3.061  -4.362
  204   HG21  ILE  32          HG21      ILE  32 -10.070   0.071  -5.701
  205   HG22  ILE  32          HG22      ILE  32  -9.197  -0.602  -7.077
  206   HG23  ILE  32          HG23      ILE  32  -8.536   0.781  -6.205
  207   HD11  ILE  32          HD11      ILE  32 -11.104  -1.573  -5.025
  208   HD12  ILE  32          HD12      ILE  32 -10.413  -1.762  -3.414
  209   HD13  ILE  32          HD13      ILE  32 -10.994  -3.176  -4.296
  210    H    TYR  33           H        TYR  33  -6.616   0.421  -7.458
  211    HA   TYR  33           HA       TYR  33  -4.186   1.537  -7.000
  212    HB2  TYR  33           HB2      TYR  33  -5.555   2.064  -8.945
  213    HB3  TYR  33           HB3      TYR  33  -6.672   2.971  -7.939
  214    HD1  TYR  33           HD2      TYR  33  -3.180   2.927  -9.204
  215    HD2  TYR  33           HD1      TYR  33  -6.297   5.263  -7.498
  216    HE1  TYR  33           HE2      TYR  33  -1.866   4.957  -9.593
  217    HE2  TYR  33           HE1      TYR  33  -4.994   7.290  -7.886
  218    HH   TYR  33           HH       TYR  33  -2.584   7.860  -8.116
  219    H    ALA  34           H        ALA  34  -7.160   2.633  -5.443
  220    HA   ALA  34           HA       ALA  34  -5.501   4.094  -3.508
  221    HB1  ALA  34           HB1      ALA  34  -6.813   5.637  -4.890
  222    HB2  ALA  34           HB2      ALA  34  -7.389   5.645  -3.223
  223    HB3  ALA  34           HB3      ALA  34  -8.290   4.773  -4.463
  224    H    ALA  35           H        ALA  35  -5.847   3.610  -1.389
  225    HA   ALA  35           HA       ALA  35  -7.411   1.266  -0.811
  226    HB1  ALA  35           HB1      ALA  35  -6.410   1.416   1.399
  227    HB2  ALA  35           HB2      ALA  35  -5.780   3.019   1.015
  228    HB3  ALA  35           HB3      ALA  35  -5.180   1.609   0.149
  229    HA   PRO  36           HA       PRO  36 -10.820   3.901   0.521
  230    HB2  PRO  36           HB2      PRO  36 -12.777   2.070   0.273
  231    HB3  PRO  36           HB3      PRO  36 -12.086   2.911  -1.116
  232    HG2  PRO  36           HG2      PRO  36 -11.615   0.136  -0.162
  233    HG3  PRO  36           HG3      PRO  36 -11.656   0.765  -1.814
  234    HD2  PRO  36           HD2      PRO  36  -9.343   0.220  -0.341
  235    HD3  PRO  36           HD3      PRO  36  -9.435   1.228  -1.792
  236    H    PHE  37           H        PHE  37 -10.219   0.650   1.773
  237    HA   PHE  37           HA       PHE  37 -11.463   1.451   4.301
  238    HB2  PHE  37           HB2      PHE  37 -12.823  -0.254   3.262
  239    HB3  PHE  37           HB3      PHE  37 -11.426  -1.277   2.985
  240    HD1  PHE  37           HD1      PHE  37 -13.462   0.245   5.703
  241    HD2  PHE  37           HD2      PHE  37 -10.851  -2.918   4.544
  242    HE1  PHE  37           HE1      PHE  37 -13.885  -0.892   7.838
  243    HE2  PHE  37           HE2      PHE  37 -11.274  -4.053   6.685
  244    HZ   PHE  37           HZ       PHE  37 -12.791  -3.036   8.333
  245    H    ALA  38           H        ALA  38  -9.105  -0.735   2.878
  246    HA   ALA  38           HA       ALA  38  -7.578  -0.867   5.318
  247    HB1  ALA  38           HB1      ALA  38  -6.051  -2.284   3.985
  248    HB2  ALA  38           HB2      ALA  38  -6.996  -1.924   2.542
  249    HB3  ALA  38           HB3      ALA  38  -7.723  -2.834   3.863
  250    H    ARG  39           H        ARG  39  -7.740   1.610   4.934
  251    HA   ARG  39           HA       ARG  39  -5.866   2.797   3.159
  252    HB2  ARG  39           HB2      ARG  39  -6.799   3.987   5.687
  253    HB3  ARG  39           HB3      ARG  39  -6.281   4.830   4.254
  254    HG2  ARG  39           HG2      ARG  39  -8.263   4.027   3.013
  255    HG3  ARG  39           HG3      ARG  39  -8.857   3.270   4.490
  256    HD2  ARG  39           HD2      ARG  39  -8.914   5.491   5.574
  257    HD3  ARG  39           HD3      ARG  39  -8.362   6.212   4.066
  258    HE   ARG  39           HE       ARG  39 -10.715   4.651   3.711
  259   HH11  ARG  39          HH11      ARG  39  -9.619   7.831   4.833
  260   HH12  ARG  39          HH12      ARG  39 -11.071   8.630   4.474
  261   HH21  ARG  39          HH21      ARG  39 -12.716   5.736   3.210
  262   HH22  ARG  39          HH22      ARG  39 -12.870   7.414   3.512
  Start of MODEL    9
    1    H1   CYS   1           H        CYS   1  -3.566   1.805   1.869
    2    HA   CYS   1           HA       CYS   1  -3.367   2.523   4.694
    3    HB2  CYS   1           HB2      CYS   1  -1.169   1.835   2.715
    4    HB3  CYS   1           HB3      CYS   1  -0.882   2.462   4.329
    5    H    GLU   2           H        GLU   2  -4.422   4.472   4.310
    6    HA   GLU   2           HA       GLU   2  -3.361   6.207   2.261
    7    HB2  GLU   2           HB2      GLU   2  -5.534   6.709   4.227
    8    HB3  GLU   2           HB3      GLU   2  -5.144   7.711   2.857
    9    HG2  GLU   2           HG2      GLU   2  -6.171   4.889   2.677
   10    HG3  GLU   2           HG3      GLU   2  -7.101   6.352   2.347
   11    H    ALA   3           H        ALA   3  -2.021   7.579   2.630
   12    HA   ALA   3           HA       ALA   3  -1.610   8.853   5.193
   13    HB1  ALA   3           HB1      ALA   3  -0.242   6.904   5.453
   14    HB2  ALA   3           HB2      ALA   3   0.833   8.280   5.139
   15    HB3  ALA   3           HB3      ALA   3   0.444   7.133   3.854
   16    H    ILE   4           H        ILE   4  -1.943  10.794   4.408
   17    HA   ILE   4           HA       ILE   4  -0.775  11.609   1.873
   18    HB   ILE   4           HB       ILE   4  -2.650  13.097   3.746
   19   HG12  ILE   4          HG12      ILE   4  -3.733  11.099   2.928
   20   HG13  ILE   4          HG13      ILE   4  -4.419  12.501   2.113
   21   HG21  ILE   4          HG21      ILE   4  -1.929  13.681   0.881
   22   HG22  ILE   4          HG22      ILE   4  -1.445  14.624   2.289
   23   HG23  ILE   4          HG23      ILE   4  -3.147  14.536   1.829
   24   HD11  ILE   4          HD11      ILE   4  -3.029  12.028   0.164
   25   HD12  ILE   4          HD12      ILE   4  -4.089  10.665   0.561
   26   HD13  ILE   4          HD13      ILE   4  -2.373  10.615   0.988
   27    H    TYR   5           H        TYR   5  -0.076  11.702   5.132
   28    HA   TYR   5           HA       TYR   5   1.519  14.115   5.010
   29    HB2  TYR   5           HB2      TYR   5   0.242  13.394   7.047
   30    HB3  TYR   5           HB3      TYR   5   1.371  12.059   7.199
   31    HD1  TYR   5           HD2      TYR   5   1.166  15.721   7.119
   32    HD2  TYR   5           HD1      TYR   5   3.454  12.347   8.271
   33    HE1  TYR   5           HE2      TYR   5   2.651  17.181   8.321
   34    HE2  TYR   5           HE1      TYR   5   4.987  13.783   9.499
   35    HH   TYR   5           HH       TYR   5   4.217  16.987  10.234
   36    H    ALA   6           H        ALA   6   1.979  10.663   5.371
   37    HA   ALA   6           HA       ALA   6   4.538  10.796   4.037
   38    HB1  ALA   6           HB1      ALA   6   5.762   9.618   5.795
   39    HB2  ALA   6           HB2      ALA   6   4.332   9.658   6.828
   40    HB3  ALA   6           HB3      ALA   6   5.146  11.162   6.394
   41    H    ALA   7           H        ALA   7   3.783   9.523   2.475
   42    HA   ALA   7           HA       ALA   7   2.179   7.236   2.985
   43    HB1  ALA   7           HB1      ALA   7   3.590   8.067   0.447
   44    HB2  ALA   7           HB2      ALA   7   1.945   8.512   0.907
   45    HB3  ALA   7           HB3      ALA   7   2.344   6.827   0.577
   46    HA   PRO   8           HA       PRO   8   5.480   4.580   4.101
   47    HB2  PRO   8           HB2      PRO   8   4.124   2.213   3.906
   48    HB3  PRO   8           HB3      PRO   8   3.977   3.320   5.275
   49    HG2  PRO   8           HG2      PRO   8   2.175   2.977   2.918
   50    HG3  PRO   8           HG3      PRO   8   1.753   3.224   4.622
   51    HD2  PRO   8           HD2      PRO   8   1.664   5.211   2.806
   52    HD3  PRO   8           HD3      PRO   8   2.098   5.496   4.504
   53    H    LYS   9           H        LYS   9   7.043   4.311   2.749
   54    HA   LYS   9           HA       LYS   9   6.851   3.380   0.050
   55    HB2  LYS   9           HB2      LYS   9   9.145   3.655   1.999
   56    HB3  LYS   9           HB3      LYS   9   9.352   3.114   0.345
   57    HG2  LYS   9           HG2      LYS   9   8.134   5.770   1.041
   58    HG3  LYS   9           HG3      LYS   9   9.870   5.551   0.838
   59    HD2  LYS   9           HD2      LYS   9   9.423   4.647  -1.444
   60    HD3  LYS   9           HD3      LYS   9   7.720   5.035  -1.218
   61    HE2  LYS   9           HE2      LYS   9   8.858   6.763  -2.507
   62    HE3  LYS   9           HE3      LYS   9   8.276   7.394  -0.972
   63    HZ1  LYS   9           HZ1      LYS   9  10.482   7.320  -0.092
   64    HZ2  LYS   9           HZ2      LYS   9  10.558   8.122  -1.562
   65    HZ3  LYS   9           HZ3      LYS   9  11.077   6.525  -1.451
   66    H    CYS  10           H        CYS  10   7.410   1.331  -0.698
   67    HA   CYS  10           HA       CYS  10   7.381  -0.770   1.366
   68    HB2  CYS  10           HB2      CYS  10   6.282  -2.194  -0.260
   69    HB3  CYS  10           HB3      CYS  10   5.349  -0.727   0.002
   70    H    ARG  11           H        ARG  11   8.784  -2.525   1.074
   71    HA   ARG  11           HA       ARG  11  10.595  -2.314  -1.235
   72    HB2  ARG  11           HB2      ARG  11  11.185  -3.575   1.460
   73    HB3  ARG  11           HB3      ARG  11  12.288  -3.510   0.100
   74    HG2  ARG  11           HG2      ARG  11  11.287  -1.154   1.694
   75    HG3  ARG  11           HG3      ARG  11  12.901  -1.863   1.749
   76    HD2  ARG  11           HD2      ARG  11  11.647  -0.550  -0.661
   77    HD3  ARG  11           HD3      ARG  11  12.834   0.193   0.406
   78    HE   ARG  11           HE       ARG  11  14.260  -1.807  -0.293
   79   HH11  ARG  11          HH11      ARG  11  11.942  -0.188  -2.442
   80   HH12  ARG  11          HH12      ARG  11  12.837  -0.516  -3.848
   81   HH21  ARG  11          HH21      ARG  11  15.492  -2.187  -2.252
   82   HH22  ARG  11          HH22      ARG  11  14.887  -1.628  -3.745
   83    H    ARG  12           H        ARG  12   8.893  -4.394   1.005
   84    HA   ARG  12           HA       ARG  12   8.384  -6.289  -1.148
   85    HB2  ARG  12           HB2      ARG  12   8.406  -8.062   0.578
   86    HB3  ARG  12           HB3      ARG  12   9.981  -7.439   0.154
   87    HG2  ARG  12           HG2      ARG  12   9.967  -6.097   2.231
   88    HG3  ARG  12           HG3      ARG  12   8.351  -6.699   2.591
   89    HD2  ARG  12           HD2      ARG  12   9.265  -8.985   2.676
   90    HD3  ARG  12           HD3      ARG  12  10.880  -8.322   2.422
   91    HE   ARG  12           HE       ARG  12  10.227  -6.955   4.527
   92   HH11  ARG  12          HH11      ARG  12   9.481 -10.372   3.965
   93   HH12  ARG  12          HH12      ARG  12   9.532 -10.820   5.593
   94   HH21  ARG  12          HH21      ARG  12  10.254  -7.529   6.774
   95   HH22  ARG  12          HH22      ARG  12   9.954  -9.128   7.260
   96    H    ASP  13           H        ASP  13   6.484  -7.418  -0.867
   97    HA   ASP  13           HA       ASP  13   4.358  -5.698  -0.273
   98    HB2  ASP  13           HB2      ASP  13   4.560  -8.620  -0.901
   99    HB3  ASP  13           HB3      ASP  13   3.031  -7.843  -0.554
  100    H    SER  14           H        SER  14   5.885  -8.295   1.398
  101    HA   SER  14           HA       SER  14   3.943  -8.621   3.400
  102    HB2  SER  14           HB2      SER  14   5.892  -9.784   4.530
  103    HB3  SER  14           HB3      SER  14   5.275 -10.415   2.977
  104    HG   SER  14           HG       SER  14   7.153 -10.128   2.211
  105    H    ASP  15           H        ASP  15   6.375  -6.271   2.985
  106    HA   ASP  15           HA       ASP  15   6.405  -5.775   5.852
  107    HB2  ASP  15           HB2      ASP  15   8.242  -4.332   5.677
  108    HB3  ASP  15           HB3      ASP  15   8.552  -5.513   4.433
  109    H    CYS  16           H        CYS  16   4.368  -5.007   3.430
  110    HA   CYS  16           HA       CYS  16   3.656  -2.437   4.537
  111    HB2  CYS  16           HB2      CYS  16   2.533  -4.068   2.268
  112    HB3  CYS  16           HB3      CYS  16   1.962  -2.478   2.748
  113    HA   PRO  17           HA       PRO  17   0.779  -4.766   7.113
  114    HB2  PRO  17           HB2      PRO  17   0.074  -2.768   8.745
  115    HB3  PRO  17           HB3      PRO  17   1.683  -3.499   8.837
  116    HG2  PRO  17           HG2      PRO  17   0.843  -0.936   7.545
  117    HG3  PRO  17           HG3      PRO  17   2.279  -1.275   8.522
  118    HD2  PRO  17           HD2      PRO  17   2.256  -1.204   5.772
  119    HD3  PRO  17           HD3      PRO  17   3.442  -2.103   6.741
  120    H    GLY  18           H        GLY  18  -1.561  -4.055   7.997
  121    HA2  GLY  18           HA2      GLY  18  -3.738  -3.488   7.541
  122    HA3  GLY  18           HA3      GLY  18  -3.110  -2.231   6.488
  123    H    ALA  19           H        ALA  19  -2.007  -5.324   5.781
  124    HA   ALA  19           HA       ALA  19  -2.253  -6.814   4.152
  125    HB1  ALA  19           HB1      ALA  19  -5.068  -5.784   3.764
  126    HB2  ALA  19           HB2      ALA  19  -4.599  -7.083   4.862
  127    HB3  ALA  19           HB3      ALA  19  -4.410  -7.288   3.121
  128    H    CYS  20           H        CYS  20  -1.807  -3.755   3.775
  129    HA   CYS  20           HA       CYS  20  -2.301  -3.280   1.056
  130    HB2  CYS  20           HB2      CYS  20  -0.298  -2.104   2.969
  131    HB3  CYS  20           HB3      CYS  20  -0.644  -1.452   1.368
  132    H    ILE  21           H        ILE  21  -0.828  -3.302  -0.623
  133    HA   ILE  21           HA       ILE  21   1.303  -5.294  -0.350
  134    HB   ILE  21           HB       ILE  21   1.001  -5.753  -2.736
  135   HG12  ILE  21          HG12      ILE  21  -1.334  -3.818  -2.637
  136   HG13  ILE  21          HG13      ILE  21   0.220  -3.473  -3.384
  137   HG21  ILE  21          HG21      ILE  21  -0.269  -7.102  -1.202
  138   HG22  ILE  21          HG22      ILE  21  -1.243  -6.797  -2.647
  139   HG23  ILE  21          HG23      ILE  21  -1.561  -5.904  -1.162
  140   HD11  ILE  21          HD11      ILE  21  -1.716  -5.616  -4.224
  141   HD12  ILE  21          HD12      ILE  21  -0.158  -5.280  -4.978
  142   HD13  ILE  21          HD13      ILE  21  -1.443  -4.074  -5.035
  143    H    CYS  22           H        CYS  22   2.906  -4.905  -2.237
  144    HA   CYS  22           HA       CYS  22   3.766  -2.135  -2.008
  145    HB2  CYS  22           HB2      CYS  22   5.378  -3.884  -1.362
  146    HB3  CYS  22           HB3      CYS  22   5.222  -4.622  -2.946
  147    H    ARG  23           H        ARG  23   2.895  -0.912  -3.588
  148    HA   ARG  23           HA       ARG  23   2.305  -2.043  -6.145
  149    HB2  ARG  23           HB2      ARG  23   2.026   0.668  -4.924
  150    HB3  ARG  23           HB3      ARG  23   1.572   0.309  -6.562
  151    HG2  ARG  23           HG2      ARG  23   0.458  -1.249  -4.287
  152    HG3  ARG  23           HG3      ARG  23  -0.252   0.282  -4.779
  153    HD2  ARG  23           HD2      ARG  23  -0.354  -0.729  -7.140
  154    HD3  ARG  23           HD3      ARG  23   0.054  -2.269  -6.391
  155    HE   ARG  23           HE       ARG  23  -2.081  -1.673  -4.989
  156   HH11  ARG  23          HH11      ARG  23  -1.619  -1.358  -8.486
  157   HH12  ARG  23          HH12      ARG  23  -3.282  -1.401  -8.853
  158   HH21  ARG  23          HH21      ARG  23  -4.319  -1.740  -5.495
  159   HH22  ARG  23          HH22      ARG  23  -4.871  -1.568  -7.104
  160    H    GLY  24           H        GLY  24   2.912  -0.605  -8.034
  161    HA2  GLY  24           HA2      GLY  24   5.792  -0.767  -8.248
  162    HA3  GLY  24           HA3      GLY  24   4.660  -0.410  -9.544
  163    H    ASN  25           H        ASN  25   3.874   1.514  -7.090
  164    HA   ASN  25           HA       ASN  25   5.230   3.789  -8.247
  165    HB2  ASN  25           HB2      ASN  25   3.708   5.144  -6.893
  166    HB3  ASN  25           HB3      ASN  25   2.789   3.907  -7.736
  167   HD21  ASN  25          HD21      ASN  25   1.909   5.328  -5.487
  168   HD22  ASN  25          HD22      ASN  25   1.673   4.213  -4.192
  169    H    GLY  26           H        GLY  26   5.456   1.625  -5.593
  170    HA2  GLY  26           HA2      GLY  26   7.610   1.395  -4.544
  171    HA3  GLY  26           HA3      GLY  26   7.800   3.142  -4.652
  172    H    TYR  27           H        TYR  27   4.696   2.333  -3.870
  173    HA   TYR  27           HA       TYR  27   5.173   2.858  -1.045
  174    HB2  TYR  27           HB2      TYR  27   3.145   3.808  -2.975
  175    HB3  TYR  27           HB3      TYR  27   2.948   4.046  -1.227
  176    HD1  TYR  27           HD1      TYR  27   4.620   5.590  -0.094
  177    HD2  TYR  27           HD2      TYR  27   4.423   5.213  -4.315
  178    HE1  TYR  27           HE1      TYR  27   5.836   7.705  -0.338
  179    HE2  TYR  27           HE2      TYR  27   5.644   7.314  -4.572
  180    HH   TYR  27           HH       TYR  27   6.026   9.324  -3.298
  181    H    CYS  28           H        CYS  28   3.565   2.021   0.302
  182    HA   CYS  28           HA       CYS  28   2.429  -0.482  -0.527
  183    HB2  CYS  28           HB2      CYS  28   2.082   1.055   2.055
  184    HB3  CYS  28           HB3      CYS  28   1.620  -0.618   1.777
  185    H    GLY  29           H        GLY  29   0.391  -0.797  -1.176
  186    HA2  GLY  29           HA2      GLY  29  -1.660   1.165  -0.580
  187    HA3  GLY  29           HA3      GLY  29  -1.283   0.920  -2.289
  188    H    GLU  30           H        GLU  30  -3.787   0.324  -1.504
  189    HA   GLU  30           HA       GLU  30  -4.076  -2.310  -0.631
  190    HB2  GLU  30           HB2      GLU  30  -5.808  -0.722  -0.341
  191    HB3  GLU  30           HB3      GLU  30  -6.013  -0.487  -2.079
  192    HG2  GLU  30           HG2      GLU  30  -6.843  -2.863  -2.144
  193    HG3  GLU  30           HG3      GLU  30  -6.732  -2.888  -0.385
  194    H    ALA  31           H        ALA  31  -4.984  -4.049  -1.941
  195    HA   ALA  31           HA       ALA  31  -3.669  -4.360  -4.485
  196    HB1  ALA  31           HB1      ALA  31  -4.508  -6.664  -4.302
  197    HB2  ALA  31           HB2      ALA  31  -5.462  -6.210  -2.891
  198    HB3  ALA  31           HB3      ALA  31  -3.701  -6.177  -2.810
  199    H    ILE  32           H        ILE  32  -6.056  -6.129  -5.210
  200    HA   ILE  32           HA       ILE  32  -7.648  -3.905  -6.214
  201    HB   ILE  32           HB       ILE  32  -7.704  -6.752  -7.184
  202   HG12  ILE  32          HG12      ILE  32  -6.326  -4.348  -8.416
  203   HG13  ILE  32          HG13      ILE  32  -5.518  -5.705  -7.646
  204   HG21  ILE  32          HG21      ILE  32  -8.932  -5.840  -9.138
  205   HG22  ILE  32          HG22      ILE  32  -8.900  -4.248  -8.381
  206   HG23  ILE  32          HG23      ILE  32  -9.790  -5.565  -7.618
  207   HD11  ILE  32          HD11      ILE  32  -5.386  -5.867 -10.053
  208   HD12  ILE  32          HD12      ILE  32  -7.146  -5.798 -10.173
  209   HD13  ILE  32          HD13      ILE  32  -6.367  -7.179  -9.398
  210    H    TYR  33           H        TYR  33  -9.645  -3.736  -5.651
  211    HA   TYR  33           HA       TYR  33 -11.236  -5.711  -4.358
  212    HB2  TYR  33           HB2      TYR  33  -9.472  -5.046  -2.596
  213    HB3  TYR  33           HB3      TYR  33 -10.204  -3.459  -2.605
  214    HD1  TYR  33           HD1      TYR  33 -11.185  -7.047  -2.133
  215    HD2  TYR  33           HD2      TYR  33 -11.793  -2.999  -1.017
  216    HE1  TYR  33           HE1      TYR  33 -12.754  -7.762  -0.379
  217    HE2  TYR  33           HE2      TYR  33 -13.339  -3.686   0.702
  218    HH   TYR  33           HH       TYR  33 -14.793  -5.555   1.208
  219    H    ALA  34           H        ALA  34 -13.318  -4.510  -3.549
  220    HA   ALA  34           HA       ALA  34 -13.926  -2.597  -5.610
  221    HB1  ALA  34           HB1      ALA  34 -15.740  -3.747  -3.497
  222    HB2  ALA  34           HB2      ALA  34 -15.510  -4.396  -5.118
  223    HB3  ALA  34           HB3      ALA  34 -16.248  -2.810  -4.900
  224    H    ALA  35           H        ALA  35 -14.992  -2.396  -2.251
  225    HA   ALA  35           HA       ALA  35 -14.776   0.479  -2.353
  226    HB1  ALA  35           HB1      ALA  35 -16.662  -0.573  -1.213
  227    HB2  ALA  35           HB2      ALA  35 -15.710   0.382  -0.076
  228    HB3  ALA  35           HB3      ALA  35 -15.558  -1.374  -0.096
  229    HA   PRO  36           HA       PRO  36 -10.715   0.706  -0.517
  230    HB2  PRO  36           HB2      PRO  36 -11.045   2.936   1.076
  231    HB3  PRO  36           HB3      PRO  36 -10.655   2.969  -0.646
  232    HG2  PRO  36           HG2      PRO  36 -13.260   3.439   0.706
  233    HG3  PRO  36           HG3      PRO  36 -12.606   4.162  -0.770
  234    HD2  PRO  36           HD2      PRO  36 -14.509   2.210  -0.743
  235    HD3  PRO  36           HD3      PRO  36 -13.376   2.462  -2.085
  236    H    PHE  37           H        PHE  37 -10.233  -0.823   0.937
  237    HA   PHE  37           HA       PHE  37 -11.361  -0.526   3.617
  238    HB2  PHE  37           HB2      PHE  37 -12.800  -2.117   2.469
  239    HB3  PHE  37           HB3      PHE  37 -11.411  -3.108   2.066
  240    HD1  PHE  37           HD2      PHE  37 -13.210  -1.712   5.013
  241    HD2  PHE  37           HD1      PHE  37 -10.809  -4.866   3.460
  242    HE1  PHE  37           HE2      PHE  37 -13.458  -2.943   7.128
  243    HE2  PHE  37           HE1      PHE  37 -11.060  -6.096   5.570
  244    HZ   PHE  37           HZ       PHE  37 -12.385  -5.133   7.407
  245    H    ALA  38           H        ALA  38  -8.875  -1.990   1.613
  246    HA   ALA  38           HA       ALA  38  -7.307  -2.491   4.053
  247    HB1  ALA  38           HB1      ALA  38  -7.238  -3.903   1.379
  248    HB2  ALA  38           HB2      ALA  38  -7.879  -4.559   2.885
  249    HB3  ALA  38           HB3      ALA  38  -6.153  -4.229   2.727
  250    H    ARG  39           H        ARG  39  -7.450  -0.021   3.023
  251    HA   ARG  39           HA       ARG  39  -5.108   0.374   1.332
  252    HB2  ARG  39           HB2      ARG  39  -7.385   2.174   2.091
  253    HB3  ARG  39           HB3      ARG  39  -5.967   2.740   1.231
  254    HG2  ARG  39           HG2      ARG  39  -6.439   1.212  -0.582
  255    HG3  ARG  39           HG3      ARG  39  -7.844   0.592   0.288
  256    HD2  ARG  39           HD2      ARG  39  -8.533   2.151  -1.398
  257    HD3  ARG  39           HD3      ARG  39  -8.819   2.824   0.206
  258    HE   ARG  39           HE       ARG  39  -6.560   3.996  -0.256
  259   HH11  ARG  39          HH11      ARG  39  -8.965   3.277  -2.777
  260   HH12  ARG  39          HH12      ARG  39  -8.711   4.722  -3.613
  261   HH21  ARG  39          HH21      ARG  39  -6.269   5.995  -1.357
  262   HH22  ARG  39          HH22      ARG  39  -7.114   6.318  -2.805
  Start of MODEL   10
    1    H1   CYS   1           H        CYS   1  -6.291   1.679   2.370
    2    HA   CYS   1           HA       CYS   1  -4.331   3.717   2.726
    3    HB2  CYS   1           HB2      CYS   1  -2.502   2.200   1.609
    4    HB3  CYS   1           HB3      CYS   1  -2.771   2.091   3.345
    5    H    GLU   2           H        GLU   2  -6.102   4.426   1.510
    6    HA   GLU   2           HA       GLU   2  -6.393   3.572  -1.255
    7    HB2  GLU   2           HB2      GLU   2  -8.320   4.144   0.242
    8    HB3  GLU   2           HB3      GLU   2  -7.711   5.783   0.341
    9    HG2  GLU   2           HG2      GLU   2  -8.046   5.994  -2.105
   10    HG3  GLU   2           HG3      GLU   2  -8.785   4.391  -2.096
   11    H    ALA   3           H        ALA   3  -5.014   6.028   0.729
   12    HA   ALA   3           HA       ALA   3  -4.206   7.669  -1.483
   13    HB1  ALA   3           HB1      ALA   3  -4.821   8.750   0.643
   14    HB2  ALA   3           HB2      ALA   3  -3.128   9.048   0.258
   15    HB3  ALA   3           HB3      ALA   3  -3.556   7.844   1.474
   16    H    ILE   4           H        ILE   4  -2.922   6.454  -2.632
   17    HA   ILE   4           HA       ILE   4  -0.865   4.795  -1.422
   18    HB   ILE   4           HB       ILE   4  -1.647   5.071  -4.353
   19   HG12  ILE   4          HG12      ILE   4  -2.396   2.976  -2.295
   20   HG13  ILE   4          HG13      ILE   4  -3.466   4.205  -2.948
   21   HG21  ILE   4          HG21      ILE   4   0.642   4.226  -4.106
   22   HG22  ILE   4          HG22      ILE   4  -0.433   2.949  -4.677
   23   HG23  ILE   4          HG23      ILE   4   0.075   2.987  -2.987
   24   HD11  ILE   4          HD11      ILE   4  -2.198   1.960  -4.501
   25   HD12  ILE   4          HD12      ILE   4  -3.273   3.193  -5.157
   26   HD13  ILE   4          HD13      ILE   4  -3.876   2.041  -3.963
   27    H    TYR   5           H        TYR   5  -1.109   7.882  -2.808
   28    HA   TYR   5           HA       TYR   5   1.721   8.021  -3.533
   29    HB2  TYR   5           HB2      TYR   5  -0.280   9.233  -4.688
   30    HB3  TYR   5           HB3      TYR   5  -0.159  10.359  -3.353
   31    HD1  TYR   5           HD2      TYR   5   1.937  11.717  -3.043
   32    HD2  TYR   5           HD1      TYR   5   1.284   9.319  -6.490
   33    HE1  TYR   5           HE2      TYR   5   3.707  12.934  -4.222
   34    HE2  TYR   5           HE1      TYR   5   3.051  10.529  -7.675
   35    HH   TYR   5           HH       TYR   5   5.272  12.464  -6.134
   36    H    ALA   6           H        ALA   6  -0.471   8.823  -1.055
   37    HA   ALA   6           HA       ALA   6   1.565  10.235   0.529
   38    HB1  ALA   6           HB1      ALA   6  -0.256  10.803   2.058
   39    HB2  ALA   6           HB2      ALA   6  -1.356   9.773   1.150
   40    HB3  ALA   6           HB3      ALA   6  -0.693  11.225   0.401
   41    H    ALA   7           H        ALA   7   1.151   7.248  -0.081
   42    HA   ALA   7           HA       ALA   7   0.865   5.981   2.495
   43    HB1  ALA   7           HB1      ALA   7   1.347   3.931   1.174
   44    HB2  ALA   7           HB2      ALA   7   1.621   4.959  -0.236
   45    HB3  ALA   7           HB3      ALA   7   0.033   4.902   0.520
   46    HA   PRO   8           HA       PRO   8   5.312   5.751   3.263
   47    HB2  PRO   8           HB2      PRO   8   5.600   3.406   4.566
   48    HB3  PRO   8           HB3      PRO   8   4.813   4.794   5.324
   49    HG2  PRO   8           HG2      PRO   8   3.602   2.359   4.100
   50    HG3  PRO   8           HG3      PRO   8   3.110   3.263   5.543
   51    HD2  PRO   8           HD2      PRO   8   1.911   3.487   3.074
   52    HD3  PRO   8           HD3      PRO   8   1.854   4.725   4.338
   53    H    LYS   9           H        LYS   9   7.243   4.437   2.758
   54    HA   LYS   9           HA       LYS   9   7.024   3.354   0.077
   55    HB2  LYS   9           HB2      LYS   9   9.460   3.267   0.128
   56    HB3  LYS   9           HB3      LYS   9   8.883   4.826   0.700
   57    HG2  LYS   9           HG2      LYS   9   9.294   4.155   3.009
   58    HG3  LYS   9           HG3      LYS   9   9.803   2.560   2.469
   59    HD2  LYS   9           HD2      LYS   9  11.747   3.937   2.972
   60    HD3  LYS   9           HD3      LYS   9  11.671   3.596   1.243
   61    HE2  LYS   9           HE2      LYS   9  10.738   5.794   0.832
   62    HE3  LYS   9           HE3      LYS   9  10.715   6.125   2.559
   63    HZ1  LYS   9           HZ1      LYS   9  13.134   5.996   2.569
   64    HZ2  LYS   9           HZ2      LYS   9  12.618   7.156   1.451
   65    HZ3  LYS   9           HZ3      LYS   9  13.156   5.673   0.920
   66    H    CYS  10           H        CYS  10   8.039   1.331  -0.577
   67    HA   CYS  10           HA       CYS  10   8.327  -0.741   1.440
   68    HB2  CYS  10           HB2      CYS  10   6.768  -2.236   0.295
   69    HB3  CYS  10           HB3      CYS  10   5.946  -0.807   0.913
   70    H    ARG  11           H        ARG  11   9.443  -2.542   0.664
   71    HA   ARG  11           HA       ARG  11  10.498  -2.339  -2.068
   72    HB2  ARG  11           HB2      ARG  11  11.656  -3.727   0.345
   73    HB3  ARG  11           HB3      ARG  11  12.325  -3.811  -1.269
   74    HG2  ARG  11           HG2      ARG  11  12.631  -1.329  -1.166
   75    HG3  ARG  11           HG3      ARG  11  12.171  -1.421   0.537
   76    HD2  ARG  11           HD2      ARG  11  14.591  -1.461   0.331
   77    HD3  ARG  11           HD3      ARG  11  14.000  -3.012   0.924
   78    HE   ARG  11           HE       ARG  11  14.101  -3.458  -1.701
   79   HH11  ARG  11          HH11      ARG  11  16.533  -2.212   0.531
   80   HH12  ARG  11          HH12      ARG  11  17.854  -2.672  -0.438
   81   HH21  ARG  11          HH21      ARG  11  15.926  -4.137  -3.020
   82   HH22  ARG  11          HH22      ARG  11  17.504  -3.787  -2.489
   83    H    ARG  12           H        ARG  12   9.051  -4.275   0.414
   84    HA   ARG  12           HA       ARG  12   8.102  -6.177  -1.571
   85    HB2  ARG  12           HB2      ARG  12   8.406  -7.909   0.257
   86    HB3  ARG  12           HB3      ARG  12   9.831  -7.482  -0.693
   87    HG2  ARG  12           HG2      ARG  12  10.431  -5.953   1.201
   88    HG3  ARG  12           HG3      ARG  12   9.103  -6.678   2.109
   89    HD2  ARG  12           HD2      ARG  12  11.458  -8.179   0.949
   90    HD3  ARG  12           HD3      ARG  12  11.280  -7.712   2.638
   91    HE   ARG  12           HE       ARG  12   9.027  -9.141   1.996
   92   HH11  ARG  12          HH11      ARG  12  12.501  -9.763   2.184
   93   HH12  ARG  12          HH12      ARG  12  12.348 -11.428   2.504
   94   HH21  ARG  12          HH21      ARG  12   8.792 -11.457   2.514
   95   HH22  ARG  12          HH22      ARG  12  10.195 -12.398   2.719
   96    H    ASP  13           H        ASP  13   6.318  -7.474  -0.803
   97    HA   ASP  13           HA       ASP  13   4.229  -5.818  -0.125
   98    HB2  ASP  13           HB2      ASP  13   4.549  -8.779  -0.030
   99    HB3  ASP  13           HB3      ASP  13   3.043  -7.954   0.269
  100    H    SER  14           H        SER  14   6.264  -7.815   1.761
  101    HA   SER  14           HA       SER  14   4.708  -7.951   4.093
  102    HB2  SER  14           HB2      SER  14   6.931  -8.507   5.146
  103    HB3  SER  14           HB3      SER  14   6.383  -9.544   3.817
  104    HG   SER  14           HG       SER  14   8.550  -7.949   4.017
  105    H    ASP  15           H        ASP  15   6.842  -5.474   2.857
  106    HA   ASP  15           HA       ASP  15   7.252  -4.040   5.287
  107    HB2  ASP  15           HB2      ASP  15   7.063  -2.950   2.460
  108    HB3  ASP  15           HB3      ASP  15   7.526  -1.986   3.847
  109    H    CYS  16           H        CYS  16   4.568  -4.430   3.206
  110    HA   CYS  16           HA       CYS  16   3.192  -2.142   4.284
  111    HB2  CYS  16           HB2      CYS  16   2.483  -4.066   2.097
  112    HB3  CYS  16           HB3      CYS  16   1.667  -2.547   2.471
  113    HA   PRO  17           HA       PRO  17   1.121  -5.066   6.927
  114    HB2  PRO  17           HB2      PRO  17  -0.133  -3.332   8.471
  115    HB3  PRO  17           HB3      PRO  17   1.634  -3.447   8.477
  116    HG2  PRO  17           HG2      PRO  17  -0.134  -1.414   7.189
  117    HG3  PRO  17           HG3      PRO  17   1.426  -1.192   7.997
  118    HD2  PRO  17           HD2      PRO  17   1.031  -1.389   5.239
  119    HD3  PRO  17           HD3      PRO  17   2.574  -1.577   6.099
  120    H    GLY  18           H        GLY  18  -0.903  -5.859   7.391
  121    HA2  GLY  18           HA2      GLY  18  -3.108  -6.327   7.249
  122    HA3  GLY  18           HA3      GLY  18  -3.359  -4.622   6.935
  123    H    ALA  19           H        ALA  19  -4.113  -4.074   5.033
  124    HA   ALA  19           HA       ALA  19  -4.391  -6.163   2.996
  125    HB1  ALA  19           HB1      ALA  19  -6.343  -4.889   2.228
  126    HB2  ALA  19           HB2      ALA  19  -6.047  -3.683   3.481
  127    HB3  ALA  19           HB3      ALA  19  -6.497  -5.329   3.930
  128    H    CYS  20           H        CYS  20  -2.396  -3.747   3.699
  129    HA   CYS  20           HA       CYS  20  -2.357  -2.503   1.104
  130    HB2  CYS  20           HB2      CYS  20  -0.475  -2.186   3.417
  131    HB3  CYS  20           HB3      CYS  20  -0.667  -1.120   2.046
  132    H    ILE  21           H        ILE  21  -0.878  -3.022  -0.333
  133    HA   ILE  21           HA       ILE  21   1.190  -4.973   0.367
  134    HB   ILE  21           HB       ILE  21   0.987  -5.908  -1.959
  135   HG12  ILE  21          HG12      ILE  21  -1.613  -4.350  -2.002
  136   HG13  ILE  21          HG13      ILE  21  -0.209  -4.046  -3.017
  137   HG21  ILE  21          HG21      ILE  21   0.090  -7.149  -0.102
  138   HG22  ILE  21          HG22      ILE  21  -0.974  -7.326  -1.497
  139   HG23  ILE  21          HG23      ILE  21  -1.418  -6.240  -0.180
  140   HD11  ILE  21          HD11      ILE  21  -1.949  -5.212  -4.241
  141   HD12  ILE  21          HD12      ILE  21  -1.923  -6.520  -3.058
  142   HD13  ILE  21          HD13      ILE  21  -0.517  -6.230  -4.080
  143    H    CYS  22           H        CYS  22   2.829  -4.957  -1.725
  144    HA   CYS  22           HA       CYS  22   3.611  -2.163  -1.671
  145    HB2  CYS  22           HB2      CYS  22   5.240  -4.009  -1.106
  146    HB3  CYS  22           HB3      CYS  22   5.132  -4.529  -2.782
  147    H    ARG  23           H        ARG  23   3.131  -0.866  -3.295
  148    HA   ARG  23           HA       ARG  23   2.015  -2.017  -5.687
  149    HB2  ARG  23           HB2      ARG  23   2.232   0.849  -4.792
  150    HB3  ARG  23           HB3      ARG  23   1.307   0.239  -6.146
  151    HG2  ARG  23           HG2      ARG  23   0.715  -0.843  -3.443
  152    HG3  ARG  23           HG3      ARG  23   0.170   0.776  -3.855
  153    HD2  ARG  23           HD2      ARG  23  -1.572  -0.909  -4.234
  154    HD3  ARG  23           HD3      ARG  23  -1.110  -0.087  -5.712
  155    HE   ARG  23           HE       ARG  23   0.344  -2.289  -5.933
  156   HH11  ARG  23          HH11      ARG  23  -2.991  -2.119  -4.667
  157   HH12  ARG  23          HH12      ARG  23  -3.483  -3.526  -5.463
  158   HH21  ARG  23          HH21      ARG  23  -0.384  -4.217  -7.005
  159   HH22  ARG  23          HH22      ARG  23  -1.986  -4.762  -6.789
  160    H    GLY  24           H        GLY  24   2.633  -0.816  -7.776
  161    HA2  GLY  24           HA2      GLY  24   5.365  -1.356  -8.262
  162    HA3  GLY  24           HA3      GLY  24   4.217  -0.678  -9.398
  163    H    ASN  25           H        ASN  25   3.958   1.401  -7.045
  164    HA   ASN  25           HA       ASN  25   5.893   3.218  -8.200
  165    HB2  ASN  25           HB2      ASN  25   4.714   4.956  -6.984
  166    HB3  ASN  25           HB3      ASN  25   3.548   3.942  -7.820
  167   HD21  ASN  25          HD21      ASN  25   3.045   5.666  -5.676
  168   HD22  ASN  25          HD22      ASN  25   2.484   4.760  -4.323
  169    H    GLY  26           H        GLY  26   5.555   1.197  -5.486
  170    HA2  GLY  26           HA2      GLY  26   7.441   0.580  -4.185
  171    HA3  GLY  26           HA3      GLY  26   8.122   2.180  -4.463
  172    H    TYR  27           H        TYR  27   4.808   2.039  -3.753
  173    HA   TYR  27           HA       TYR  27   5.251   2.867  -0.978
  174    HB2  TYR  27           HB2      TYR  27   3.378   3.717  -3.112
  175    HB3  TYR  27           HB3      TYR  27   3.008   4.058  -1.421
  176    HD1  TYR  27           HD2      TYR  27   5.862   4.522  -3.857
  177    HD2  TYR  27           HD1      TYR  27   3.522   6.213  -0.746
  178    HE1  TYR  27           HE2      TYR  27   7.080   6.622  -4.092
  179    HE2  TYR  27           HE1      TYR  27   4.717   8.317  -0.974
  180    HH   TYR  27           HH       TYR  27   6.779   9.167  -1.790
  181    H    CYS  28           H        CYS  28   3.620   2.227   0.465
  182    HA   CYS  28           HA       CYS  28   2.443  -0.337  -0.065
  183    HB2  CYS  28           HB2      CYS  28   2.465   1.421   2.371
  184    HB3  CYS  28           HB3      CYS  28   1.637  -0.132   2.309
  185    H    GLY  29           H        GLY  29   0.721  -0.369  -1.291
  186    HA2  GLY  29           HA2      GLY  29  -1.425   1.541  -0.649
  187    HA3  GLY  29           HA3      GLY  29  -1.074   1.050  -2.300
  188    H    GLU  30           H        GLU  30  -3.513   0.812  -0.865
  189    HA   GLU  30           HA       GLU  30  -4.028  -1.678   0.138
  190    HB2  GLU  30           HB2      GLU  30  -5.278   0.409   0.302
  191    HB3  GLU  30           HB3      GLU  30  -5.886   0.174  -1.332
  192    HG2  GLU  30           HG2      GLU  30  -7.080  -1.784  -0.566
  193    HG3  GLU  30           HG3      GLU  30  -6.359  -1.612   1.043
  194    H    ALA  31           H        ALA  31  -5.363  -3.238  -0.774
  195    HA   ALA  31           HA       ALA  31  -4.261  -4.453  -3.075
  196    HB1  ALA  31           HB1      ALA  31  -5.997  -6.182  -2.748
  197    HB2  ALA  31           HB2      ALA  31  -6.766  -5.148  -1.543
  198    HB3  ALA  31           HB3      ALA  31  -5.149  -5.783  -1.255
  199    H    ILE  32           H        ILE  32  -7.682  -3.754  -2.612
  200    HA   ILE  32           HA       ILE  32  -7.687  -2.485  -5.218
  201    HB   ILE  32           HB       ILE  32  -9.804  -4.490  -4.331
  202   HG12  ILE  32          HG12      ILE  32  -7.818  -4.717  -6.612
  203   HG13  ILE  32          HG13      ILE  32  -7.666  -5.545  -5.070
  204   HG21  ILE  32          HG21      ILE  32  -9.591  -2.931  -6.905
  205   HG22  ILE  32          HG22      ILE  32 -10.774  -2.678  -5.622
  206   HG23  ILE  32          HG23      ILE  32 -10.791  -4.176  -6.555
  207   HD11  ILE  32          HD11      ILE  32  -8.511  -7.012  -6.809
  208   HD12  ILE  32          HD12      ILE  32  -9.883  -5.932  -7.068
  209   HD13  ILE  32          HD13      ILE  32  -9.706  -6.788  -5.535
  210    H    TYR  33           H        TYR  33  -9.823  -3.327  -2.785
  211    HA   TYR  33           HA       TYR  33 -10.035  -0.724  -1.642
  212    HB2  TYR  33           HB2      TYR  33 -11.552  -0.505  -3.683
  213    HB3  TYR  33           HB3      TYR  33 -12.582  -1.736  -2.962
  214    HD1  TYR  33           HD1      TYR  33 -11.263   1.672  -2.560
  215    HD2  TYR  33           HD2      TYR  33 -14.115  -1.165  -1.190
  216    HE1  TYR  33           HE1      TYR  33 -12.395   3.438  -1.316
  217    HE2  TYR  33           HE2      TYR  33 -15.266   0.602   0.070
  218    HH   TYR  33           HH       TYR  33 -14.738   2.793   1.032
  219    H    ALA  34           H        ALA  34  -9.824  -1.401   0.296
  220    HA   ALA  34           HA       ALA  34 -11.129  -3.888   1.133
  221    HB1  ALA  34           HB1      ALA  34  -8.703  -3.807   1.367
  222    HB2  ALA  34           HB2      ALA  34  -9.492  -3.939   2.941
  223    HB3  ALA  34           HB3      ALA  34  -8.847  -2.389   2.403
  224    H    ALA  35           H        ALA  35 -11.751  -3.977   3.401
  225    HA   ALA  35           HA       ALA  35 -13.571  -1.854   4.112
  226    HB1  ALA  35           HB1      ALA  35 -12.844  -4.484   5.439
  227    HB2  ALA  35           HB2      ALA  35 -14.203  -4.217   4.352
  228    HB3  ALA  35           HB3      ALA  35 -14.186  -3.456   5.938
  229    HA   PRO  36           HA       PRO  36 -10.892   0.056   7.143
  230    HB2  PRO  36           HB2      PRO  36 -12.313   0.134   9.462
  231    HB3  PRO  36           HB3      PRO  36 -12.464   1.300   8.138
  232    HG2  PRO  36           HG2      PRO  36 -14.223  -1.014   8.840
  233    HG3  PRO  36           HG3      PRO  36 -14.661   0.568   8.170
  234    HD2  PRO  36           HD2      PRO  36 -14.530  -1.697   6.687
  235    HD3  PRO  36           HD3      PRO  36 -14.230  -0.090   6.012
  236    H    PHE  37           H        PHE  37  -9.519  -1.451   7.196
  237    HA   PHE  37           HA       PHE  37  -9.124  -2.980   9.655
  238    HB2  PHE  37           HB2      PHE  37 -10.032  -4.574   7.976
  239    HB3  PHE  37           HB3      PHE  37  -8.799  -4.079   6.836
  240    HD1  PHE  37           HD1      PHE  37  -9.368  -5.838  10.029
  241    HD2  PHE  37           HD2      PHE  37  -6.628  -5.040   6.872
  242    HE1  PHE  37           HE1      PHE  37  -7.891  -7.618  10.856
  243    HE2  PHE  37           HE2      PHE  37  -5.150  -6.821   7.701
  244    HZ   PHE  37           HZ       PHE  37  -5.776  -8.109   9.691
  245    H    ALA  38           H        ALA  38  -7.823  -2.292   6.471
  246    HA   ALA  38           HA       ALA  38  -5.715  -0.673   7.555
  247    HB1  ALA  38           HB1      ALA  38  -5.248  -3.050   5.767
  248    HB2  ALA  38           HB2      ALA  38  -4.582  -2.838   7.398
  249    HB3  ALA  38           HB3      ALA  38  -4.059  -1.794   6.063
  250    H    ARG  39           H        ARG  39  -6.596   1.035   6.592
  251    HA   ARG  39           HA       ARG  39  -7.337   0.832   3.799
  252    HB2  ARG  39           HB2      ARG  39  -7.697   2.991   5.824
  253    HB3  ARG  39           HB3      ARG  39  -8.148   3.158   4.149
  254    HG2  ARG  39           HG2      ARG  39  -9.252   0.903   5.782
  255    HG3  ARG  39           HG3      ARG  39 -10.017   2.496   5.783
  256    HD2  ARG  39           HD2      ARG  39  -9.392   0.974   3.256
  257    HD3  ARG  39           HD3      ARG  39 -10.932   0.837   4.109
  258    HE   ARG  39           HE       ARG  39 -11.037   3.331   3.850
  259   HH11  ARG  39          HH11      ARG  39  -9.253   1.416   1.411
  260   HH12  ARG  39          HH12      ARG  39  -9.725   2.381   0.130
  261   HH21  ARG  39          HH21      ARG  39 -11.594   4.702   2.052
  262   HH22  ARG  39          HH22      ARG  39 -11.038   4.339   0.484
  Start of MODEL   11
    1    H1   CYS   1           H        CYS   1  -4.783   1.417   2.824
    2    HA   CYS   1           HA       CYS   1  -2.996   3.368   3.954
    3    HB2  CYS   1           HB2      CYS   1  -3.191   2.282   1.152
    4    HB3  CYS   1           HB3      CYS   1  -2.110   3.598   1.605
    5    H    GLU   2           H        GLU   2  -4.571   4.624   4.717
    6    HA   GLU   2           HA       GLU   2  -6.266   6.101   2.893
    7    HB2  GLU   2           HB2      GLU   2  -5.952   6.230   5.891
    8    HB3  GLU   2           HB3      GLU   2  -7.162   7.101   4.958
    9    HG2  GLU   2           HG2      GLU   2  -6.924   4.101   5.110
   10    HG3  GLU   2           HG3      GLU   2  -8.066   5.080   6.032
   11    H    ALA   3           H        ALA   3  -3.475   6.481   4.936
   12    HA   ALA   3           HA       ALA   3  -3.155   9.245   4.241
   13    HB1  ALA   3           HB1      ALA   3  -1.060   9.054   5.558
   14    HB2  ALA   3           HB2      ALA   3  -1.341   7.323   5.726
   15    HB3  ALA   3           HB3      ALA   3  -2.453   8.471   6.469
   16    H    ILE   4           H        ILE   4  -3.023   9.165   2.064
   17    HA   ILE   4           HA       ILE   4  -1.121   7.384   0.789
   18    HB   ILE   4           HB       ILE   4  -3.004   9.391  -0.516
   19   HG12  ILE   4          HG12      ILE   4  -3.277   6.396  -0.145
   20   HG13  ILE   4          HG13      ILE   4  -4.181   7.620   0.736
   21   HG21  ILE   4          HG21      ILE   4  -2.612   8.114  -2.583
   22   HG22  ILE   4          HG22      ILE   4  -1.439   7.104  -1.739
   23   HG23  ILE   4          HG23      ILE   4  -1.114   8.821  -1.976
   24   HD11  ILE   4          HD11      ILE   4  -5.246   8.329  -1.340
   25   HD12  ILE   4          HD12      ILE   4  -5.506   6.607  -1.050
   26   HD13  ILE   4          HD13      ILE   4  -4.312   7.134  -2.233
   27    H    TYR   5           H        TYR   5  -1.117  10.557   1.955
   28    HA   TYR   5           HA       TYR   5   0.924  11.511   0.100
   29    HB2  TYR   5           HB2      TYR   5  -0.876  12.991   1.150
   30    HB3  TYR   5           HB3      TYR   5  -0.028  12.799   2.669
   31    HD1  TYR   5           HD2      TYR   5   0.086  14.317  -0.632
   32    HD2  TYR   5           HD1      TYR   5   2.080  13.949   3.094
   33    HE1  TYR   5           HE2      TYR   5   1.503  16.216  -1.217
   34    HE2  TYR   5           HE1      TYR   5   3.505  15.852   2.524
   35    HH   TYR   5           HH       TYR   5   4.299  17.018   0.531
   36    H    ALA   6           H        ALA   6   0.480  10.299   3.243
   37    HA   ALA   6           HA       ALA   6   3.373  10.334   3.777
   38    HB1  ALA   6           HB1      ALA   6   2.775   9.922   6.102
   39    HB2  ALA   6           HB2      ALA   6   1.065   9.881   5.664
   40    HB3  ALA   6           HB3      ALA   6   1.994  11.374   5.481
   41    H    ALA   7           H        ALA   7   1.855   8.482   2.018
   42    HA   ALA   7           HA       ALA   7   1.585   5.938   3.184
   43    HB1  ALA   7           HB1      ALA   7   0.630   6.474   0.993
   44    HB2  ALA   7           HB2      ALA   7   1.697   5.077   0.877
   45    HB3  ALA   7           HB3      ALA   7   2.248   6.657   0.321
   46    HA   PRO   8           HA       PRO   8   5.916   5.193   3.782
   47    HB2  PRO   8           HB2      PRO   8   5.748   2.603   4.583
   48    HB3  PRO   8           HB3      PRO   8   5.334   3.955   5.639
   49    HG2  PRO   8           HG2      PRO   8   3.535   2.150   4.084
   50    HG3  PRO   8           HG3      PRO   8   3.327   2.801   5.719
   51    HD2  PRO   8           HD2      PRO   8   2.073   3.826   3.523
   52    HD3  PRO   8           HD3      PRO   8   2.490   4.792   4.952
   53    H    LYS   9           H        LYS   9   7.550   4.337   2.576
   54    HA   LYS   9           HA       LYS   9   6.740   3.101   0.125
   55    HB2  LYS   9           HB2      LYS   9   9.087   3.312  -0.590
   56    HB3  LYS   9           HB3      LYS   9   8.381   4.842  -0.106
   57    HG2  LYS   9           HG2      LYS   9   9.554   4.647   2.060
   58    HG3  LYS   9           HG3      LYS   9  10.312   3.165   1.483
   59    HD2  LYS   9           HD2      LYS   9  10.571   5.888   0.195
   60    HD3  LYS   9           HD3      LYS   9  11.780   5.112   1.214
   61    HE2  LYS   9           HE2      LYS   9  10.785   4.024  -1.428
   62    HE3  LYS   9           HE3      LYS   9  12.280   4.910  -1.194
   63    HZ1  LYS   9           HZ1      LYS   9  11.639   2.278   0.041
   64    HZ2  LYS   9           HZ2      LYS   9  13.043   3.167   0.292
   65    HZ3  LYS   9           HZ3      LYS   9  12.701   2.573  -1.226
   66    H    CYS  10           H        CYS  10   7.917   1.178  -0.706
   67    HA   CYS  10           HA       CYS  10   8.378  -0.693   1.506
   68    HB2  CYS  10           HB2      CYS  10   7.026  -2.327   0.201
   69    HB3  CYS  10           HB3      CYS  10   6.107  -0.974   0.860
   70    H    ARG  11           H        ARG  11   9.699  -2.409   1.048
   71    HA   ARG  11           HA       ARG  11  11.248  -2.326  -1.453
   72    HB2  ARG  11           HB2      ARG  11  11.589  -4.042   1.013
   73    HB3  ARG  11           HB3      ARG  11  12.745  -3.824  -0.287
   74    HG2  ARG  11           HG2      ARG  11  13.282  -1.645   0.432
   75    HG3  ARG  11           HG3      ARG  11  11.866  -1.582   1.491
   76    HD2  ARG  11           HD2      ARG  11  14.218  -3.434   1.815
   77    HD3  ARG  11           HD3      ARG  11  13.904  -1.984   2.773
   78    HE   ARG  11           HE       ARG  11  11.620  -3.423   3.033
   79   HH11  ARG  11          HH11      ARG  11  15.027  -4.289   3.591
   80   HH12  ARG  11          HH12      ARG  11  14.661  -5.329   4.884
   81   HH21  ARG  11          HH21      ARG  11  11.169  -4.800   4.772
   82   HH22  ARG  11          HH22      ARG  11  12.407  -5.648   5.597
   83    H    ARG  12           H        ARG  12   9.370  -4.258   0.755
   84    HA   ARG  12           HA       ARG  12   8.621  -6.146  -1.359
   85    HB2  ARG  12           HB2      ARG  12   8.628  -7.867   0.391
   86    HB3  ARG  12           HB3      ARG  12  10.231  -7.296  -0.033
   87    HG2  ARG  12           HG2      ARG  12   9.859  -5.700   2.019
   88    HG3  ARG  12           HG3      ARG  12   8.614  -6.867   2.455
   89    HD2  ARG  12           HD2      ARG  12  10.675  -7.416   3.574
   90    HD3  ARG  12           HD3      ARG  12  10.321  -8.649   2.354
   91    HE   ARG  12           HE       ARG  12  11.815  -6.867   1.031
   92   HH11  ARG  12          HH11      ARG  12  12.373  -8.675   4.034
   93   HH12  ARG  12          HH12      ARG  12  14.061  -8.734   3.823
   94   HH21  ARG  12          HH21      ARG  12  14.119  -6.917   0.781
   95   HH22  ARG  12          HH22      ARG  12  15.069  -7.736   1.928
   96    H    ASP  13           H        ASP  13   6.725  -7.312  -0.815
   97    HA   ASP  13           HA       ASP  13   4.620  -5.572  -0.227
   98    HB2  ASP  13           HB2      ASP  13   4.887  -8.488  -0.723
   99    HB3  ASP  13           HB3      ASP  13   3.354  -7.808  -0.217
  100    H    SER  14           H        SER  14   6.390  -7.884   1.600
  101    HA   SER  14           HA       SER  14   4.617  -8.002   3.796
  102    HB2  SER  14           HB2      SER  14   6.691  -8.949   4.882
  103    HB3  SER  14           HB3      SER  14   5.952  -9.811   3.497
  104    HG   SER  14           HG       SER  14   8.238  -9.630   3.354
  105    H    ASP  15           H        ASP  15   6.594  -5.619   2.790
  106    HA   ASP  15           HA       ASP  15   7.188  -4.470   5.406
  107    HB2  ASP  15           HB2      ASP  15   7.244  -3.138   2.679
  108    HB3  ASP  15           HB3      ASP  15   7.631  -2.298   4.171
  109    H    CYS  16           H        CYS  16   4.520  -4.550   3.287
  110    HA   CYS  16           HA       CYS  16   3.211  -2.368   4.680
  111    HB2  CYS  16           HB2      CYS  16   2.408  -3.878   2.203
  112    HB3  CYS  16           HB3      CYS  16   1.753  -2.355   2.796
  113    HA   PRO  17           HA       PRO  17   0.785  -5.840   6.343
  114    HB2  PRO  17           HB2      PRO  17  -0.112  -4.596   8.543
  115    HB3  PRO  17           HB3      PRO  17   1.562  -5.136   8.391
  116    HG2  PRO  17           HG2      PRO  17   0.488  -2.398   8.379
  117    HG3  PRO  17           HG3      PRO  17   2.145  -2.946   8.649
  118    HD2  PRO  17           HD2      PRO  17   0.943  -1.911   6.205
  119    HD3  PRO  17           HD3      PRO  17   2.648  -2.281   6.554
  120    H    GLY  18           H        GLY  18  -1.492  -5.957   7.376
  121    HA2  GLY  18           HA2      GLY  18  -3.734  -5.638   7.393
  122    HA3  GLY  18           HA3      GLY  18  -3.467  -3.996   6.856
  123    H    ALA  19           H        ALA  19  -4.030  -3.481   4.913
  124    HA   ALA  19           HA       ALA  19  -4.750  -5.654   3.093
  125    HB1  ALA  19           HB1      ALA  19  -6.468  -4.203   2.213
  126    HB2  ALA  19           HB2      ALA  19  -5.942  -2.895   3.272
  127    HB3  ALA  19           HB3      ALA  19  -6.656  -4.352   3.961
  128    H    CYS  20           H        CYS  20  -2.415  -3.460   3.663
  129    HA   CYS  20           HA       CYS  20  -2.223  -2.496   0.958
  130    HB2  CYS  20           HB2      CYS  20  -0.617  -1.889   3.400
  131    HB3  CYS  20           HB3      CYS  20  -0.375  -1.183   1.822
  132    H    ILE  21           H        ILE  21  -0.766  -2.933  -0.342
  133    HA   ILE  21           HA       ILE  21   1.227  -4.991   0.286
  134    HB   ILE  21           HB       ILE  21   1.017  -5.802  -2.051
  135   HG12  ILE  21          HG12      ILE  21  -1.409  -3.987  -2.231
  136   HG13  ILE  21          HG13      ILE  21   0.127  -3.698  -3.034
  137   HG21  ILE  21          HG21      ILE  21  -0.197  -6.996  -0.332
  138   HG22  ILE  21          HG22      ILE  21  -1.136  -6.985  -1.827
  139   HG23  ILE  21          HG23      ILE  21  -1.569  -5.902  -0.504
  140   HD11  ILE  21          HD11      ILE  21  -0.184  -5.726  -4.354
  141   HD12  ILE  21          HD12      ILE  21  -1.529  -4.605  -4.561
  142   HD13  ILE  21          HD13      ILE  21  -1.714  -6.025  -3.534
  143    H    CYS  22           H        CYS  22   2.830  -4.852  -1.797
  144    HA   CYS  22           HA       CYS  22   3.691  -2.060  -1.717
  145    HB2  CYS  22           HB2      CYS  22   5.288  -3.824  -1.008
  146    HB3  CYS  22           HB3      CYS  22   5.180  -4.554  -2.604
  147    H    ARG  23           H        ARG  23   2.792  -0.912  -3.354
  148    HA   ARG  23           HA       ARG  23   1.971  -2.211  -5.769
  149    HB2  ARG  23           HB2      ARG  23   1.899   0.684  -4.936
  150    HB3  ARG  23           HB3      ARG  23   1.131   0.014  -6.360
  151    HG2  ARG  23           HG2      ARG  23  -0.290  -1.377  -4.919
  152    HG3  ARG  23           HG3      ARG  23   0.483  -0.677  -3.509
  153    HD2  ARG  23           HD2      ARG  23  -1.656   0.423  -3.934
  154    HD3  ARG  23           HD3      ARG  23  -0.316   1.548  -4.127
  155    HE   ARG  23           HE       ARG  23  -0.900   0.501  -6.635
  156   HH11  ARG  23          HH11      ARG  23  -2.552   2.522  -4.209
  157   HH12  ARG  23          HH12      ARG  23  -3.467   3.376  -5.343
  158   HH21  ARG  23          HH21      ARG  23  -2.133   1.688  -8.177
  159   HH22  ARG  23          HH22      ARG  23  -3.204   2.923  -7.687
  160    H    GLY  24           H        GLY  24   2.464  -1.002  -7.865
  161    HA2  GLY  24           HA2      GLY  24   5.229  -1.248  -8.411
  162    HA3  GLY  24           HA3      GLY  24   3.993  -0.697  -9.523
  163    H    ASN  25           H        ASN  25   3.699   1.281  -6.998
  164    HA   ASN  25           HA       ASN  25   5.264   3.388  -8.250
  165    HB2  ASN  25           HB2      ASN  25   4.055   4.904  -6.741
  166    HB3  ASN  25           HB3      ASN  25   2.918   3.846  -7.564
  167   HD21  ASN  25          HD21      ASN  25   2.495   5.300  -5.137
  168   HD22  ASN  25          HD22      ASN  25   2.147   4.136  -3.919
  169    H    GLY  26           H        GLY  26   5.359   1.219  -5.616
  170    HA2  GLY  26           HA2      GLY  26   7.422   0.668  -4.596
  171    HA3  GLY  26           HA3      GLY  26   7.963   2.329  -4.844
  172    H    TYR  27           H        TYR  27   4.754   1.949  -3.813
  173    HA   TYR  27           HA       TYR  27   5.503   2.533  -1.082
  174    HB2  TYR  27           HB2      TYR  27   3.707   3.907  -2.964
  175    HB3  TYR  27           HB3      TYR  27   3.430   4.085  -1.219
  176    HD1  TYR  27           HD1      TYR  27   5.187   5.264   0.120
  177    HD2  TYR  27           HD2      TYR  27   5.437   5.060  -4.116
  178    HE1  TYR  27           HE1      TYR  27   6.847   7.046   0.149
  179    HE2  TYR  27           HE2      TYR  27   7.106   6.849  -4.111
  180    HH   TYR  27           HH       TYR  27   7.795   8.737  -2.603
  181    H    CYS  28           H        CYS  28   3.889   2.067   0.423
  182    HA   CYS  28           HA       CYS  28   2.478  -0.330  -0.075
  183    HB2  CYS  28           HB2      CYS  28   2.359   1.614   2.234
  184    HB3  CYS  28           HB3      CYS  28   1.548   0.052   2.209
  185    H    GLY  29           H        GLY  29   0.468  -0.622  -0.696
  186    HA2  GLY  29           HA2      GLY  29  -1.520   1.431  -0.284
  187    HA3  GLY  29           HA3      GLY  29  -1.150   1.067  -1.968
  188    H    GLU  30           H        GLU  30  -3.415   0.528   0.091
  189    HA   GLU  30           HA       GLU  30  -3.918  -2.138   0.340
  190    HB2  GLU  30           HB2      GLU  30  -5.263  -0.442   1.332
  191    HB3  GLU  30           HB3      GLU  30  -5.790   0.075  -0.283
  192    HG2  GLU  30           HG2      GLU  30  -7.052  -1.945  -0.543
  193    HG3  GLU  30           HG3      GLU  30  -6.409  -2.583   0.969
  194    H    ALA  31           H        ALA  31  -4.722  -3.582  -0.716
  195    HA   ALA  31           HA       ALA  31  -4.387  -3.607  -3.629
  196    HB1  ALA  31           HB1      ALA  31  -4.647  -6.021  -3.541
  197    HB2  ALA  31           HB2      ALA  31  -5.154  -5.932  -1.858
  198    HB3  ALA  31           HB3      ALA  31  -3.504  -5.497  -2.304
  199    H    ILE  32           H        ILE  32  -6.916  -4.796  -1.510
  200    HA   ILE  32           HA       ILE  32  -8.958  -3.779  -3.334
  201    HB   ILE  32           HB       ILE  32  -9.025  -6.403  -1.808
  202   HG12  ILE  32          HG12      ILE  32  -8.750  -5.978  -4.799
  203   HG13  ILE  32          HG13      ILE  32  -7.483  -6.557  -3.727
  204   HG21  ILE  32          HG21      ILE  32 -11.111  -6.856  -2.982
  205   HG22  ILE  32          HG22      ILE  32 -10.995  -5.315  -3.807
  206   HG23  ILE  32          HG23      ILE  32 -11.225  -5.355  -2.056
  207   HD11  ILE  32          HD11      ILE  32  -8.788  -8.571  -3.281
  208   HD12  ILE  32          HD12      ILE  32  -8.472  -8.371  -5.005
  209   HD13  ILE  32          HD13      ILE  32 -10.062  -7.981  -4.348
  210    H    TYR  33           H        TYR  33 -10.701  -2.954  -2.151
  211    HA   TYR  33           HA       TYR  33 -10.050  -1.808   0.316
  212    HB2  TYR  33           HB2      TYR  33 -12.738  -2.088  -1.041
  213    HB3  TYR  33           HB3      TYR  33 -12.420  -1.056   0.346
  214    HD1  TYR  33           HD1      TYR  33 -10.406   0.647  -0.022
  215    HD2  TYR  33           HD2      TYR  33 -12.652  -1.105  -3.170
  216    HE1  TYR  33           HE1      TYR  33  -9.750   2.474  -1.484
  217    HE2  TYR  33           HE2      TYR  33 -11.985   0.724  -4.662
  218    HH   TYR  33           HH       TYR  33 -11.211   3.080  -4.451
  219    H    ALA  34           H        ALA  34  -9.801  -2.867   2.130
  220    HA   ALA  34           HA       ALA  34 -11.539  -5.180   2.673
  221    HB1  ALA  34           HB1      ALA  34  -9.654  -6.208   3.784
  222    HB2  ALA  34           HB2      ALA  34  -8.680  -4.770   3.483
  223    HB3  ALA  34           HB3      ALA  34  -9.232  -5.756   2.130
  224    H    ALA  35           H        ALA  35 -10.775  -5.736   5.210
  225    HA   ALA  35           HA       ALA  35 -12.194  -3.839   6.752
  226    HB1  ALA  35           HB1      ALA  35 -11.785  -5.392   8.610
  227    HB2  ALA  35           HB2      ALA  35 -10.657  -6.296   7.599
  228    HB3  ALA  35           HB3      ALA  35 -12.368  -6.240   7.178
  229    HA   PRO  36           HA       PRO  36  -8.818  -1.290   8.085
  230    HB2  PRO  36           HB2      PRO  36 -10.168  -1.168  10.719
  231    HB3  PRO  36           HB3      PRO  36  -9.727   0.144   9.620
  232    HG2  PRO  36           HG2      PRO  36 -12.256  -0.548   9.806
  233    HG3  PRO  36           HG3      PRO  36 -11.535  -0.261   8.213
  234    HD2  PRO  36           HD2      PRO  36 -12.021  -2.887   9.581
  235    HD3  PRO  36           HD3      PRO  36 -12.459  -2.361   7.936
  236    H    PHE  37           H        PHE  37  -6.926  -2.025   8.494
  237    HA   PHE  37           HA       PHE  37  -6.170  -2.869  11.142
  238    HB2  PHE  37           HB2      PHE  37  -6.476  -4.996   9.834
  239    HB3  PHE  37           HB3      PHE  37  -5.306  -4.412   8.666
  240    HD1  PHE  37           HD2      PHE  37  -5.735  -5.679  12.077
  241    HD2  PHE  37           HD1      PHE  37  -2.921  -4.414   9.154
  242    HE1  PHE  37           HE2      PHE  37  -3.910  -6.643  13.413
  243    HE2  PHE  37           HE1      PHE  37  -1.095  -5.380  10.492
  244    HZ   PHE  37           HZ       PHE  37  -1.592  -6.490  12.618
  245    H    ALA  38           H        ALA  38  -4.905  -2.737   7.876
  246    HA   ALA  38           HA       ALA  38  -3.646  -0.204   8.416
  247    HB1  ALA  38           HB1      ALA  38  -2.161  -2.549   7.220
  248    HB2  ALA  38           HB2      ALA  38  -1.787  -1.787   8.778
  249    HB3  ALA  38           HB3      ALA  38  -1.603  -0.893   7.257
  250    H    ARG  39           H        ARG  39  -5.034   0.754   7.124
  251    HA   ARG  39           HA       ARG  39  -5.148  -0.208   4.389
  252    HB2  ARG  39           HB2      ARG  39  -7.020   1.642   5.881
  253    HB3  ARG  39           HB3      ARG  39  -7.200   1.110   4.218
  254    HG2  ARG  39           HG2      ARG  39  -7.359  -1.246   5.095
  255    HG3  ARG  39           HG3      ARG  39  -7.442  -0.547   6.714
  256    HD2  ARG  39           HD2      ARG  39  -9.681  -0.984   5.914
  257    HD3  ARG  39           HD3      ARG  39  -9.424   0.763   5.985
  258    HE   ARG  39           HE       ARG  39  -8.865  -0.546   3.462
  259   HH11  ARG  39          HH11      ARG  39 -11.338   1.213   5.321
  260   HH12  ARG  39          HH12      ARG  39 -12.123   1.779   3.925
  261   HH21  ARG  39          HH21      ARG  39  -9.849   0.289   1.655
  262   HH22  ARG  39          HH22      ARG  39 -11.256   1.276   1.759
  Start of MODEL   12
    1    H1   CYS   1           H        CYS   1  -4.024   2.463   1.926
    2    HA   CYS   1           HA       CYS   1  -1.895   3.167   3.736
    3    HB2  CYS   1           HB2      CYS   1  -1.843   1.020   1.611
    4    HB3  CYS   1           HB3      CYS   1  -0.391   1.654   2.388
    5    H    GLU   2           H        GLU   2  -1.817   5.183   3.212
    6    HA   GLU   2           HA       GLU   2  -0.938   5.961   0.556
    7    HB2  GLU   2           HB2      GLU   2  -3.060   7.452   2.148
    8    HB3  GLU   2           HB3      GLU   2  -2.433   7.875   0.575
    9    HG2  GLU   2           HG2      GLU   2  -3.532   5.952  -0.410
   10    HG3  GLU   2           HG3      GLU   2  -4.115   5.455   1.180
   11    H    ALA   3           H        ALA   3  -0.591   8.630   1.189
   12    HA   ALA   3           HA       ALA   3   1.121   8.398   3.513
   13    HB1  ALA   3           HB1      ALA   3   2.149  10.488   2.762
   14    HB2  ALA   3           HB2      ALA   3   0.970  10.612   1.455
   15    HB3  ALA   3           HB3      ALA   3   2.144   9.296   1.463
   16    H    ILE   4           H        ILE   4  -0.565   8.373   5.019
   17    HA   ILE   4           HA       ILE   4  -1.951  10.942   5.326
   18    HB   ILE   4           HB       ILE   4  -2.524   8.439   6.951
   19   HG12  ILE   4          HG12      ILE   4  -4.768   8.522   5.583
   20   HG13  ILE   4          HG13      ILE   4  -3.782   9.345   4.384
   21   HG21  ILE   4          HG21      ILE   4  -3.147  10.509   8.018
   22   HG22  ILE   4          HG22      ILE   4  -4.579   9.573   7.587
   23   HG23  ILE   4          HG23      ILE   4  -4.109  10.967   6.612
   24   HD11  ILE   4          HD11      ILE   4  -3.276   6.609   5.505
   25   HD12  ILE   4          HD12      ILE   4  -2.313   7.414   4.262
   26   HD13  ILE   4          HD13      ILE   4  -3.993   6.966   3.938
   27    H    TYR   5           H        TYR   5  -0.498   8.461   7.323
   28    HA   TYR   5           HA       TYR   5   0.111  10.377   9.421
   29    HB2  TYR   5           HB2      TYR   5  -0.798   7.965   9.663
   30    HB3  TYR   5           HB3      TYR   5   0.832   7.454   9.285
   31    HD1  TYR   5           HD1      TYR   5   2.665   7.817  10.912
   32    HD2  TYR   5           HD2      TYR   5  -1.342   8.937  11.787
   33    HE1  TYR   5           HE1      TYR   5   3.231   7.976  13.295
   34    HE2  TYR   5           HE2      TYR   5  -0.791   9.109  14.161
   35    HH   TYR   5           HH       TYR   5   2.327   9.200  15.322
   36    H    ALA   6           H        ALA   6   1.558   8.467   6.942
   37    HA   ALA   6           HA       ALA   6   3.929   9.985   6.719
   38    HB1  ALA   6           HB1      ALA   6   4.617   8.700   8.710
   39    HB2  ALA   6           HB2      ALA   6   5.539   8.187   7.294
   40    HB3  ALA   6           HB3      ALA   6   4.205   7.196   7.885
   41    H    ALA   7           H        ALA   7   5.204   9.116   4.876
   42    HA   ALA   7           HA       ALA   7   3.482   7.781   3.008
   43    HB1  ALA   7           HB1      ALA   7   5.290   8.155   1.409
   44    HB2  ALA   7           HB2      ALA   7   6.347   8.689   2.715
   45    HB3  ALA   7           HB3      ALA   7   4.924   9.642   2.287
   46    HA   PRO   8           HA       PRO   8   5.380   3.979   4.344
   47    HB2  PRO   8           HB2      PRO   8   3.470   2.288   3.455
   48    HB3  PRO   8           HB3      PRO   8   3.276   3.259   4.916
   49    HG2  PRO   8           HG2      PRO   8   2.001   3.585   2.275
   50    HG3  PRO   8           HG3      PRO   8   1.463   4.158   3.859
   51    HD2  PRO   8           HD2      PRO   8   2.803   5.652   1.809
   52    HD3  PRO   8           HD3      PRO   8   2.300   6.202   3.419
   53    H    LYS   9           H        LYS   9   7.138   3.823   3.047
   54    HA   LYS   9           HA       LYS   9   6.903   3.107   0.243
   55    HB2  LYS   9           HB2      LYS   9   9.401   3.081   0.316
   56    HB3  LYS   9           HB3      LYS   9   8.701   4.611   0.830
   57    HG2  LYS   9           HG2      LYS   9   9.031   3.930   3.179
   58    HG3  LYS   9           HG3      LYS   9   9.803   2.451   2.611
   59    HD2  LYS   9           HD2      LYS   9  11.555   3.729   1.550
   60    HD3  LYS   9           HD3      LYS   9  10.750   5.240   1.977
   61    HE2  LYS   9           HE2      LYS   9  12.565   4.819   3.543
   62    HE3  LYS   9           HE3      LYS   9  11.012   4.678   4.355
   63    HZ1  LYS   9           HZ1      LYS   9  12.470   2.917   5.019
   64    HZ2  LYS   9           HZ2      LYS   9  12.695   2.422   3.424
   65    HZ3  LYS   9           HZ3      LYS   9  11.189   2.275   4.155
   66    H    CYS  10           H        CYS  10   7.923   1.114  -0.607
   67    HA   CYS  10           HA       CYS  10   8.012  -1.042   1.378
   68    HB2  CYS  10           HB2      CYS  10   6.579  -2.431  -0.034
   69    HB3  CYS  10           HB3      CYS  10   5.739  -0.997   0.546
   70    H    ARG  11           H        ARG  11   9.316  -2.752   0.853
   71    HA   ARG  11           HA       ARG  11  10.789  -2.649  -1.685
   72    HB2  ARG  11           HB2      ARG  11  11.241  -4.262   0.836
   73    HB3  ARG  11           HB3      ARG  11  12.285  -4.247  -0.573
   74    HG2  ARG  11           HG2      ARG  11  13.007  -2.043  -0.124
   75    HG3  ARG  11           HG3      ARG  11  11.732  -1.808   1.077
   76    HD2  ARG  11           HD2      ARG  11  13.973  -3.804   1.285
   77    HD3  ARG  11           HD3      ARG  11  13.907  -2.253   2.131
   78    HE   ARG  11           HE       ARG  11  11.555  -3.535   2.724
   79   HH11  ARG  11          HH11      ARG  11  14.985  -4.285   3.254
   80   HH12  ARG  11          HH12      ARG  11  14.685  -5.188   4.666
   81   HH21  ARG  11          HH21      ARG  11  11.187  -4.662   4.608
   82   HH22  ARG  11          HH22      ARG  11  12.468  -5.408   5.492
   83    H    ARG  12           H        ARG  12   8.907  -4.542   0.560
   84    HA   ARG  12           HA       ARG  12   7.771  -6.152  -1.582
   85    HB2  ARG  12           HB2      ARG  12   7.883  -8.071   0.072
   86    HB3  ARG  12           HB3      ARG  12   9.320  -7.730  -0.886
   87    HG2  ARG  12           HG2      ARG  12  10.197  -6.521   1.128
   88    HG3  ARG  12           HG3      ARG  12   8.797  -7.141   2.012
   89    HD2  ARG  12           HD2      ARG  12  10.828  -8.833   0.558
   90    HD3  ARG  12           HD3      ARG  12  10.780  -8.582   2.301
   91    HE   ARG  12           HE       ARG  12   8.363  -9.492   1.909
   92   HH11  ARG  12          HH11      ARG  12  11.385 -10.700   0.523
   93   HH12  ARG  12          HH12      ARG  12  10.889 -12.318   0.428
   94   HH21  ARG  12          HH21      ARG  12   7.656 -11.727   1.813
   95   HH22  ARG  12          HH22      ARG  12   8.700 -12.920   1.195
   96    H    ASP  13           H        ASP  13   5.906  -7.438  -0.813
   97    HA   ASP  13           HA       ASP  13   3.959  -5.633  -0.068
   98    HB2  ASP  13           HB2      ASP  13   3.998  -8.626  -0.032
   99    HB3  ASP  13           HB3      ASP  13   2.580  -7.628   0.150
  100    H    SER  14           H        SER  14   5.820  -7.914   1.651
  101    HA   SER  14           HA       SER  14   4.329  -8.026   4.039
  102    HB2  SER  14           HB2      SER  14   6.503  -8.832   5.001
  103    HB3  SER  14           HB3      SER  14   5.854  -9.760   3.632
  104    HG   SER  14           HG       SER  14   8.194  -8.477   3.887
  105    H    ASP  15           H        ASP  15   6.550  -5.676   2.834
  106    HA   ASP  15           HA       ASP  15   7.166  -4.400   5.330
  107    HB2  ASP  15           HB2      ASP  15   7.106  -3.235   2.537
  108    HB3  ASP  15           HB3      ASP  15   7.601  -2.320   3.949
  109    H    CYS  16           H        CYS  16   4.399  -4.485   3.366
  110    HA   CYS  16           HA       CYS  16   3.317  -2.013   4.357
  111    HB2  CYS  16           HB2      CYS  16   2.220  -4.053   2.445
  112    HB3  CYS  16           HB3      CYS  16   1.606  -2.423   2.721
  113    HA   PRO  17           HA       PRO  17   1.035  -4.258   7.478
  114    HB2  PRO  17           HB2      PRO  17  -0.393  -2.217   8.445
  115    HB3  PRO  17           HB3      PRO  17   1.346  -2.344   8.732
  116    HG2  PRO  17           HG2      PRO  17  -0.131  -0.665   6.741
  117    HG3  PRO  17           HG3      PRO  17   1.254  -0.229   7.757
  118    HD2  PRO  17           HD2      PRO  17   1.454  -0.942   5.121
  119    HD3  PRO  17           HD3      PRO  17   2.759  -1.157   6.307
  120    H    GLY  18           H        GLY  18  -1.322  -4.331   8.209
  121    HA2  GLY  18           HA2      GLY  18  -3.485  -4.898   7.769
  122    HA3  GLY  18           HA3      GLY  18  -3.458  -3.663   6.510
  123    H    ALA  19           H        ALA  19  -4.230  -4.597   4.763
  124    HA   ALA  19           HA       ALA  19  -3.037  -7.150   3.972
  125    HB1  ALA  19           HB1      ALA  19  -5.484  -7.190   4.184
  126    HB2  ALA  19           HB2      ALA  19  -4.967  -7.450   2.518
  127    HB3  ALA  19           HB3      ALA  19  -5.599  -5.879   3.008
  128    H    CYS  20           H        CYS  20  -2.281  -4.105   3.702
  129    HA   CYS  20           HA       CYS  20  -2.539  -3.455   0.984
  130    HB2  CYS  20           HB2      CYS  20  -0.601  -2.458   3.055
  131    HB3  CYS  20           HB3      CYS  20  -0.893  -1.721   1.489
  132    H    ILE  21           H        ILE  21  -0.980  -3.408  -0.606
  133    HA   ILE  21           HA       ILE  21   1.182  -5.331  -0.239
  134    HB   ILE  21           HB       ILE  21   0.990  -5.751  -2.696
  135   HG12  ILE  21          HG12      ILE  21  -1.649  -4.276  -2.422
  136   HG13  ILE  21          HG13      ILE  21  -0.244  -3.704  -3.308
  137   HG21  ILE  21          HG21      ILE  21  -0.955  -7.265  -2.539
  138   HG22  ILE  21          HG22      ILE  21  -1.383  -6.503  -1.003
  139   HG23  ILE  21          HG23      ILE  21   0.137  -7.375  -1.160
  140   HD11  ILE  21          HD11      ILE  21  -0.474  -5.576  -4.864
  141   HD12  ILE  21          HD12      ILE  21  -1.935  -4.590  -4.799
  142   HD13  ILE  21          HD13      ILE  21  -1.880  -6.143  -3.964
  143    H    CYS  22           H        CYS  22   2.798  -4.929  -2.097
  144    HA   CYS  22           HA       CYS  22   3.619  -2.166  -1.820
  145    HB2  CYS  22           HB2      CYS  22   5.191  -4.046  -1.373
  146    HB3  CYS  22           HB3      CYS  22   5.000  -4.563  -3.039
  147    H    ARG  23           H        ARG  23   3.175  -0.726  -3.420
  148    HA   ARG  23           HA       ARG  23   2.107  -1.722  -5.910
  149    HB2  ARG  23           HB2      ARG  23   2.443   1.103  -4.954
  150    HB3  ARG  23           HB3      ARG  23   1.392   0.519  -6.221
  151    HG2  ARG  23           HG2      ARG  23   1.072  -0.286  -3.346
  152    HG3  ARG  23           HG3      ARG  23   0.240   1.088  -4.051
  153    HD2  ARG  23           HD2      ARG  23   0.033  -1.754  -5.063
  154    HD3  ARG  23           HD3      ARG  23  -1.110  -1.025  -3.940
  155    HE   ARG  23           HE       ARG  23  -0.961   0.672  -6.088
  156   HH11  ARG  23          HH11      ARG  23  -1.928  -2.707  -5.630
  157   HH12  ARG  23          HH12      ARG  23  -3.129  -2.685  -6.834
  158   HH21  ARG  23          HH21      ARG  23  -2.591   0.684  -7.788
  159   HH22  ARG  23          HH22      ARG  23  -3.480  -0.733  -8.090
  160    H    GLY  24           H        GLY  24   2.893  -0.728  -7.866
  161    HA2  GLY  24           HA2      GLY  24   5.719  -1.025  -8.097
  162    HA3  GLY  24           HA3      GLY  24   4.610  -0.605  -9.389
  163    H    ASN  25           H        ASN  25   4.056   1.558  -7.046
  164    HA   ASN  25           HA       ASN  25   5.738   3.552  -8.310
  165    HB2  ASN  25           HB2      ASN  25   4.461   5.203  -6.879
  166    HB3  ASN  25           HB3      ASN  25   3.453   4.271  -7.973
  167   HD21  ASN  25          HD21      ASN  25   1.609   4.687  -6.693
  168   HD22  ASN  25          HD22      ASN  25   1.390   3.927  -5.164
  169    H    GLY  26           H        GLY  26   5.655   1.628  -5.468
  170    HA2  GLY  26           HA2      GLY  26   7.872   1.282  -4.477
  171    HA3  GLY  26           HA3      GLY  26   8.085   3.026  -4.547
  172    H    TYR  27           H        TYR  27   4.959   2.517  -3.849
  173    HA   TYR  27           HA       TYR  27   5.413   2.767  -0.988
  174    HB2  TYR  27           HB2      TYR  27   3.547   4.057  -2.878
  175    HB3  TYR  27           HB3      TYR  27   3.274   4.140  -1.125
  176    HD1  TYR  27           HD2      TYR  27   5.299   5.111   0.223
  177    HD2  TYR  27           HD1      TYR  27   4.761   5.680  -3.949
  178    HE1  TYR  27           HE2      TYR  27   6.789   7.057   0.308
  179    HE2  TYR  27           HE1      TYR  27   6.247   7.623  -3.883
  180    HH   TYR  27           HH       TYR  27   7.069   9.238  -2.305
  181    H    CYS  28           H        CYS  28   3.686   2.104   0.284
  182    HA   CYS  28           HA       CYS  28   2.454  -0.366  -0.520
  183    HB2  CYS  28           HB2      CYS  28   2.292   1.250   2.014
  184    HB3  CYS  28           HB3      CYS  28   1.555  -0.331   1.782
  185    H    GLY  29           H        GLY  29   0.372  -0.713  -0.968
  186    HA2  GLY  29           HA2      GLY  29  -1.620   1.295  -0.423
  187    HA3  GLY  29           HA3      GLY  29  -1.266   1.030  -2.128
  188    H    GLU  30           H        GLU  30  -3.727   0.446  -0.784
  189    HA   GLU  30           HA       GLU  30  -3.892  -2.325  -0.504
  190    HB2  GLU  30           HB2      GLU  30  -5.420  -0.875   0.618
  191    HB3  GLU  30           HB3      GLU  30  -5.981  -0.167  -0.898
  192    HG2  GLU  30           HG2      GLU  30  -7.614  -1.657   0.111
  193    HG3  GLU  30           HG3      GLU  30  -7.055  -2.277  -1.437
  194    H    ALA  31           H        ALA  31  -5.182  -3.634  -1.961
  195    HA   ALA  31           HA       ALA  31  -4.317  -3.366  -4.716
  196    HB1  ALA  31           HB1      ALA  31  -4.437  -5.588  -3.698
  197    HB2  ALA  31           HB2      ALA  31  -5.544  -5.482  -5.071
  198    HB3  ALA  31           HB3      ALA  31  -6.168  -5.380  -3.425
  199    H    ILE  32           H        ILE  32  -7.217  -3.174  -2.878
  200    HA   ILE  32           HA       ILE  32  -8.889  -2.354  -5.080
  201    HB   ILE  32           HB       ILE  32  -9.402  -2.138  -2.111
  202   HG12  ILE  32          HG12      ILE  32  -8.913  -4.479  -2.632
  203   HG13  ILE  32          HG13      ILE  32 -10.615  -4.277  -2.236
  204   HG21  ILE  32          HG21      ILE  32 -11.327  -2.194  -4.423
  205   HG22  ILE  32          HG22      ILE  32 -10.933  -0.807  -3.405
  206   HG23  ILE  32          HG23      ILE  32 -11.789  -2.189  -2.719
  207   HD11  ILE  32          HD11      ILE  32 -11.162  -4.342  -4.624
  208   HD12  ILE  32          HD12      ILE  32 -10.335  -5.803  -4.092
  209   HD13  ILE  32          HD13      ILE  32  -9.454  -4.576  -5.003
  210    H    TYR  33           H        TYR  33  -9.404  -0.234  -5.453
  211    HA   TYR  33           HA       TYR  33  -7.504   1.677  -4.531
  212    HB2  TYR  33           HB2      TYR  33  -9.943   2.065  -6.273
  213    HB3  TYR  33           HB3      TYR  33  -8.651   3.229  -6.010
  214    HD1  TYR  33           HD2      TYR  33  -6.285   2.573  -6.743
  215    HD2  TYR  33           HD1      TYR  33  -9.762   0.466  -7.979
  216    HE1  TYR  33           HE2      TYR  33  -5.026   1.597  -8.609
  217    HE2  TYR  33           HE1      TYR  33  -8.518  -0.520  -9.839
  218    HH   TYR  33           HH       TYR  33  -5.164  -0.417 -10.059
  219    H    ALA  34           H        ALA  34 -10.882   1.021  -3.972
  220    HA   ALA  34           HA       ALA  34 -11.065   3.248  -2.129
  221    HB1  ALA  34           HB1      ALA  34 -13.436   2.684  -1.998
  222    HB2  ALA  34           HB2      ALA  34 -13.152   1.251  -2.985
  223    HB3  ALA  34           HB3      ALA  34 -12.917   2.856  -3.676
  224    H    ALA  35           H        ALA  35  -9.623   2.475  -0.578
  225    HA   ALA  35           HA       ALA  35 -10.130   0.011   0.815
  226    HB1  ALA  35           HB1      ALA  35  -8.252   2.286   1.445
  227    HB2  ALA  35           HB2      ALA  35  -7.844   0.798   0.593
  228    HB3  ALA  35           HB3      ALA  35  -8.285   0.746   2.300
  229    HA   PRO  36           HA       PRO  36 -13.435   1.736   3.305
  230    HB2  PRO  36           HB2      PRO  36 -12.830  -0.572   5.068
  231    HB3  PRO  36           HB3      PRO  36 -14.359  -0.093   4.331
  232    HG2  PRO  36           HG2      PRO  36 -12.999  -2.169   3.379
  233    HG3  PRO  36           HG3      PRO  36 -13.837  -1.052   2.288
  234    HD2  PRO  36           HD2      PRO  36 -10.921  -1.257   2.917
  235    HD3  PRO  36           HD3      PRO  36 -11.741  -0.938   1.371
  236    H    PHE  37           H        PHE  37 -10.516   0.610   4.996
  237    HA   PHE  37           HA       PHE  37 -10.544   3.018   6.608
  238    HB2  PHE  37           HB2      PHE  37 -11.925   1.370   7.858
  239    HB3  PHE  37           HB3      PHE  37 -10.546   0.292   7.884
  240    HD1  PHE  37           HD1      PHE  37 -11.564   3.714   8.954
  241    HD2  PHE  37           HD2      PHE  37  -9.006   0.374   9.619
  242    HE1  PHE  37           HE1      PHE  37 -10.745   4.756  11.018
  243    HE2  PHE  37           HE2      PHE  37  -8.181   1.414  11.683
  244    HZ   PHE  37           HZ       PHE  37  -9.047   3.607  12.389
  245    H    ALA  38           H        ALA  38  -9.107  -0.141   6.053
  246    HA   ALA  38           HA       ALA  38  -6.531   0.695   6.921
  247    HB1  ALA  38           HB1      ALA  38  -7.316  -1.815   5.444
  248    HB2  ALA  38           HB2      ALA  38  -7.254  -1.638   7.201
  249    HB3  ALA  38           HB3      ALA  38  -5.775  -1.523   6.243
  250    H    ARG  39           H        ARG  39  -6.813   2.494   5.459
  251    HA   ARG  39           HA       ARG  39  -6.005   2.208   2.717
  252    HB2  ARG  39           HB2      ARG  39  -5.900   4.600   4.520
  253    HB3  ARG  39           HB3      ARG  39  -5.602   4.606   2.802
  254    HG2  ARG  39           HG2      ARG  39  -7.937   3.949   2.422
  255    HG3  ARG  39           HG3      ARG  39  -8.218   4.047   4.174
  256    HD2  ARG  39           HD2      ARG  39  -7.505   6.350   4.168
  257    HD3  ARG  39           HD3      ARG  39  -7.139   6.251   2.454
  258    HE   ARG  39           HE       ARG  39  -9.866   5.809   3.385
  259   HH11  ARG  39          HH11      ARG  39  -7.508   7.669   1.481
  260   HH12  ARG  39          HH12      ARG  39  -8.653   8.745   0.856
  261   HH21  ARG  39          HH21      ARG  39 -11.469   7.314   2.515
  262   HH22  ARG  39          HH22      ARG  39 -10.945   8.557   1.465
  Start of MODEL   13
    1    H1   CYS   1           H        CYS   1  -3.398   1.553   4.271
    2    HA   CYS   1           HA       CYS   1  -2.348   2.536   6.896
    3    HB2  CYS   1           HB2      CYS   1  -0.423   1.070   6.606
    4    HB3  CYS   1           HB3      CYS   1  -1.887   0.105   6.439
    5    H    GLU   2           H        GLU   2  -2.988   3.456   4.115
    6    HA   GLU   2           HA       GLU   2  -0.463   4.212   2.885
    7    HB2  GLU   2           HB2      GLU   2  -3.243   4.732   1.971
    8    HB3  GLU   2           HB3      GLU   2  -1.803   4.676   0.994
    9    HG2  GLU   2           HG2      GLU   2  -1.589   2.337   1.174
   10    HG3  GLU   2           HG3      GLU   2  -2.755   2.259   2.484
   11    H    ALA   3           H        ALA   3  -0.627   6.478   1.800
   12    HA   ALA   3           HA       ALA   3  -2.178   8.445   3.027
   13    HB1  ALA   3           HB1      ALA   3  -0.434   8.250   4.729
   14    HB2  ALA   3           HB2      ALA   3  -0.262   9.753   3.818
   15    HB3  ALA   3           HB3      ALA   3   0.808   8.393   3.482
   16    H    ILE   4           H        ILE   4  -1.962  10.282   1.820
   17    HA   ILE   4           HA       ILE   4  -0.841   9.742  -0.814
   18    HB   ILE   4           HB       ILE   4  -2.940  11.863  -0.165
   19   HG12  ILE   4          HG12      ILE   4  -4.474  10.355  -1.566
   20   HG13  ILE   4          HG13      ILE   4  -3.276   9.091  -1.344
   21   HG21  ILE   4          HG21      ILE   4  -3.268  12.003  -2.605
   22   HG22  ILE   4          HG22      ILE   4  -1.935  10.873  -2.831
   23   HG23  ILE   4          HG23      ILE   4  -1.633  12.457  -2.119
   24   HD11  ILE   4          HD11      ILE   4  -3.645   9.198   1.081
   25   HD12  ILE   4          HD12      ILE   4  -5.135   8.845   0.205
   26   HD13  ILE   4          HD13      ILE   4  -4.846  10.467   0.835
   27    H    TYR   5           H        TYR   5  -0.541  11.841   1.862
   28    HA   TYR   5           HA       TYR   5   1.062  13.741   0.355
   29    HB2  TYR   5           HB2      TYR   5  -0.470  14.412   2.269
   30    HB3  TYR   5           HB3      TYR   5   0.653  13.614   3.346
   31    HD1  TYR   5           HD2      TYR   5   2.860  14.570   3.827
   32    HD2  TYR   5           HD1      TYR   5   0.151  16.521   1.191
   33    HE1  TYR   5           HE2      TYR   5   4.218  16.604   3.949
   34    HE2  TYR   5           HE1      TYR   5   1.499  18.556   1.303
   35    HH   TYR   5           HH       TYR   5   3.126  19.587   2.902
   36    H    ALA   6           H        ALA   6   1.436  11.348   2.867
   37    HA   ALA   6           HA       ALA   6   4.269  11.130   2.143
   38    HB1  ALA   6           HB1      ALA   6   4.935  10.896   4.466
   39    HB2  ALA   6           HB2      ALA   6   3.265  11.091   4.986
   40    HB3  ALA   6           HB3      ALA   6   4.112  12.440   4.230
   41    H    ALA   7           H        ALA   7   3.891   9.322   0.980
   42    HA   ALA   7           HA       ALA   7   2.333   7.187   2.055
   43    HB1  ALA   7           HB1      ALA   7   2.274   7.687  -0.310
   44    HB2  ALA   7           HB2      ALA   7   2.911   6.058  -0.052
   45    HB3  ALA   7           HB3      ALA   7   4.006   7.381  -0.440
   46    HA   PRO   8           HA       PRO   8   5.845   5.123   3.994
   47    HB2  PRO   8           HB2      PRO   8   4.097   2.738   3.899
   48    HB3  PRO   8           HB3      PRO   8   4.814   3.527   5.306
   49    HG2  PRO   8           HG2      PRO   8   2.191   3.689   4.817
   50    HG3  PRO   8           HG3      PRO   8   3.092   5.058   5.493
   51    HD2  PRO   8           HD2      PRO   8   2.193   4.585   2.679
   52    HD3  PRO   8           HD3      PRO   8   2.143   6.077   3.655
   53    H    LYS   9           H        LYS   9   7.502   4.356   2.782
   54    HA   LYS   9           HA       LYS   9   6.858   3.193   0.226
   55    HB2  LYS   9           HB2      LYS   9   9.268   3.255  -0.268
   56    HB3  LYS   9           HB3      LYS   9   8.627   4.817   0.196
   57    HG2  LYS   9           HG2      LYS   9   9.613   4.559   2.414
   58    HG3  LYS   9           HG3      LYS   9  10.250   2.978   1.943
   59    HD2  LYS   9           HD2      LYS   9  11.534   4.019   0.150
   60    HD3  LYS   9           HD3      LYS   9  10.884   5.596   0.588
   61    HE2  LYS   9           HE2      LYS   9  11.950   5.403   2.790
   62    HE3  LYS   9           HE3      LYS   9  12.612   3.837   2.320
   63    HZ1  LYS   9           HZ1      LYS   9  13.192   6.407   0.965
   64    HZ2  LYS   9           HZ2      LYS   9  13.865   4.896   0.588
   65    HZ3  LYS   9           HZ3      LYS   9  14.212   5.616   2.065
   66    H    CYS  10           H        CYS  10   8.084   1.264  -0.556
   67    HA   CYS  10           HA       CYS  10   8.552  -0.728   1.505
   68    HB2  CYS  10           HB2      CYS  10   6.924  -2.242   0.419
   69    HB3  CYS  10           HB3      CYS  10   6.159  -0.843   1.175
   70    H    ARG  11           H        ARG  11   9.608  -2.562   0.641
   71    HA   ARG  11           HA       ARG  11  10.362  -2.381  -2.194
   72    HB2  ARG  11           HB2      ARG  11  11.929  -3.560   0.115
   73    HB3  ARG  11           HB3      ARG  11  12.330  -3.861  -1.563
   74    HG2  ARG  11           HG2      ARG  11  12.290  -1.132  -0.280
   75    HG3  ARG  11           HG3      ARG  11  13.736  -2.118  -0.479
   76    HD2  ARG  11           HD2      ARG  11  13.663  -0.493  -2.264
   77    HD3  ARG  11           HD3      ARG  11  13.346  -2.085  -2.946
   78    HE   ARG  11           HE       ARG  11  11.088  -0.361  -2.250
   79   HH11  ARG  11          HH11      ARG  11  13.012  -1.818  -4.817
   80   HH12  ARG  11          HH12      ARG  11  11.865  -1.567  -6.045
   81   HH21  ARG  11          HH21      ARG  11   9.512  -0.054  -3.840
   82   HH22  ARG  11          HH22      ARG  11   9.766  -0.543  -5.466
   83    H    ARG  12           H        ARG  12   9.246  -4.309   0.450
   84    HA   ARG  12           HA       ARG  12   8.244  -6.243  -1.482
   85    HB2  ARG  12           HB2      ARG  12   8.354  -7.907   0.382
   86    HB3  ARG  12           HB3      ARG  12   9.892  -7.506  -0.368
   87    HG2  ARG  12           HG2      ARG  12  10.370  -6.047   1.558
   88    HG3  ARG  12           HG3      ARG  12   8.826  -6.517   2.276
   89    HD2  ARG  12           HD2      ARG  12  10.724  -7.806   3.192
   90    HD3  ARG  12           HD3      ARG  12   9.537  -8.828   2.383
   91    HE   ARG  12           HE       ARG  12  11.705  -7.926   0.767
   92   HH11  ARG  12          HH11      ARG  12  10.469 -10.560   2.808
   93   HH12  ARG  12          HH12      ARG  12  11.559 -11.726   2.258
   94   HH21  ARG  12          HH21      ARG  12  13.241  -9.560  -0.018
   95   HH22  ARG  12          HH22      ARG  12  13.186 -11.138   0.612
   96    H    ASP  13           H        ASP  13   6.390  -7.357  -0.802
   97    HA   ASP  13           HA       ASP  13   4.366  -5.562  -0.202
   98    HB2  ASP  13           HB2      ASP  13   4.542  -8.520  -0.414
   99    HB3  ASP  13           HB3      ASP  13   3.055  -7.710   0.025
  100    H    SER  14           H        SER  14   6.201  -7.737   1.733
  101    HA   SER  14           HA       SER  14   4.447  -7.707   3.962
  102    HB2  SER  14           HB2      SER  14   6.531  -8.547   5.126
  103    HB3  SER  14           HB3      SER  14   5.813  -9.525   3.816
  104    HG   SER  14           HG       SER  14   7.772  -9.465   3.142
  105    H    ASP  15           H        ASP  15   6.577  -5.444   2.787
  106    HA   ASP  15           HA       ASP  15   7.149  -4.058   5.269
  107    HB2  ASP  15           HB2      ASP  15   7.121  -2.941   2.444
  108    HB3  ASP  15           HB3      ASP  15   7.603  -2.016   3.853
  109    H    CYS  16           H        CYS  16   4.356  -4.484   3.433
  110    HA   CYS  16           HA       CYS  16   3.112  -2.088   4.488
  111    HB2  CYS  16           HB2      CYS  16   2.315  -3.915   2.234
  112    HB3  CYS  16           HB3      CYS  16   1.572  -2.380   2.671
  113    HA   PRO  17           HA       PRO  17   1.065  -5.122   7.082
  114    HB2  PRO  17           HB2      PRO  17  -0.274  -3.452   8.664
  115    HB3  PRO  17           HB3      PRO  17   1.487  -3.561   8.730
  116    HG2  PRO  17           HG2      PRO  17  -0.235  -1.478   7.474
  117    HG3  PRO  17           HG3      PRO  17   1.314  -1.298   8.313
  118    HD2  PRO  17           HD2      PRO  17   0.950  -1.380   5.537
  119    HD3  PRO  17           HD3      PRO  17   2.487  -1.601   6.388
  120    H    GLY  18           H        GLY  18  -1.102  -5.735   7.787
  121    HA2  GLY  18           HA2      GLY  18  -3.262  -6.282   7.428
  122    HA3  GLY  18           HA3      GLY  18  -3.483  -4.603   6.968
  123    H    ALA  19           H        ALA  19  -4.465  -4.447   5.149
  124    HA   ALA  19           HA       ALA  19  -4.264  -6.568   3.152
  125    HB1  ALA  19           HB1      ALA  19  -6.213  -4.279   3.381
  126    HB2  ALA  19           HB2      ALA  19  -6.496  -5.927   3.934
  127    HB3  ALA  19           HB3      ALA  19  -6.292  -5.598   2.213
  128    H    CYS  20           H        CYS  20  -2.421  -4.083   3.751
  129    HA   CYS  20           HA       CYS  20  -2.496  -2.750   1.213
  130    HB2  CYS  20           HB2      CYS  20  -0.499  -2.709   3.459
  131    HB3  CYS  20           HB3      CYS  20  -0.491  -1.633   2.069
  132    H    ILE  21           H        ILE  21  -0.853  -2.954  -0.314
  133    HA   ILE  21           HA       ILE  21   1.043  -5.157  -0.009
  134    HB   ILE  21           HB       ILE  21   0.870  -5.584  -2.438
  135   HG12  ILE  21          HG12      ILE  21  -1.555  -3.765  -2.393
  136   HG13  ILE  21          HG13      ILE  21   0.006  -3.335  -3.072
  137   HG21  ILE  21          HG21      ILE  21  -0.361  -7.026  -0.971
  138   HG22  ILE  21          HG22      ILE  21  -1.288  -6.765  -2.450
  139   HG23  ILE  21          HG23      ILE  21  -1.728  -5.914  -0.969
  140   HD11  ILE  21          HD11      ILE  21  -1.756  -5.577  -4.043
  141   HD12  ILE  21          HD12      ILE  21  -0.220  -5.071  -4.752
  142   HD13  ILE  21          HD13      ILE  21  -1.606  -3.984  -4.783
  143    H    CYS  22           H        CYS  22   2.766  -4.795  -1.779
  144    HA   CYS  22           HA       CYS  22   3.533  -1.999  -1.563
  145    HB2  CYS  22           HB2      CYS  22   5.155  -3.789  -0.941
  146    HB3  CYS  22           HB3      CYS  22   5.104  -4.385  -2.596
  147    H    ARG  23           H        ARG  23   2.829  -0.717  -3.203
  148    HA   ARG  23           HA       ARG  23   1.892  -1.905  -5.638
  149    HB2  ARG  23           HB2      ARG  23   2.207   0.981  -4.858
  150    HB3  ARG  23           HB3      ARG  23   1.298   0.370  -6.214
  151    HG2  ARG  23           HG2      ARG  23   0.622  -0.420  -3.403
  152    HG3  ARG  23           HG3      ARG  23  -0.019   1.042  -4.135
  153    HD2  ARG  23           HD2      ARG  23  -0.366  -1.758  -5.227
  154    HD3  ARG  23           HD3      ARG  23  -1.573  -0.884  -4.282
  155    HE   ARG  23           HE       ARG  23  -0.570   0.225  -6.808
  156   HH11  ARG  23          HH11      ARG  23  -3.363  -0.968  -4.924
  157   HH12  ARG  23          HH12      ARG  23  -4.497  -0.461  -6.070
  158   HH21  ARG  23          HH21      ARG  23  -2.128   0.912  -8.325
  159   HH22  ARG  23          HH22      ARG  23  -3.791   0.655  -8.032
  160    H    GLY  24           H        GLY  24   2.600  -0.942  -7.719
  161    HA2  GLY  24           HA2      GLY  24   5.386  -1.434  -8.067
  162    HA3  GLY  24           HA3      GLY  24   4.264  -0.951  -9.321
  163    H    ASN  25           H        ASN  25   4.021   1.292  -6.967
  164    HA   ASN  25           HA       ASN  25   5.792   3.131  -8.350
  165    HB2  ASN  25           HB2      ASN  25   4.685   4.900  -7.072
  166    HB3  ASN  25           HB3      ASN  25   3.469   3.861  -7.796
  167   HD21  ASN  25          HD21      ASN  25   3.132   5.633  -5.576
  168   HD22  ASN  25          HD22      ASN  25   2.668   4.650  -4.241
  169    H    GLY  26           H        GLY  26   5.606   1.244  -5.493
  170    HA2  GLY  26           HA2      GLY  26   7.665   0.644  -4.403
  171    HA3  GLY  26           HA3      GLY  26   8.222   2.293  -4.667
  172    H    TYR  27           H        TYR  27   4.942   2.020  -3.767
  173    HA   TYR  27           HA       TYR  27   5.585   2.633  -1.017
  174    HB2  TYR  27           HB2      TYR  27   3.921   4.044  -3.005
  175    HB3  TYR  27           HB3      TYR  27   3.701   4.342  -1.269
  176    HD1  TYR  27           HD1      TYR  27   5.612   5.440  -0.036
  177    HD2  TYR  27           HD2      TYR  27   5.679   4.998  -4.257
  178    HE1  TYR  27           HE1      TYR  27   7.386   7.095  -0.162
  179    HE2  TYR  27           HE2      TYR  27   7.473   6.662  -4.409
  180    HH   TYR  27           HH       TYR  27   9.117   7.830  -1.589
  181    H    CYS  28           H        CYS  28   3.966   2.128   0.430
  182    HA   CYS  28           HA       CYS  28   2.487  -0.202  -0.129
  183    HB2  CYS  28           HB2      CYS  28   2.452   1.670   2.229
  184    HB3  CYS  28           HB3      CYS  28   1.545   0.162   2.163
  185    H    GLY  29           H        GLY  29   0.574  -0.455  -0.934
  186    HA2  GLY  29           HA2      GLY  29  -1.403   1.664  -0.682
  187    HA3  GLY  29           HA3      GLY  29  -0.959   1.124  -2.294
  188    H    GLU  30           H        GLU  30  -3.500   0.886  -1.298
  189    HA   GLU  30           HA       GLU  30  -4.059  -1.601  -0.246
  190    HB2  GLU  30           HB2      GLU  30  -5.648   0.178  -0.228
  191    HB3  GLU  30           HB3      GLU  30  -5.750   0.180  -1.990
  192    HG2  GLU  30           HG2      GLU  30  -6.875  -1.923  -1.947
  193    HG3  GLU  30           HG3      GLU  30  -6.608  -2.092  -0.211
  194    H    ALA  31           H        ALA  31  -5.007  -3.394  -1.253
  195    HA   ALA  31           HA       ALA  31  -3.378  -4.299  -3.449
  196    HB1  ALA  31           HB1      ALA  31  -4.326  -6.488  -3.024
  197    HB2  ALA  31           HB2      ALA  31  -5.515  -5.772  -1.931
  198    HB3  ALA  31           HB3      ALA  31  -3.804  -5.729  -1.521
  199    H    ILE  32           H        ILE  32  -6.536  -3.137  -3.110
  200    HA   ILE  32           HA       ILE  32  -7.695  -4.414  -5.370
  201    HB   ILE  32           HB       ILE  32  -8.641  -1.905  -3.920
  202   HG12  ILE  32          HG12      ILE  32  -9.308  -4.803  -3.347
  203   HG13  ILE  32          HG13      ILE  32  -8.280  -3.782  -2.350
  204   HG21  ILE  32          HG21      ILE  32  -9.802  -2.275  -6.035
  205   HG22  ILE  32          HG22      ILE  32 -10.886  -2.588  -4.682
  206   HG23  ILE  32          HG23      ILE  32 -10.164  -3.933  -5.563
  207   HD11  ILE  32          HD11      ILE  32 -11.223  -3.385  -2.866
  208   HD12  ILE  32          HD12      ILE  32 -10.200  -2.347  -1.873
  209   HD13  ILE  32          HD13      ILE  32 -10.494  -4.016  -1.387
  210    H    TYR  33           H        TYR  33  -8.220  -3.357  -7.419
  211    HA   TYR  33           HA       TYR  33  -6.079  -1.612  -8.264
  212    HB2  TYR  33           HB2      TYR  33  -8.170  -3.145  -9.820
  213    HB3  TYR  33           HB3      TYR  33  -6.923  -2.148 -10.538
  214    HD1  TYR  33           HD1      TYR  33  -4.583  -2.879 -10.525
  215    HD2  TYR  33           HD2      TYR  33  -7.647  -5.316  -8.860
  216    HE1  TYR  33           HE1      TYR  33  -3.062  -4.790 -10.543
  217    HE2  TYR  33           HE2      TYR  33  -6.136  -7.239  -8.866
  218    HH   TYR  33           HH       TYR  33  -2.802  -6.951  -9.357
  219    H    ALA  34           H        ALA  34  -9.229  -1.363  -7.289
  220    HA   ALA  34           HA       ALA  34 -10.023   0.955  -8.786
  221    HB1  ALA  34           HB1      ALA  34 -11.694  -0.548  -7.782
  222    HB2  ALA  34           HB2      ALA  34 -11.859   1.082  -7.130
  223    HB3  ALA  34           HB3      ALA  34 -11.072  -0.172  -6.176
  224    H    ALA  35           H        ALA  35 -10.730   2.919  -7.107
  225    HA   ALA  35           HA       ALA  35  -8.313   4.104  -6.310
  226    HB1  ALA  35           HB1      ALA  35 -10.310   5.423  -6.884
  227    HB2  ALA  35           HB2      ALA  35  -9.702   5.850  -5.286
  228    HB3  ALA  35           HB3      ALA  35 -11.122   4.819  -5.438
  229    HA   PRO  36           HA       PRO  36  -7.607   1.737  -2.552
  230    HB2  PRO  36           HB2      PRO  36  -5.856   4.080  -1.996
  231    HB3  PRO  36           HB3      PRO  36  -5.477   2.358  -1.917
  232    HG2  PRO  36           HG2      PRO  36  -4.601   3.797  -3.948
  233    HG3  PRO  36           HG3      PRO  36  -5.256   2.173  -4.227
  234    HD2  PRO  36           HD2      PRO  36  -6.537   4.832  -4.709
  235    HD3  PRO  36           HD3      PRO  36  -6.578   3.341  -5.680
  236    H    PHE  37           H        PHE  37  -7.995   1.916  -0.376
  237    HA   PHE  37           HA       PHE  37  -9.901   3.973   0.368
  238    HB2  PHE  37           HB2      PHE  37 -10.417   1.620   0.772
  239    HB3  PHE  37           HB3      PHE  37  -8.990   1.452   1.778
  240    HD1  PHE  37           HD1      PHE  37 -12.142   3.397   1.524
  241    HD2  PHE  37           HD2      PHE  37  -9.231   1.642   4.076
  242    HE1  PHE  37           HE1      PHE  37 -13.515   3.972   3.481
  243    HE2  PHE  37           HE2      PHE  37 -10.600   2.221   6.033
  244    HZ   PHE  37           HZ       PHE  37 -12.737   3.388   5.735
  245    H    ALA  38           H        ALA  38  -6.592   3.412   0.721
  246    HA   ALA  38           HA       ALA  38  -4.966   4.300   1.766
  247    HB1  ALA  38           HB1      ALA  38  -6.845   6.398   2.909
  248    HB2  ALA  38           HB2      ALA  38  -5.915   6.559   1.415
  249    HB3  ALA  38           HB3      ALA  38  -5.086   6.472   2.965
  250    H    ARG  39           H        ARG  39  -5.302   2.274   2.676
  251    HA   ARG  39           HA       ARG  39  -6.513   1.906   5.252
  252    HB2  ARG  39           HB2      ARG  39  -4.552   0.019   4.003
  253    HB3  ARG  39           HB3      ARG  39  -5.905  -0.342   5.070
  254    HG2  ARG  39           HG2      ARG  39  -7.438   0.423   3.257
  255    HG3  ARG  39           HG3      ARG  39  -6.035   0.522   2.197
  256    HD2  ARG  39           HD2      ARG  39  -7.083  -1.567   1.805
  257    HD3  ARG  39           HD3      ARG  39  -5.606  -1.890   2.718
  258    HE   ARG  39           HE       ARG  39  -6.863  -2.368   4.596
  259   HH11  ARG  39          HH11      ARG  39  -8.938  -1.569   1.787
  260   HH12  ARG  39          HH12      ARG  39 -10.329  -2.251   2.458
  261   HH21  ARG  39          HH21      ARG  39  -8.853  -3.301   5.519
  262   HH22  ARG  39          HH22      ARG  39 -10.285  -3.226   4.629
  Start of MODEL   14
    1    H1   CYS   1           H        CYS   1  -2.888   2.396   2.484
    2    HA   CYS   1           HA       CYS   1  -1.761   2.984   5.098
    3    HB2  CYS   1           HB2      CYS   1  -0.270   1.683   2.798
    4    HB3  CYS   1           HB3      CYS   1   0.456   2.242   4.296
    5    H    GLU   2           H        GLU   2  -2.020   5.173   4.905
    6    HA   GLU   2           HA       GLU   2  -0.227   6.418   3.031
    7    HB2  GLU   2           HB2      GLU   2  -2.342   6.511   1.842
    8    HB3  GLU   2           HB3      GLU   2  -3.146   7.232   3.238
    9    HG2  GLU   2           HG2      GLU   2  -1.886   9.258   2.960
   10    HG3  GLU   2           HG3      GLU   2  -0.875   8.513   1.726
   11    H    ALA   3           H        ALA   3   0.472   8.444   3.688
   12    HA   ALA   3           HA       ALA   3  -0.274   9.770   6.007
   13    HB1  ALA   3           HB1      ALA   3   1.760   9.314   7.314
   14    HB2  ALA   3           HB2      ALA   3   2.247   8.091   6.142
   15    HB3  ALA   3           HB3      ALA   3   0.806   7.845   7.131
   16    H    ILE   4           H        ILE   4   0.857  11.676   6.038
   17    HA   ILE   4           HA       ILE   4   2.079  12.176   3.447
   18    HB   ILE   4           HB       ILE   4   1.029  14.249   5.415
   19   HG12  ILE   4          HG12      ILE   4  -0.703  14.648   3.566
   20   HG13  ILE   4          HG13      ILE   4  -0.186  13.116   2.885
   21   HG21  ILE   4          HG21      ILE   4   2.794  15.191   4.085
   22   HG22  ILE   4          HG22      ILE   4   1.244  15.860   3.567
   23   HG23  ILE   4          HG23      ILE   4   2.036  14.610   2.606
   24   HD11  ILE   4          HD11      ILE   4  -2.229  12.903   4.197
   25   HD12  ILE   4          HD12      ILE   4  -1.384  13.515   5.619
   26   HD13  ILE   4          HD13      ILE   4  -0.909  11.974   4.907
   27    H    TYR   5           H        TYR   5   2.954  12.301   6.791
   28    HA   TYR   5           HA       TYR   5   5.417  13.716   6.151
   29    HB2  TYR   5           HB2      TYR   5   4.330  14.171   8.288
   30    HB3  TYR   5           HB3      TYR   5   4.441  12.497   8.736
   31    HD1  TYR   5           HD2      TYR   5   6.681  15.346   7.831
   32    HD2  TYR   5           HD1      TYR   5   6.218  11.712   9.991
   33    HE1  TYR   5           HE2      TYR   5   8.887  15.673   8.843
   34    HE2  TYR   5           HE1      TYR   5   8.421  12.023  11.007
   35    HH   TYR   5           HH       TYR   5  10.070  14.911  10.959
   36    H    ALA   6           H        ALA   6   4.355  10.632   7.131
   37    HA   ALA   6           HA       ALA   6   6.896   9.534   6.150
   38    HB1  ALA   6           HB1      ALA   6   6.829   7.761   7.828
   39    HB2  ALA   6           HB2      ALA   6   5.330   8.419   8.480
   40    HB3  ALA   6           HB3      ALA   6   6.824   9.346   8.603
   41    H    ALA   7           H        ALA   7   5.944   9.253   4.127
   42    HA   ALA   7           HA       ALA   7   3.619   7.584   3.906
   43    HB1  ALA   7           HB1      ALA   7   3.984   9.395   2.297
   44    HB2  ALA   7           HB2      ALA   7   3.932   7.830   1.484
   45    HB3  ALA   7           HB3      ALA   7   5.480   8.627   1.767
   46    HA   PRO   8           HA       PRO   8   6.081   3.981   4.412
   47    HB2  PRO   8           HB2      PRO   8   4.146   2.130   3.911
   48    HB3  PRO   8           HB3      PRO   8   4.287   3.013   5.432
   49    HG2  PRO   8           HG2      PRO   8   2.466   3.509   3.118
   50    HG3  PRO   8           HG3      PRO   8   2.132   3.623   4.855
   51    HD2  PRO   8           HD2      PRO   8   2.601   5.788   3.292
   52    HD3  PRO   8           HD3      PRO   8   3.015   5.733   5.016
   53    H    LYS   9           H        LYS   9   7.534   3.863   2.877
   54    HA   LYS   9           HA       LYS   9   6.867   3.017   0.184
   55    HB2  LYS   9           HB2      LYS   9   9.530   3.545   1.533
   56    HB3  LYS   9           HB3      LYS   9   9.358   3.019  -0.131
   57    HG2  LYS   9           HG2      LYS   9   8.113   5.079  -0.635
   58    HG3  LYS   9           HG3      LYS   9   8.355   5.612   1.027
   59    HD2  LYS   9           HD2      LYS   9  10.759   5.628   0.710
   60    HD3  LYS   9           HD3      LYS   9  10.581   4.956  -0.908
   61    HE2  LYS   9           HE2      LYS   9  11.006   7.335  -1.064
   62    HE3  LYS   9           HE3      LYS   9   9.364   6.994  -1.592
   63    HZ1  LYS   9           HZ1      LYS   9  10.103   8.035   1.095
   64    HZ2  LYS   9           HZ2      LYS   9   8.529   7.803   0.512
   65    HZ3  LYS   9           HZ3      LYS   9   9.527   8.960  -0.181
   66    H    CYS  10           H        CYS  10   7.713   1.069  -0.705
   67    HA   CYS  10           HA       CYS  10   8.122  -1.008   1.341
   68    HB2  CYS  10           HB2      CYS  10   6.782  -2.509  -0.039
   69    HB3  CYS  10           HB3      CYS  10   5.850  -1.118   0.507
   70    H    ARG  11           H        ARG  11   9.523  -2.632   0.819
   71    HA   ARG  11           HA       ARG  11  10.804  -2.478  -1.826
   72    HB2  ARG  11           HB2      ARG  11  11.826  -3.852   0.676
   73    HB3  ARG  11           HB3      ARG  11  12.685  -3.697  -0.838
   74    HG2  ARG  11           HG2      ARG  11  12.006  -1.470   1.080
   75    HG3  ARG  11           HG3      ARG  11  13.598  -2.156   0.777
   76    HD2  ARG  11           HD2      ARG  11  11.901  -0.652  -1.219
   77    HD3  ARG  11           HD3      ARG  11  13.299  -0.008  -0.362
   78    HE   ARG  11           HE       ARG  11  14.190  -2.246  -1.664
   79   HH11  ARG  11          HH11      ARG  11  12.702   0.808  -2.660
   80   HH12  ARG  11          HH12      ARG  11  13.500   0.890  -4.150
   81   HH21  ARG  11          HH21      ARG  11  15.309  -2.147  -3.701
   82   HH22  ARG  11          HH22      ARG  11  15.065  -0.844  -4.759
   83    H    ARG  12           H        ARG  12   9.363  -4.412   0.668
   84    HA   ARG  12           HA       ARG  12   8.569  -6.437  -1.276
   85    HB2  ARG  12           HB2      ARG  12   8.670  -8.002   0.774
   86    HB3  ARG  12           HB3      ARG  12  10.148  -7.679  -0.101
   87    HG2  ARG  12           HG2      ARG  12  10.580  -5.886   1.646
   88    HG3  ARG  12           HG3      ARG  12   9.244  -6.593   2.551
   89    HD2  ARG  12           HD2      ARG  12  11.732  -8.067   1.671
   90    HD3  ARG  12           HD3      ARG  12  11.467  -7.429   3.288
   91    HE   ARG  12           HE       ARG  12   9.362  -9.157   2.538
   92   HH11  ARG  12          HH11      ARG  12  12.733  -9.253   3.620
   93   HH12  ARG  12          HH12      ARG  12  12.607 -10.832   4.263
   94   HH21  ARG  12          HH21      ARG  12   9.214 -11.291   3.446
   95   HH22  ARG  12          HH22      ARG  12  10.584 -11.985   4.184
   96    H    ASP  13           H        ASP  13   6.644  -7.568  -0.683
   97    HA   ASP  13           HA       ASP  13   4.610  -5.721  -0.210
   98    HB2  ASP  13           HB2      ASP  13   4.705  -8.695  -0.423
   99    HB3  ASP  13           HB3      ASP  13   3.229  -7.823  -0.100
  100    H    SER  14           H        SER  14   6.259  -7.901   1.797
  101    HA   SER  14           HA       SER  14   4.534  -8.017   4.006
  102    HB2  SER  14           HB2      SER  14   6.705  -8.533   5.221
  103    HB3  SER  14           HB3      SER  14   6.250  -9.604   3.887
  104    HG   SER  14           HG       SER  14   8.322  -7.809   4.128
  105    H    ASP  15           H        ASP  15   6.689  -5.526   2.907
  106    HA   ASP  15           HA       ASP  15   6.974  -4.074   5.350
  107    HB2  ASP  15           HB2      ASP  15   7.054  -3.068   2.496
  108    HB3  ASP  15           HB3      ASP  15   7.432  -2.078   3.894
  109    H    CYS  16           H        CYS  16   4.357  -4.623   3.342
  110    HA   CYS  16           HA       CYS  16   3.017  -2.187   4.122
  111    HB2  CYS  16           HB2      CYS  16   2.372  -4.240   2.030
  112    HB3  CYS  16           HB3      CYS  16   1.639  -2.648   2.226
  113    HA   PRO  17           HA       PRO  17   0.970  -5.110   6.890
  114    HB2  PRO  17           HB2      PRO  17  -0.054  -3.310   8.584
  115    HB3  PRO  17           HB3      PRO  17   1.672  -3.697   8.584
  116    HG2  PRO  17           HG2      PRO  17   0.250  -1.348   7.403
  117    HG3  PRO  17           HG3      PRO  17   1.799  -1.402   8.264
  118    HD2  PRO  17           HD2      PRO  17   1.533  -1.315   5.519
  119    HD3  PRO  17           HD3      PRO  17   2.957  -1.940   6.371
  120    H    GLY  18           H        GLY  18  -1.330  -5.133   7.864
  121    HA2  GLY  18           HA2      GLY  18  -3.591  -5.134   7.633
  122    HA3  GLY  18           HA3      GLY  18  -3.417  -3.634   6.735
  123    H    ALA  19           H        ALA  19  -3.970  -3.661   4.687
  124    HA   ALA  19           HA       ALA  19  -4.069  -6.220   3.275
  125    HB1  ALA  19           HB1      ALA  19  -6.031  -3.926   3.067
  126    HB2  ALA  19           HB2      ALA  19  -6.333  -5.462   3.878
  127    HB3  ALA  19           HB3      ALA  19  -6.084  -5.423   2.134
  128    H    CYS  20           H        CYS  20  -2.185  -3.809   3.562
  129    HA   CYS  20           HA       CYS  20  -2.208  -2.691   0.936
  130    HB2  CYS  20           HB2      CYS  20  -0.214  -2.455   3.172
  131    HB3  CYS  20           HB3      CYS  20  -0.256  -1.486   1.712
  132    H    ILE  21           H        ILE  21  -0.750  -3.099  -0.573
  133    HA   ILE  21           HA       ILE  21   1.133  -5.301  -0.166
  134    HB   ILE  21           HB       ILE  21   0.856  -5.901  -2.528
  135   HG12  ILE  21          HG12      ILE  21  -1.372  -3.846  -2.637
  136   HG13  ILE  21          HG13      ILE  21   0.228  -3.614  -3.327
  137   HG21  ILE  21          HG21      ILE  21  -0.567  -7.062  -0.934
  138   HG22  ILE  21          HG22      ILE  21  -1.432  -6.831  -2.454
  139   HG23  ILE  21          HG23      ILE  21  -1.788  -5.798  -1.073
  140   HD11  ILE  21          HD11      ILE  21  -0.148  -5.504  -4.811
  141   HD12  ILE  21          HD12      ILE  21  -1.368  -4.244  -5.030
  142   HD13  ILE  21          HD13      ILE  21  -1.761  -5.717  -4.133
  143    H    CYS  22           H        CYS  22   2.848  -5.064  -2.045
  144    HA   CYS  22           HA       CYS  22   3.767  -2.324  -1.804
  145    HB2  CYS  22           HB2      CYS  22   5.346  -4.159  -1.286
  146    HB3  CYS  22           HB3      CYS  22   5.182  -4.782  -2.922
  147    H    ARG  23           H        ARG  23   3.010  -0.991  -3.290
  148    HA   ARG  23           HA       ARG  23   2.046  -1.989  -5.787
  149    HB2  ARG  23           HB2      ARG  23   2.244   0.807  -4.724
  150    HB3  ARG  23           HB3      ARG  23   1.405   0.297  -6.165
  151    HG2  ARG  23           HG2      ARG  23  -0.128  -1.050  -4.807
  152    HG3  ARG  23           HG3      ARG  23   0.699  -0.491  -3.358
  153    HD2  ARG  23           HD2      ARG  23  -1.376   0.814  -3.905
  154    HD3  ARG  23           HD3      ARG  23   0.091   1.784  -3.757
  155    HE   ARG  23           HE       ARG  23  -0.247   1.005  -6.423
  156   HH11  ARG  23          HH11      ARG  23  -1.906   3.133  -4.124
  157   HH12  ARG  23          HH12      ARG  23  -2.294   4.293  -5.301
  158   HH21  ARG  23          HH21      ARG  23  -0.782   2.615  -8.004
  159   HH22  ARG  23          HH22      ARG  23  -1.666   3.986  -7.561
  160    H    GLY  24           H        GLY  24   2.607  -0.758  -7.780
  161    HA2  GLY  24           HA2      GLY  24   5.408  -1.042  -8.312
  162    HA3  GLY  24           HA3      GLY  24   4.181  -0.507  -9.450
  163    H    ASN  25           H        ASN  25   3.742   1.449  -6.986
  164    HA   ASN  25           HA       ASN  25   5.353   3.570  -8.144
  165    HB2  ASN  25           HB2      ASN  25   4.026   5.090  -6.795
  166    HB3  ASN  25           HB3      ASN  25   2.941   3.962  -7.594
  167   HD21  ASN  25          HD21      ASN  25   2.273   5.505  -5.381
  168   HD22  ASN  25          HD22      ASN  25   1.951   4.487  -4.041
  169    H    GLY  26           H        GLY  26   5.437   1.359  -5.588
  170    HA2  GLY  26           HA2      GLY  26   7.474   0.900  -4.479
  171    HA3  GLY  26           HA3      GLY  26   7.928   2.592  -4.667
  172    H    TYR  27           H        TYR  27   4.731   2.056  -3.767
  173    HA   TYR  27           HA       TYR  27   5.327   2.675  -0.990
  174    HB2  TYR  27           HB2      TYR  27   3.470   3.829  -2.946
  175    HB3  TYR  27           HB3      TYR  27   3.034   3.906  -1.228
  176    HD1  TYR  27           HD2      TYR  27   4.728   5.029   0.305
  177    HD2  TYR  27           HD1      TYR  27   4.882   5.425  -3.918
  178    HE1  TYR  27           HE2      TYR  27   6.101   7.018   0.558
  179    HE2  TYR  27           HE1      TYR  27   6.272   7.434  -3.681
  180    HH   TYR  27           HH       TYR  27   6.713   9.178  -1.937
  181    H    CYS  28           H        CYS  28   3.845   1.987   0.478
  182    HA   CYS  28           HA       CYS  28   2.535  -0.488  -0.126
  183    HB2  CYS  28           HB2      CYS  28   2.806   1.152   2.378
  184    HB3  CYS  28           HB3      CYS  28   1.908  -0.361   2.307
  185    H    GLY  29           H        GLY  29   0.555  -0.598  -0.895
  186    HA2  GLY  29           HA2      GLY  29  -1.409   1.248   0.154
  187    HA3  GLY  29           HA3      GLY  29  -1.161   1.272  -1.592
  188    H    GLU  30           H        GLU  30  -3.575   0.627  -0.389
  189    HA   GLU  30           HA       GLU  30  -3.984  -2.099  -0.136
  190    HB2  GLU  30           HB2      GLU  30  -5.464  -0.497   0.764
  191    HB3  GLU  30           HB3      GLU  30  -5.874   0.165  -0.825
  192    HG2  GLU  30           HG2      GLU  30  -7.096  -1.887  -1.300
  193    HG3  GLU  30           HG3      GLU  30  -6.549  -2.576   0.230
  194    H    ALA  31           H        ALA  31  -5.242  -3.402  -1.651
  195    HA   ALA  31           HA       ALA  31  -3.760  -3.530  -4.090
  196    HB1  ALA  31           HB1      ALA  31  -6.124  -5.193  -3.247
  197    HB2  ALA  31           HB2      ALA  31  -4.431  -5.569  -2.917
  198    HB3  ALA  31           HB3      ALA  31  -5.028  -5.544  -4.578
  199    H    ILE  32           H        ILE  32  -7.187  -3.120  -3.407
  200    HA   ILE  32           HA       ILE  32  -7.334  -1.714  -5.945
  201    HB   ILE  32           HB       ILE  32  -9.613  -3.268  -4.691
  202   HG12  ILE  32          HG12      ILE  32  -7.900  -4.061  -7.069
  203   HG13  ILE  32          HG13      ILE  32  -7.864  -4.827  -5.487
  204   HG21  ILE  32          HG21      ILE  32  -9.351  -1.971  -7.404
  205   HG22  ILE  32          HG22      ILE  32 -10.359  -1.413  -6.068
  206   HG23  ILE  32          HG23      ILE  32 -10.726  -2.938  -6.874
  207   HD11  ILE  32          HD11      ILE  32  -9.112  -6.165  -7.081
  208   HD12  ILE  32          HD12      ILE  32 -10.190  -4.808  -7.399
  209   HD13  ILE  32          HD13      ILE  32 -10.178  -5.567  -5.808
  210    H    TYR  33           H        TYR  33  -8.415   0.214  -5.801
  211    HA   TYR  33           HA       TYR  33  -8.889   1.086  -3.090
  212    HB2  TYR  33           HB2      TYR  33  -8.183   2.581  -5.590
  213    HB3  TYR  33           HB3      TYR  33  -8.769   3.382  -4.142
  214    HD1  TYR  33           HD2      TYR  33  -6.010   1.338  -5.534
  215    HD2  TYR  33           HD1      TYR  33  -7.325   3.759  -2.298
  216    HE1  TYR  33           HE2      TYR  33  -3.729   1.408  -4.669
  217    HE2  TYR  33           HE1      TYR  33  -5.048   3.843  -1.425
  218    HH   TYR  33           HH       TYR  33  -2.978   2.669  -1.547
  219    H    ALA  34           H        ALA  34 -10.911   0.100  -3.025
  220    HA   ALA  34           HA       ALA  34 -12.930   1.940  -4.031
  221    HB1  ALA  34           HB1      ALA  34 -14.470   0.080  -4.429
  222    HB2  ALA  34           HB2      ALA  34 -13.208  -1.067  -3.979
  223    HB3  ALA  34           HB3      ALA  34 -13.021  -0.065  -5.421
  224    H    ALA  35           H        ALA  35 -13.380  -0.983  -2.155
  225    HA   ALA  35           HA       ALA  35 -14.460   0.528   0.043
  226    HB1  ALA  35           HB1      ALA  35 -15.469  -1.605  -0.608
  227    HB2  ALA  35           HB2      ALA  35 -14.849  -1.682   1.041
  228    HB3  ALA  35           HB3      ALA  35 -13.949  -2.434  -0.276
  229    HA   PRO  36           HA       PRO  36 -10.309   0.656   1.740
  230    HB2  PRO  36           HB2      PRO  36 -10.887   2.161   3.935
  231    HB3  PRO  36           HB3      PRO  36 -10.670   2.856   2.327
  232    HG2  PRO  36           HG2      PRO  36 -13.181   2.299   3.828
  233    HG3  PRO  36           HG3      PRO  36 -12.806   3.632   2.724
  234    HD2  PRO  36           HD2      PRO  36 -14.305   1.412   2.060
  235    HD3  PRO  36           HD3      PRO  36 -13.452   2.436   0.891
  236    H    PHE  37           H        PHE  37  -9.535  -1.075   2.772
  237    HA   PHE  37           HA       PHE  37 -11.087  -2.099   5.040
  238    HB2  PHE  37           HB2      PHE  37 -10.879  -3.721   3.146
  239    HB3  PHE  37           HB3      PHE  37  -9.128  -3.628   3.289
  240    HD1  PHE  37           HD1      PHE  37  -7.998  -4.628   5.269
  241    HD2  PHE  37           HD2      PHE  37 -12.191  -5.039   4.641
  242    HE1  PHE  37           HE1      PHE  37  -8.063  -6.459   6.905
  243    HE2  PHE  37           HE2      PHE  37 -12.257  -6.865   6.278
  244    HZ   PHE  37           HZ       PHE  37 -10.190  -7.577   7.416
  245    H    ALA  38           H        ALA  38  -7.861  -1.800   3.697
  246    HA   ALA  38           HA       ALA  38  -6.899  -0.682   6.121
  247    HB1  ALA  38           HB1      ALA  38  -6.793  -3.036   6.713
  248    HB2  ALA  38           HB2      ALA  38  -5.165  -2.370   6.504
  249    HB3  ALA  38           HB3      ALA  38  -5.874  -3.378   5.248
  250    H    ARG  39           H        ARG  39  -6.504   0.960   4.745
  251    HA   ARG  39           HA       ARG  39  -4.545   0.579   2.633
  252    HB2  ARG  39           HB2      ARG  39  -6.129   2.979   3.485
  253    HB3  ARG  39           HB3      ARG  39  -5.001   2.958   2.136
  254    HG2  ARG  39           HG2      ARG  39  -6.311   1.257   1.043
  255    HG3  ARG  39           HG3      ARG  39  -7.426   1.216   2.407
  256    HD2  ARG  39           HD2      ARG  39  -8.048   3.488   1.956
  257    HD3  ARG  39           HD3      ARG  39  -6.904   3.564   0.602
  258    HE   ARG  39           HE       ARG  39  -8.525   1.359   0.218
  259   HH11  ARG  39          HH11      ARG  39  -8.975   4.874   0.310
  260   HH12  ARG  39          HH12      ARG  39 -10.300   4.825  -0.764
  261   HH21  ARG  39          HH21      ARG  39 -10.241   1.318  -1.103
  262   HH22  ARG  39          HH22      ARG  39 -11.076   2.758  -1.594
  Start of MODEL   15
    1    H1   CYS   1           H        CYS   1  -5.203  -0.147   5.019
    2    HA   CYS   1           HA       CYS   1  -3.450   1.810   5.907
    3    HB2  CYS   1           HB2      CYS   1  -1.787  -0.149   5.554
    4    HB3  CYS   1           HB3      CYS   1  -3.091  -0.287   6.729
    5    H    GLU   2           H        GLU   2  -4.183   2.711   3.367
    6    HA   GLU   2           HA       GLU   2  -1.919   2.384   1.559
    7    HB2  GLU   2           HB2      GLU   2  -4.296   2.359   0.728
    8    HB3  GLU   2           HB3      GLU   2  -4.493   3.994   1.319
    9    HG2  GLU   2           HG2      GLU   2  -2.828   4.773  -0.301
   10    HG3  GLU   2           HG3      GLU   2  -2.633   3.126  -0.902
   11    H    ALA   3           H        ALA   3  -1.274   4.708   0.614
   12    HA   ALA   3           HA       ALA   3  -0.199   6.318   2.631
   13    HB1  ALA   3           HB1      ALA   3   0.788   6.137   0.389
   14    HB2  ALA   3           HB2      ALA   3   0.398   7.817   0.780
   15    HB3  ALA   3           HB3      ALA   3  -0.649   6.893  -0.296
   16    H    ILE   4           H        ILE   4  -1.673   7.010   3.906
   17    HA   ILE   4           HA       ILE   4  -3.733   8.853   2.864
   18    HB   ILE   4           HB       ILE   4  -3.621   7.619   5.635
   19   HG12  ILE   4          HG12      ILE   4  -5.431   6.890   3.328
   20   HG13  ILE   4          HG13      ILE   4  -4.049   5.934   3.858
   21   HG21  ILE   4          HG21      ILE   4  -4.789   9.768   5.567
   22   HG22  ILE   4          HG22      ILE   4  -5.909   8.442   5.880
   23   HG23  ILE   4          HG23      ILE   4  -5.835   9.164   4.277
   24   HD11  ILE   4          HD11      ILE   4  -5.135   5.617   6.028
   25   HD12  ILE   4          HD12      ILE   4  -6.123   5.015   4.698
   26   HD13  ILE   4          HD13      ILE   4  -6.513   6.559   5.461
   27    H    TYR   5           H        TYR   5  -1.885   8.456   5.759
   28    HA   TYR   5           HA       TYR   5  -1.724  11.302   6.292
   29    HB2  TYR   5           HB2      TYR   5  -2.233   9.802   8.072
   30    HB3  TYR   5           HB3      TYR   5  -0.906   8.767   7.656
   31    HD1  TYR   5           HD1      TYR   5  -1.472  12.284   8.839
   32    HD2  TYR   5           HD2      TYR   5   1.040   8.855   8.837
   33    HE1  TYR   5           HE1      TYR   5  -0.012  13.342  10.497
   34    HE2  TYR   5           HE2      TYR   5   2.502   9.900  10.482
   35    HH   TYR   5           HH       TYR   5   3.071  12.182  11.261
   36    H    ALA   6           H        ALA   6   0.114   8.603   5.443
   37    HA   ALA   6           HA       ALA   6   2.347  10.275   4.614
   38    HB1  ALA   6           HB1      ALA   6   2.706   7.984   6.547
   39    HB2  ALA   6           HB2      ALA   6   2.912   9.695   6.919
   40    HB3  ALA   6           HB3      ALA   6   4.004   8.901   5.784
   41    H    ALA   7           H        ALA   7   3.439   9.423   2.940
   42    HA   ALA   7           HA       ALA   7   2.330   7.145   1.616
   43    HB1  ALA   7           HB1      ALA   7   4.687   8.905   0.921
   44    HB2  ALA   7           HB2      ALA   7   3.034   9.111   0.343
   45    HB3  ALA   7           HB3      ALA   7   3.968   7.693  -0.139
   46    HA   PRO   8           HA       PRO   8   5.422   4.740   3.854
   47    HB2  PRO   8           HB2      PRO   8   3.923   2.357   3.476
   48    HB3  PRO   8           HB3      PRO   8   3.979   3.357   4.929
   49    HG2  PRO   8           HG2      PRO   8   1.748   3.011   3.281
   50    HG3  PRO   8           HG3      PRO   8   1.964   4.299   4.473
   51    HD2  PRO   8           HD2      PRO   8   2.354   4.372   1.519
   52    HD3  PRO   8           HD3      PRO   8   1.749   5.619   2.633
   53    H    LYS   9           H        LYS   9   7.139   4.248   2.745
   54    HA   LYS   9           HA       LYS   9   7.015   3.222   0.038
   55    HB2  LYS   9           HB2      LYS   9   9.524   3.365   0.210
   56    HB3  LYS   9           HB3      LYS   9   8.680   4.888   0.454
   57    HG2  LYS   9           HG2      LYS   9   8.916   4.562   2.900
   58    HG3  LYS   9           HG3      LYS   9   9.871   3.116   2.574
   59    HD2  LYS   9           HD2      LYS   9  11.543   4.435   1.446
   60    HD3  LYS   9           HD3      LYS   9  10.551   5.888   1.607
   61    HE2  LYS   9           HE2      LYS   9  10.688   5.677   4.053
   62    HE3  LYS   9           HE3      LYS   9  11.714   4.260   3.845
   63    HZ1  LYS   9           HZ1      LYS   9  12.361   6.990   2.909
   64    HZ2  LYS   9           HZ2      LYS   9  13.359   5.636   2.784
   65    HZ3  LYS   9           HZ3      LYS   9  12.975   6.268   4.302
   66    H    CYS  10           H        CYS  10   8.100   1.262  -0.615
   67    HA   CYS  10           HA       CYS  10   8.463  -0.719   1.499
   68    HB2  CYS  10           HB2      CYS  10   7.011  -2.291   0.209
   69    HB3  CYS  10           HB3      CYS  10   6.143  -0.945   0.944
   70    H    ARG  11           H        ARG  11   9.490  -2.621   0.742
   71    HA   ARG  11           HA       ARG  11  10.724  -2.489  -1.937
   72    HB2  ARG  11           HB2      ARG  11  11.807  -3.763   0.597
   73    HB3  ARG  11           HB3      ARG  11  12.571  -3.849  -0.982
   74    HG2  ARG  11           HG2      ARG  11  12.885  -1.425  -0.954
   75    HG3  ARG  11           HG3      ARG  11  12.129  -1.356   0.640
   76    HD2  ARG  11           HD2      ARG  11  13.891  -2.768   1.551
   77    HD3  ARG  11           HD3      ARG  11  14.624  -2.899  -0.045
   78    HE   ARG  11           HE       ARG  11  14.302  -0.206   0.834
   79   HH11  ARG  11          HH11      ARG  11  16.432  -3.029   1.039
   80   HH12  ARG  11          HH12      ARG  11  17.833  -2.105   1.324
   81   HH21  ARG  11          HH21      ARG  11  16.244   1.029   1.196
   82   HH22  ARG  11          HH22      ARG  11  17.742   0.228   1.384
   83    H    ARG  12           H        ARG  12   9.403  -4.396   0.674
   84    HA   ARG  12           HA       ARG  12   8.614  -6.452  -1.214
   85    HB2  ARG  12           HB2      ARG  12   8.599  -7.916   0.905
   86    HB3  ARG  12           HB3      ARG  12  10.127  -7.599   0.112
   87    HG2  ARG  12           HG2      ARG  12  10.406  -5.706   1.833
   88    HG3  ARG  12           HG3      ARG  12   9.025  -6.415   2.663
   89    HD2  ARG  12           HD2      ARG  12  11.597  -7.862   2.034
   90    HD3  ARG  12           HD3      ARG  12  11.214  -7.126   3.585
   91    HE   ARG  12           HE       ARG  12   9.144  -8.797   3.077
   92   HH11  ARG  12          HH11      ARG  12  12.646  -9.193   3.376
   93   HH12  ARG  12          HH12      ARG  12  12.569 -10.764   4.003
   94   HH21  ARG  12          HH21      ARG  12   9.043 -11.011   3.894
   95   HH22  ARG  12          HH22      ARG  12  10.480 -11.822   4.299
   96    H    ASP  13           H        ASP  13   6.617  -7.473  -0.721
   97    HA   ASP  13           HA       ASP  13   4.643  -5.519  -0.241
   98    HB2  ASP  13           HB2      ASP  13   4.618  -8.453  -0.731
   99    HB3  ASP  13           HB3      ASP  13   3.154  -7.581  -0.339
  100    H    SER  14           H        SER  14   6.095  -7.926   1.608
  101    HA   SER  14           HA       SER  14   4.361  -7.935   3.809
  102    HB2  SER  14           HB2      SER  14   6.465  -8.847   4.915
  103    HB3  SER  14           HB3      SER  14   5.692  -9.750   3.582
  104    HG   SER  14           HG       SER  14   7.333  -9.478   2.441
  105    H    ASP  15           H        ASP  15   6.549  -5.622   2.778
  106    HA   ASP  15           HA       ASP  15   7.101  -4.307   5.285
  107    HB2  ASP  15           HB2      ASP  15   6.986  -3.161   2.480
  108    HB3  ASP  15           HB3      ASP  15   7.259  -2.149   3.881
  109    H    CYS  16           H        CYS  16   4.370  -4.559   3.238
  110    HA   CYS  16           HA       CYS  16   3.110  -2.208   4.331
  111    HB2  CYS  16           HB2      CYS  16   2.195  -4.134   2.209
  112    HB3  CYS  16           HB3      CYS  16   1.561  -2.522   2.543
  113    HA   PRO  17           HA       PRO  17   1.001  -5.059   7.094
  114    HB2  PRO  17           HB2      PRO  17  -0.032  -3.245   8.745
  115    HB3  PRO  17           HB3      PRO  17   1.713  -3.524   8.695
  116    HG2  PRO  17           HG2      PRO  17   0.113  -1.324   7.454
  117    HG3  PRO  17           HG3      PRO  17   1.677  -1.237   8.282
  118    HD2  PRO  17           HD2      PRO  17   1.345  -1.318   5.531
  119    HD3  PRO  17           HD3      PRO  17   2.831  -1.770   6.393
  120    H    GLY  18           H        GLY  18  -1.365  -4.651   8.259
  121    HA2  GLY  18           HA2      GLY  18  -3.627  -4.646   8.026
  122    HA3  GLY  18           HA3      GLY  18  -3.419  -3.473   6.729
  123    H    ALA  19           H        ALA  19  -3.978  -4.074   4.845
  124    HA   ALA  19           HA       ALA  19  -3.707  -6.868   4.002
  125    HB1  ALA  19           HB1      ALA  19  -6.126  -5.099   3.559
  126    HB2  ALA  19           HB2      ALA  19  -6.062  -6.511   4.610
  127    HB3  ALA  19           HB3      ALA  19  -5.894  -6.704   2.864
  128    H    CYS  20           H        CYS  20  -2.308  -4.240   3.720
  129    HA   CYS  20           HA       CYS  20  -2.805  -3.479   0.977
  130    HB2  CYS  20           HB2      CYS  20  -1.134  -2.300   3.179
  131    HB3  CYS  20           HB3      CYS  20  -1.324  -1.613   1.565
  132    H    ILE  21           H        ILE  21  -1.124  -3.217  -0.489
  133    HA   ILE  21           HA       ILE  21   1.027  -5.179  -0.174
  134    HB   ILE  21           HB       ILE  21   0.820  -5.599  -2.632
  135   HG12  ILE  21          HG12      ILE  21  -1.769  -4.038  -2.347
  136   HG13  ILE  21          HG13      ILE  21  -0.363  -3.544  -3.278
  137   HG21  ILE  21          HG21      ILE  21  -1.605  -6.272  -0.973
  138   HG22  ILE  21          HG22      ILE  21  -0.099  -7.186  -1.062
  139   HG23  ILE  21          HG23      ILE  21  -1.147  -7.073  -2.477
  140   HD11  ILE  21          HD11      ILE  21  -2.129  -5.920  -3.839
  141   HD12  ILE  21          HD12      ILE  21  -0.704  -5.472  -4.767
  142   HD13  ILE  21          HD13      ILE  21  -2.105  -4.400  -4.735
  143    H    CYS  22           H        CYS  22   2.638  -4.756  -2.091
  144    HA   CYS  22           HA       CYS  22   3.427  -1.950  -1.828
  145    HB2  CYS  22           HB2      CYS  22   5.014  -3.623  -0.994
  146    HB3  CYS  22           HB3      CYS  22   5.011  -4.441  -2.549
  147    H    ARG  23           H        ARG  23   2.836  -0.740  -3.543
  148    HA   ARG  23           HA       ARG  23   2.203  -1.986  -6.040
  149    HB2  ARG  23           HB2      ARG  23   2.081   0.887  -5.141
  150    HB3  ARG  23           HB3      ARG  23   1.475   0.266  -6.665
  151    HG2  ARG  23           HG2      ARG  23  -0.086  -1.182  -5.407
  152    HG3  ARG  23           HG3      ARG  23   0.480  -0.445  -3.920
  153    HD2  ARG  23           HD2      ARG  23  -0.276   1.737  -4.617
  154    HD3  ARG  23           HD3      ARG  23  -0.740   1.113  -6.196
  155    HE   ARG  23           HE       ARG  23  -2.302  -0.365  -4.788
  156   HH11  ARG  23          HH11      ARG  23  -1.467   2.981  -3.907
  157   HH12  ARG  23          HH12      ARG  23  -3.027   3.306  -3.298
  158   HH21  ARG  23          HH21      ARG  23  -4.443   0.192  -3.865
  159   HH22  ARG  23          HH22      ARG  23  -4.649   1.779  -3.227
  160    H    GLY  24           H        GLY  24   2.896  -0.729  -8.050
  161    HA2  GLY  24           HA2      GLY  24   5.717  -1.048  -8.312
  162    HA3  GLY  24           HA3      GLY  24   4.604  -0.523  -9.564
  163    H    ASN  25           H        ASN  25   4.046   1.497  -7.122
  164    HA   ASN  25           HA       ASN  25   5.749   3.558  -8.244
  165    HB2  ASN  25           HB2      ASN  25   4.399   5.120  -6.930
  166    HB3  ASN  25           HB3      ASN  25   3.341   4.027  -7.807
  167   HD21  ASN  25          HD21      ASN  25   2.612   5.558  -5.563
  168   HD22  ASN  25          HD22      ASN  25   2.189   4.488  -4.295
  169    H    GLY  26           H        GLY  26   5.665   1.387  -5.639
  170    HA2  GLY  26           HA2      GLY  26   7.677   0.898  -4.450
  171    HA3  GLY  26           HA3      GLY  26   8.150   2.584  -4.628
  172    H    TYR  27           H        TYR  27   4.897   2.071  -3.875
  173    HA   TYR  27           HA       TYR  27   5.376   2.659  -1.075
  174    HB2  TYR  27           HB2      TYR  27   3.533   3.797  -3.076
  175    HB3  TYR  27           HB3      TYR  27   3.274   4.046  -1.339
  176    HD1  TYR  27           HD2      TYR  27   5.237   5.209  -0.108
  177    HD2  TYR  27           HD1      TYR  27   4.815   5.227  -4.325
  178    HE1  TYR  27           HE2      TYR  27   6.688   7.159  -0.237
  179    HE2  TYR  27           HE1      TYR  27   6.274   7.184  -4.478
  180    HH   TYR  27           HH       TYR  27   8.150   8.261  -1.898
  181    H    CYS  28           H        CYS  28   3.734   2.003   0.244
  182    HA   CYS  28           HA       CYS  28   2.351  -0.395  -0.483
  183    HB2  CYS  28           HB2      CYS  28   2.331   1.253   2.047
  184    HB3  CYS  28           HB3      CYS  28   1.545  -0.311   1.859
  185    H    GLY  29           H        GLY  29   0.183  -0.622  -0.778
  186    HA2  GLY  29           HA2      GLY  29  -1.556   1.583  -0.289
  187    HA3  GLY  29           HA3      GLY  29  -1.339   1.157  -1.993
  188    H    GLU  30           H        GLU  30  -3.809   0.904  -0.954
  189    HA   GLU  30           HA       GLU  30  -4.291  -1.570   0.191
  190    HB2  GLU  30           HB2      GLU  30  -5.783   0.342   0.268
  191    HB3  GLU  30           HB3      GLU  30  -6.153   0.172  -1.452
  192    HG2  GLU  30           HG2      GLU  30  -7.173  -1.982  -0.960
  193    HG3  GLU  30           HG3      GLU  30  -6.717  -1.812   0.733
  194    H    ALA  31           H        ALA  31  -5.587  -3.267  -0.956
  195    HA   ALA  31           HA       ALA  31  -4.018  -4.234  -3.165
  196    HB1  ALA  31           HB1      ALA  31  -4.951  -5.792  -1.502
  197    HB2  ALA  31           HB2      ALA  31  -5.464  -6.206  -3.135
  198    HB3  ALA  31           HB3      ALA  31  -6.579  -5.387  -2.045
  199    H    ILE  32           H        ILE  32  -6.944  -2.570  -2.778
  200    HA   ILE  32           HA       ILE  32  -7.718  -2.912  -5.534
  201    HB   ILE  32           HB       ILE  32  -9.038  -1.227  -3.393
  202   HG12  ILE  32          HG12      ILE  32  -9.707  -4.080  -4.185
  203   HG13  ILE  32          HG13      ILE  32  -8.918  -3.605  -2.686
  204   HG21  ILE  32          HG21      ILE  32 -11.043  -1.451  -4.814
  205   HG22  ILE  32          HG22      ILE  32 -10.079  -2.324  -6.007
  206   HG23  ILE  32          HG23      ILE  32  -9.715  -0.636  -5.638
  207   HD11  ILE  32          HD11      ILE  32 -11.275  -4.096  -2.350
  208   HD12  ILE  32          HD12      ILE  32 -11.704  -2.863  -3.537
  209   HD13  ILE  32          HD13      ILE  32 -10.933  -2.397  -2.020
  210    H    TYR  33           H        TYR  33  -7.586  -1.120  -6.940
  211    HA   TYR  33           HA       TYR  33  -5.548   0.785  -6.181
  212    HB2  TYR  33           HB2      TYR  33  -5.610  -0.388  -8.438
  213    HB3  TYR  33           HB3      TYR  33  -6.971   0.645  -8.848
  214    HD1  TYR  33           HD2      TYR  33  -3.422   0.767  -7.758
  215    HD2  TYR  33           HD1      TYR  33  -6.579   2.772  -9.791
  216    HE1  TYR  33           HE2      TYR  33  -1.845   2.487  -8.486
  217    HE2  TYR  33           HE1      TYR  33  -5.000   4.502 -10.529
  218    HH   TYR  33           HH       TYR  33  -1.654   4.148 -10.326
  219    H    ALA  34           H        ALA  34  -8.951   0.777  -6.853
  220    HA   ALA  34           HA       ALA  34  -9.071   3.591  -6.039
  221    HB1  ALA  34           HB1      ALA  34 -11.184   1.906  -7.418
  222    HB2  ALA  34           HB2      ALA  34 -10.179   3.127  -8.197
  223    HB3  ALA  34           HB3      ALA  34 -11.359   3.604  -6.974
  224    H    ALA  35           H        ALA  35  -8.803   3.227  -3.884
  225    HA   ALA  35           HA       ALA  35  -9.951   1.203  -2.376
  226    HB1  ALA  35           HB1      ALA  35  -8.011   2.480  -1.647
  227    HB2  ALA  35           HB2      ALA  35  -9.284   2.517  -0.427
  228    HB3  ALA  35           HB3      ALA  35  -9.012   3.917  -1.463
  229    HA   PRO  36           HA       PRO  36 -14.266   2.407  -2.030
  230    HB2  PRO  36           HB2      PRO  36 -13.886   0.756   0.428
  231    HB3  PRO  36           HB3      PRO  36 -15.176   0.692  -0.783
  232    HG2  PRO  36           HG2      PRO  36 -13.285  -1.141  -0.823
  233    HG3  PRO  36           HG3      PRO  36 -13.855  -0.408  -2.331
  234    HD2  PRO  36           HD2      PRO  36 -11.315   0.113  -0.838
  235    HD3  PRO  36           HD3      PRO  36 -11.621   0.031  -2.584
  236    H    PHE  37           H        PHE  37 -11.989   2.537   0.702
  237    HA   PHE  37           HA       PHE  37 -13.229   5.070   1.347
  238    HB2  PHE  37           HB2      PHE  37 -14.160   3.381   2.935
  239    HB3  PHE  37           HB3      PHE  37 -12.526   2.982   3.439
  240    HD1  PHE  37           HD1      PHE  37 -15.169   5.504   3.520
  241    HD2  PHE  37           HD2      PHE  37 -11.297   4.443   4.922
  242    HE1  PHE  37           HE1      PHE  37 -15.291   7.281   5.204
  243    HE2  PHE  37           HE2      PHE  37 -11.415   6.223   6.602
  244    HZ   PHE  37           HZ       PHE  37 -13.408   7.641   6.750
  245    H    ALA  38           H        ALA  38 -10.763   3.125   2.906
  246    HA   ALA  38           HA       ALA  38  -8.478   3.896   1.737
  247    HB1  ALA  38           HB1      ALA  38  -9.012   6.265   2.242
  248    HB2  ALA  38           HB2      ALA  38  -7.542   5.711   3.037
  249    HB3  ALA  38           HB3      ALA  38  -9.038   5.874   3.969
  250    H    ARG  39           H        ARG  39  -8.232   1.783   2.457
  251    HA   ARG  39           HA       ARG  39  -7.785   1.358   5.267
  252    HB2  ARG  39           HB2      ARG  39  -7.362  -0.333   2.816
  253    HB3  ARG  39           HB3      ARG  39  -6.682  -0.872   4.338
  254    HG2  ARG  39           HG2      ARG  39  -8.924  -0.778   5.355
  255    HG3  ARG  39           HG3      ARG  39  -9.575  -0.293   3.791
  256    HD2  ARG  39           HD2      ARG  39  -8.060  -2.850   4.227
  257    HD3  ARG  39           HD3      ARG  39  -9.817  -2.732   4.357
  258    HE   ARG  39           HE       ARG  39  -8.924  -1.653   1.934
  259   HH11  ARG  39          HH11      ARG  39  -9.292  -4.828   3.492
  260   HH12  ARG  39          HH12      ARG  39  -9.675  -5.628   2.044
  261   HH21  ARG  39          HH21      ARG  39  -9.409  -2.757  -0.017
  262   HH22  ARG  39          HH22      ARG  39  -9.708  -4.450  -0.016
  Start of MODEL   16
    1    H1   CYS   1           H        CYS   1  -7.047   0.691   2.075
    2    HA   CYS   1           HA       CYS   1  -4.891   1.453   3.891
    3    HB2  CYS   1           HB2      CYS   1  -4.668   1.296   0.868
    4    HB3  CYS   1           HB3      CYS   1  -3.364   1.503   2.028
    5    H    GLU   2           H        GLU   2  -5.558   3.369   4.415
    6    HA   GLU   2           HA       GLU   2  -7.232   4.919   2.619
    7    HB2  GLU   2           HB2      GLU   2  -7.697   4.682   5.066
    8    HB3  GLU   2           HB3      GLU   2  -6.254   5.627   5.383
    9    HG2  GLU   2           HG2      GLU   2  -7.216   7.524   4.232
   10    HG3  GLU   2           HG3      GLU   2  -8.656   6.580   3.849
   11    H    ALA   3           H        ALA   3  -4.035   4.901   3.923
   12    HA   ALA   3           HA       ALA   3  -3.446   7.394   2.622
   13    HB1  ALA   3           HB1      ALA   3  -2.484   6.985   4.824
   14    HB2  ALA   3           HB2      ALA   3  -1.223   7.135   3.601
   15    HB3  ALA   3           HB3      ALA   3  -1.676   5.542   4.209
   16    H    ILE   4           H        ILE   4  -3.669   6.886   0.519
   17    HA   ILE   4           HA       ILE   4  -1.948   4.769  -0.563
   18    HB   ILE   4           HB       ILE   4  -4.200   6.275  -1.968
   19   HG12  ILE   4          HG12      ILE   4  -4.114   3.434  -0.924
   20   HG13  ILE   4          HG13      ILE   4  -4.969   4.763  -0.159
   21   HG21  ILE   4          HG21      ILE   4  -2.594   3.894  -2.904
   22   HG22  ILE   4          HG22      ILE   4  -2.490   5.531  -3.549
   23   HG23  ILE   4          HG23      ILE   4  -3.976   4.600  -3.743
   24   HD11  ILE   4          HD11      ILE   4  -6.436   4.936  -2.099
   25   HD12  ILE   4          HD12      ILE   4  -6.472   3.310  -1.412
   26   HD13  ILE   4          HD13      ILE   4  -5.551   3.628  -2.883
   27    H    TYR   5           H        TYR   5  -2.588   8.163  -0.639
   28    HA   TYR   5           HA       TYR   5  -0.482   8.713  -2.572
   29    HB2  TYR   5           HB2      TYR   5  -2.582  10.021  -2.524
   30    HB3  TYR   5           HB3      TYR   5  -2.236  10.505  -0.881
   31    HD1  TYR   5           HD1      TYR   5  -1.059  10.854  -4.373
   32    HD2  TYR   5           HD2      TYR   5  -0.884  12.386  -0.412
   33    HE1  TYR   5           HE1      TYR   5   0.083  12.853  -5.200
   34    HE2  TYR   5           HE2      TYR   5   0.265  14.385  -1.224
   35    HH   TYR   5           HH       TYR   5   1.673  14.989  -3.169
   36    H    ALA   6           H        ALA   6  -1.285   9.104   0.764
   37    HA   ALA   6           HA       ALA   6   1.421   9.994   1.500
   38    HB1  ALA   6           HB1      ALA   6   0.405  10.481   3.690
   39    HB2  ALA   6           HB2      ALA   6  -1.116   9.792   3.128
   40    HB3  ALA   6           HB3      ALA   6  -0.489  11.264   2.385
   41    H    ALA   7           H        ALA   7   1.005   7.432   0.568
   42    HA   ALA   7           HA       ALA   7   0.739   5.465   2.623
   43    HB1  ALA   7           HB1      ALA   7   1.756   5.303  -0.203
   44    HB2  ALA   7           HB2      ALA   7   0.099   5.019   0.326
   45    HB3  ALA   7           HB3      ALA   7   1.389   3.924   0.830
   46    HA   PRO   8           HA       PRO   8   5.095   5.325   3.643
   47    HB2  PRO   8           HB2      PRO   8   5.273   2.830   4.642
   48    HB3  PRO   8           HB3      PRO   8   4.424   4.111   5.517
   49    HG2  PRO   8           HG2      PRO   8   3.303   1.921   3.817
   50    HG3  PRO   8           HG3      PRO   8   2.730   2.518   5.383
   51    HD2  PRO   8           HD2      PRO   8   1.621   3.253   3.003
   52    HD3  PRO   8           HD3      PRO   8   1.627   4.293   4.439
   53    H    LYS   9           H        LYS   9   7.014   4.139   2.995
   54    HA   LYS   9           HA       LYS   9   6.793   3.170   0.278
   55    HB2  LYS   9           HB2      LYS   9   9.160   3.629   2.089
   56    HB3  LYS   9           HB3      LYS   9   9.289   3.004   0.453
   57    HG2  LYS   9           HG2      LYS   9   8.287   5.070  -0.401
   58    HG3  LYS   9           HG3      LYS   9   8.187   5.689   1.243
   59    HD2  LYS   9           HD2      LYS   9  10.573   5.609   1.483
   60    HD3  LYS   9           HD3      LYS   9  10.748   4.832  -0.091
   61    HE2  LYS   9           HE2      LYS   9  11.298   7.203  -0.222
   62    HE3  LYS   9           HE3      LYS   9   9.864   6.838  -1.176
   63    HZ1  LYS   9           HZ1      LYS   9   9.639   8.872   0.127
   64    HZ2  LYS   9           HZ2      LYS   9   9.810   8.001   1.562
   65    HZ3  LYS   9           HZ3      LYS   9   8.487   7.738   0.558
   66    H    CYS  10           H        CYS  10   7.317   1.191  -0.407
   67    HA   CYS  10           HA       CYS  10   7.507  -0.888   1.654
   68    HB2  CYS  10           HB2      CYS  10   6.277  -2.320   0.073
   69    HB3  CYS  10           HB3      CYS  10   5.334  -0.931   0.606
   70    H    ARG  11           H        ARG  11   8.872  -2.569   1.216
   71    HA   ARG  11           HA       ARG  11  10.566  -2.246  -1.154
   72    HB2  ARG  11           HB2      ARG  11  11.148  -3.585   1.504
   73    HB3  ARG  11           HB3      ARG  11  12.202  -3.725   0.116
   74    HG2  ARG  11           HG2      ARG  11  13.143  -2.079   1.587
   75    HG3  ARG  11           HG3      ARG  11  12.516  -1.235   0.178
   76    HD2  ARG  11           HD2      ARG  11  10.493  -0.634   1.493
   77    HD3  ARG  11           HD3      ARG  11  11.199  -1.419   2.902
   78    HE   ARG  11           HE       ARG  11  12.951   0.514   1.793
   79   HH11  ARG  11          HH11      ARG  11  10.032   0.294   3.837
   80   HH12  ARG  11          HH12      ARG  11  10.348   1.748   4.658
   81   HH21  ARG  11          HH21      ARG  11  13.341   2.528   2.957
   82   HH22  ARG  11          HH22      ARG  11  12.258   3.031   4.150
   83    H    ARG  12           H        ARG  12   8.604  -4.310   0.778
   84    HA   ARG  12           HA       ARG  12   7.922  -5.927  -1.514
   85    HB2  ARG  12           HB2      ARG  12   7.862  -7.949  -0.153
   86    HB3  ARG  12           HB3      ARG  12   9.505  -7.442  -0.491
   87    HG2  ARG  12           HG2      ARG  12   8.040  -6.906   2.099
   88    HG3  ARG  12           HG3      ARG  12   8.965  -8.373   1.821
   89    HD2  ARG  12           HD2      ARG  12  10.039  -5.566   1.748
   90    HD3  ARG  12           HD3      ARG  12  10.221  -6.700   3.087
   91    HE   ARG  12           HE       ARG  12  11.128  -7.877   0.740
   92   HH11  ARG  12          HH11      ARG  12  12.039  -5.329   3.011
   93   HH12  ARG  12          HH12      ARG  12  13.700  -5.462   2.738
   94   HH21  ARG  12          HH21      ARG  12  13.425  -8.082   0.373
   95   HH22  ARG  12          HH22      ARG  12  14.534  -7.070   1.177
   96    H    ASP  13           H        ASP  13   5.987  -7.112  -1.132
   97    HA   ASP  13           HA       ASP  13   3.953  -5.392  -0.363
   98    HB2  ASP  13           HB2      ASP  13   3.991  -8.371  -0.750
   99    HB3  ASP  13           HB3      ASP  13   2.566  -7.372  -0.618
  100    H    SER  14           H        SER  14   5.578  -7.968   1.194
  101    HA   SER  14           HA       SER  14   3.773  -8.276   3.335
  102    HB2  SER  14           HB2      SER  14   5.741  -9.485   4.350
  103    HB3  SER  14           HB3      SER  14   4.997 -10.119   2.865
  104    HG   SER  14           HG       SER  14   6.846  -9.886   1.931
  105    H    ASP  15           H        ASP  15   6.185  -5.986   2.799
  106    HA   ASP  15           HA       ASP  15   6.259  -5.428   5.672
  107    HB2  ASP  15           HB2      ASP  15   7.971  -3.768   5.395
  108    HB3  ASP  15           HB3      ASP  15   8.448  -5.208   4.521
  109    H    CYS  16           H        CYS  16   4.071  -4.819   3.500
  110    HA   CYS  16           HA       CYS  16   3.597  -2.093   4.267
  111    HB2  CYS  16           HB2      CYS  16   2.169  -4.020   2.461
  112    HB3  CYS  16           HB3      CYS  16   1.520  -2.438   2.875
  113    HA   PRO  17           HA       PRO  17   1.155  -2.824   7.841
  114    HB2  PRO  17           HB2      PRO  17  -0.816  -0.918   7.438
  115    HB3  PRO  17           HB3      PRO  17   0.773  -0.594   8.137
  116    HG2  PRO  17           HG2      PRO  17  -0.166  -0.236   5.318
  117    HG3  PRO  17           HG3      PRO  17   0.852   0.834   6.300
  118    HD2  PRO  17           HD2      PRO  17   1.935  -0.725   4.449
  119    HD3  PRO  17           HD3      PRO  17   2.738  -0.505   6.018
  120    H    GLY  18           H        GLY  18  -0.270  -4.286   8.317
  121    HA2  GLY  18           HA2      GLY  18  -2.093  -5.613   8.324
  122    HA3  GLY  18           HA3      GLY  18  -2.882  -4.428   7.293
  123    H    ALA  19           H        ALA  19  -3.233  -4.933   5.265
  124    HA   ALA  19           HA       ALA  19  -1.777  -7.191   4.132
  125    HB1  ALA  19           HB1      ALA  19  -4.756  -6.736   3.926
  126    HB2  ALA  19           HB2      ALA  19  -3.961  -7.985   4.883
  127    HB3  ALA  19           HB3      ALA  19  -3.848  -8.017   3.122
  128    H    CYS  20           H        CYS  20  -1.836  -4.065   3.899
  129    HA   CYS  20           HA       CYS  20  -2.663  -3.469   1.283
  130    HB2  CYS  20           HB2      CYS  20  -0.487  -2.246   2.989
  131    HB3  CYS  20           HB3      CYS  20  -1.041  -1.579   1.471
  132    H    ILE  21           H        ILE  21  -1.359  -3.270  -0.598
  133    HA   ILE  21           HA       ILE  21   0.854  -5.206  -0.599
  134    HB   ILE  21           HB       ILE  21   0.552  -5.463  -3.010
  135   HG12  ILE  21          HG12      ILE  21  -1.831  -3.603  -2.754
  136   HG13  ILE  21          HG13      ILE  21  -0.285  -3.151  -3.458
  137   HG21  ILE  21          HG21      ILE  21  -0.683  -6.941  -1.562
  138   HG22  ILE  21          HG22      ILE  21  -1.638  -6.588  -3.003
  139   HG23  ILE  21          HG23      ILE  21  -2.015  -5.796  -1.470
  140   HD11  ILE  21          HD11      ILE  21  -1.925  -3.657  -5.178
  141   HD12  ILE  21          HD12      ILE  21  -2.152  -5.272  -4.506
  142   HD13  ILE  21          HD13      ILE  21  -0.601  -4.820  -5.216
  143    H    CYS  22           H        CYS  22   2.488  -4.711  -2.377
  144    HA   CYS  22           HA       CYS  22   3.359  -1.950  -1.966
  145    HB2  CYS  22           HB2      CYS  22   4.896  -3.763  -1.293
  146    HB3  CYS  22           HB3      CYS  22   4.857  -4.416  -2.923
  147    H    ARG  23           H        ARG  23   3.153  -0.547  -3.658
  148    HA   ARG  23           HA       ARG  23   2.194  -1.619  -6.146
  149    HB2  ARG  23           HB2      ARG  23   2.625   1.271  -5.453
  150    HB3  ARG  23           HB3      ARG  23   1.544   0.577  -6.646
  151    HG2  ARG  23           HG2      ARG  23   0.297  -0.466  -4.729
  152    HG3  ARG  23           HG3      ARG  23   1.270   0.539  -3.663
  153    HD2  ARG  23           HD2      ARG  23  -0.759   1.390  -5.703
  154    HD3  ARG  23           HD3      ARG  23  -0.735   1.734  -3.982
  155    HE   ARG  23           HE       ARG  23   0.956   2.938  -6.029
  156   HH11  ARG  23          HH11      ARG  23   0.047   3.048  -2.603
  157   HH12  ARG  23          HH12      ARG  23   0.045   4.746  -2.540
  158   HH21  ARG  23          HH21      ARG  23   0.973   5.299  -5.859
  159   HH22  ARG  23          HH22      ARG  23   0.588   6.047  -4.381
  160    H    GLY  24           H        GLY  24   3.066  -0.508  -8.155
  161    HA2  GLY  24           HA2      GLY  24   5.803  -1.198  -8.447
  162    HA3  GLY  24           HA3      GLY  24   4.798  -0.434  -9.663
  163    H    ASN  25           H        ASN  25   4.458   1.622  -7.293
  164    HA   ASN  25           HA       ASN  25   6.620   3.327  -8.188
  165    HB2  ASN  25           HB2      ASN  25   5.480   5.126  -7.036
  166    HB3  ASN  25           HB3      ASN  25   4.317   4.216  -7.985
  167   HD21  ASN  25          HD21      ASN  25   3.818   5.963  -5.781
  168   HD22  ASN  25          HD22      ASN  25   3.036   5.021  -4.575
  169    H    GLY  26           H        GLY  26   5.779   1.384  -5.462
  170    HA2  GLY  26           HA2      GLY  26   7.553   0.634  -4.036
  171    HA3  GLY  26           HA3      GLY  26   8.310   2.214  -4.212
  172    H    TYR  27           H        TYR  27   4.932   2.177  -3.820
  173    HA   TYR  27           HA       TYR  27   5.153   2.746  -0.971
  174    HB2  TYR  27           HB2      TYR  27   3.672   4.055  -3.179
  175    HB3  TYR  27           HB3      TYR  27   3.119   4.257  -1.508
  176    HD1  TYR  27           HD1      TYR  27   5.715   5.095  -3.991
  177    HD2  TYR  27           HD2      TYR  27   4.436   5.653   0.020
  178    HE1  TYR  27           HE1      TYR  27   7.290   6.963  -3.749
  179    HE2  TYR  27           HE2      TYR  27   5.987   7.509   0.269
  180    HH   TYR  27           HH       TYR  27   7.454   9.024  -2.291
  181    H    CYS  28           H        CYS  28   3.234   2.165   0.189
  182    HA   CYS  28           HA       CYS  28   2.096  -0.283  -0.787
  183    HB2  CYS  28           HB2      CYS  28   1.563   1.230   1.768
  184    HB3  CYS  28           HB3      CYS  28   1.061  -0.422   1.422
  185    H    GLY  29           H        GLY  29  -0.139  -0.738  -1.020
  186    HA2  GLY  29           HA2      GLY  29  -2.083   1.414  -0.913
  187    HA3  GLY  29           HA3      GLY  29  -1.732   0.833  -2.534
  188    H    GLU  30           H        GLU  30  -4.226   0.480  -2.073
  189    HA   GLU  30           HA       GLU  30  -5.061  -1.611  -0.455
  190    HB2  GLU  30           HB2      GLU  30  -6.649   0.013  -1.246
  191    HB3  GLU  30           HB3      GLU  30  -6.277  -0.384  -2.922
  192    HG2  GLU  30           HG2      GLU  30  -8.481  -1.194  -2.292
  193    HG3  GLU  30           HG3      GLU  30  -7.405  -2.529  -2.664
  194    H    ALA  31           H        ALA  31  -5.805  -3.636  -1.085
  195    HA   ALA  31           HA       ALA  31  -3.745  -5.071  -2.489
  196    HB1  ALA  31           HB1      ALA  31  -4.928  -7.089  -1.791
  197    HB2  ALA  31           HB2      ALA  31  -6.311  -6.114  -1.304
  198    HB3  ALA  31           HB3      ALA  31  -4.780  -5.963  -0.440
  199    H    ILE  32           H        ILE  32  -7.205  -4.683  -2.936
  200    HA   ILE  32           HA       ILE  32  -6.830  -4.946  -5.815
  201    HB   ILE  32           HB       ILE  32  -9.137  -6.242  -4.373
  202   HG12  ILE  32          HG12      ILE  32  -6.748  -7.681  -5.576
  203   HG13  ILE  32          HG13      ILE  32  -7.046  -7.498  -3.855
  204   HG21  ILE  32          HG21      ILE  32  -9.644  -5.558  -6.637
  205   HG22  ILE  32          HG22      ILE  32  -9.598  -7.319  -6.554
  206   HG23  ILE  32          HG23      ILE  32  -8.240  -6.435  -7.248
  207   HD11  ILE  32          HD11      ILE  32  -9.077  -8.846  -4.072
  208   HD12  ILE  32          HD12      ILE  32  -7.649  -9.720  -4.623
  209   HD13  ILE  32          HD13      ILE  32  -8.766  -9.026  -5.798
  210    H    TYR  33           H        TYR  33  -7.951  -3.400  -6.749
  211    HA   TYR  33           HA       TYR  33  -9.356  -1.559  -5.035
  212    HB2  TYR  33           HB2      TYR  33  -8.266  -1.311  -7.812
  213    HB3  TYR  33           HB3      TYR  33  -9.316  -0.093  -7.106
  214    HD1  TYR  33           HD1      TYR  33  -6.039  -1.756  -6.835
  215    HD2  TYR  33           HD2      TYR  33  -8.479   1.444  -5.469
  216    HE1  TYR  33           HE1      TYR  33  -4.097  -0.734  -5.787
  217    HE2  TYR  33           HE2      TYR  33  -6.534   2.486  -4.408
  218    HH   TYR  33           HH       TYR  33  -3.382   1.533  -5.088
  219    H    ALA  34           H        ALA  34 -11.164  -2.642  -4.703
  220    HA   ALA  34           HA       ALA  34 -13.209  -2.113  -6.629
  221    HB1  ALA  34           HB1      ALA  34 -12.759  -4.946  -5.624
  222    HB2  ALA  34           HB2      ALA  34 -12.566  -4.397  -7.287
  223    HB3  ALA  34           HB3      ALA  34 -14.164  -4.397  -6.543
  224    H    ALA  35           H        ALA  35 -13.585  -4.444  -4.090
  225    HA   ALA  35           HA       ALA  35 -15.100  -2.593  -2.487
  226    HB1  ALA  35           HB1      ALA  35 -15.779  -4.951  -2.634
  227    HB2  ALA  35           HB2      ALA  35 -15.353  -4.534  -0.973
  228    HB3  ALA  35           HB3      ALA  35 -14.222  -5.448  -1.971
  229    HA   PRO  36           HA       PRO  36 -11.458  -1.508  -0.056
  230    HB2  PRO  36           HB2      PRO  36 -13.200  -1.300   2.319
  231    HB3  PRO  36           HB3      PRO  36 -12.242  -0.043   1.530
  232    HG2  PRO  36           HG2      PRO  36 -14.932  -0.062   1.387
  233    HG3  PRO  36           HG3      PRO  36 -13.918   0.510   0.052
  234    HD2  PRO  36           HD2      PRO  36 -15.320  -2.114   0.377
  235    HD3  PRO  36           HD3      PRO  36 -15.138  -1.099  -1.072
  236    H    PHE  37           H        PHE  37 -10.180  -3.190   0.419
  237    HA   PHE  37           HA       PHE  37 -11.353  -5.443   1.882
  238    HB2  PHE  37           HB2      PHE  37 -10.825  -6.106  -0.365
  239    HB3  PHE  37           HB3      PHE  37  -9.214  -5.415  -0.248
  240    HD1  PHE  37           HD1      PHE  37 -11.372  -8.071   1.190
  241    HD2  PHE  37           HD2      PHE  37  -7.424  -6.758   0.367
  242    HE1  PHE  37           HE1      PHE  37 -10.495 -10.267   1.894
  243    HE2  PHE  37           HE2      PHE  37  -6.539  -8.939   1.065
  244    HZ   PHE  37           HZ       PHE  37  -8.081 -10.699   1.833
  245    H    ALA  38           H        ALA  38  -8.143  -4.159   1.214
  246    HA   ALA  38           HA       ALA  38  -7.354  -4.883   3.945
  247    HB1  ALA  38           HB1      ALA  38  -5.780  -4.471   1.406
  248    HB2  ALA  38           HB2      ALA  38  -6.110  -6.016   2.192
  249    HB3  ALA  38           HB3      ALA  38  -5.076  -4.820   2.981
  250    H    ARG  39           H        ARG  39  -8.886  -2.690   3.480
  251    HA   ARG  39           HA       ARG  39  -8.439  -0.419   2.477
  252    HB2  ARG  39           HB2      ARG  39  -8.944  -0.604   5.361
  253    HB3  ARG  39           HB3      ARG  39  -9.182   0.822   4.394
  254    HG2  ARG  39           HG2      ARG  39 -10.853  -0.276   3.033
  255    HG3  ARG  39           HG3      ARG  39 -10.676  -1.761   3.966
  256    HD2  ARG  39           HD2      ARG  39 -12.641  -0.465   4.680
  257    HD3  ARG  39           HD3      ARG  39 -11.451  -0.597   5.975
  258    HE   ARG  39           HE       ARG  39 -11.002   1.773   4.527
  259   HH11  ARG  39          HH11      ARG  39 -13.427   0.442   6.760
  260   HH12  ARG  39          HH12      ARG  39 -13.816   1.949   7.415
  261   HH21  ARG  39          HH21      ARG  39 -11.553   3.803   5.449
  262   HH22  ARG  39          HH22      ARG  39 -12.767   3.906   6.651
  Start of MODEL   17
    1    H1   CYS   1           H        CYS   1  -4.464   3.508   0.548
    2    HA   CYS   1           HA       CYS   1  -4.098   2.452   3.107
    3    HB2  CYS   1           HB2      CYS   1  -3.448   0.436   1.664
    4    HB3  CYS   1           HB3      CYS   1  -2.243   1.468   0.902
    5    H    GLU   2           H        GLU   2  -3.736   4.542   3.613
    6    HA   GLU   2           HA       GLU   2  -1.891   5.998   1.892
    7    HB2  GLU   2           HB2      GLU   2  -4.102   6.199   0.965
    8    HB3  GLU   2           HB3      GLU   2  -4.737   6.755   2.498
    9    HG2  GLU   2           HG2      GLU   2  -3.529   8.818   2.277
   10    HG3  GLU   2           HG3      GLU   2  -2.702   8.221   0.835
   11    H    ALA   3           H        ALA   3  -1.113   7.851   2.762
   12    HA   ALA   3           HA       ALA   3  -1.806   8.884   5.282
   13    HB1  ALA   3           HB1      ALA   3   0.885   7.535   4.889
   14    HB2  ALA   3           HB2      ALA   3  -0.348   7.062   6.057
   15    HB3  ALA   3           HB3      ALA   3   0.486   8.607   6.229
   16    H    ILE   4           H        ILE   4  -1.276  10.995   5.159
   17    HA   ILE   4           HA       ILE   4  -0.130  11.791   2.597
   18    HB   ILE   4           HB       ILE   4  -1.770  13.444   4.550
   19   HG12  ILE   4          HG12      ILE   4  -3.093  11.651   3.526
   20   HG13  ILE   4          HG13      ILE   4  -3.602  13.225   2.934
   21   HG21  ILE   4          HG21      ILE   4  -0.294  14.849   3.203
   22   HG22  ILE   4          HG22      ILE   4  -1.981  15.078   2.736
   23   HG23  ILE   4          HG23      ILE   4  -0.912  14.100   1.732
   24   HD11  ILE   4          HD11      ILE   4  -3.564  11.599   1.138
   25   HD12  ILE   4          HD12      ILE   4  -1.872  11.237   1.475
   26   HD13  ILE   4          HD13      ILE   4  -2.326  12.831   0.869
   27    H    TYR   5           H        TYR   5   0.650  11.801   5.924
   28    HA   TYR   5           HA       TYR   5   2.505  14.014   5.611
   29    HB2  TYR   5           HB2      TYR   5   1.140  13.448   7.739
   30    HB3  TYR   5           HB3      TYR   5   2.323  12.178   7.990
   31    HD1  TYR   5           HD1      TYR   5   1.787  15.786   7.901
   32    HD2  TYR   5           HD2      TYR   5   4.586  12.693   8.707
   33    HE1  TYR   5           HE1      TYR   5   3.232  17.404   9.003
   34    HE2  TYR   5           HE2      TYR   5   6.050  14.305   9.820
   35    HH   TYR   5           HH       TYR   5   5.041  17.311  10.788
   36    H    ALA   6           H        ALA   6   2.552  10.542   6.091
   37    HA   ALA   6           HA       ALA   6   5.078  10.369   4.686
   38    HB1  ALA   6           HB1      ALA   6   4.753   9.207   7.464
   39    HB2  ALA   6           HB2      ALA   6   5.784  10.573   7.039
   40    HB3  ALA   6           HB3      ALA   6   6.143   8.966   6.403
   41    H    ALA   7           H        ALA   7   4.340   9.118   3.088
   42    HA   ALA   7           HA       ALA   7   2.330   7.131   3.580
   43    HB1  ALA   7           HB1      ALA   7   3.830   7.778   1.037
   44    HB2  ALA   7           HB2      ALA   7   2.285   8.477   1.524
   45    HB3  ALA   7           HB3      ALA   7   2.401   6.754   1.165
   46    HA   PRO   8           HA       PRO   8   5.091   3.813   4.521
   47    HB2  PRO   8           HB2      PRO   8   3.464   1.749   3.646
   48    HB3  PRO   8           HB3      PRO   8   3.355   2.501   5.236
   49    HG2  PRO   8           HG2      PRO   8   1.715   2.997   2.789
   50    HG3  PRO   8           HG3      PRO   8   1.209   2.952   4.486
   51    HD2  PRO   8           HD2      PRO   8   1.530   5.255   3.158
   52    HD3  PRO   8           HD3      PRO   8   1.930   5.112   4.882
   53    H    LYS   9           H        LYS   9   6.797   3.389   3.331
   54    HA   LYS   9           HA       LYS   9   6.630   3.003   0.438
   55    HB2  LYS   9           HB2      LYS   9   8.995   3.144   2.331
   56    HB3  LYS   9           HB3      LYS   9   9.104   3.002   0.588
   57    HG2  LYS   9           HG2      LYS   9   8.064   5.209   0.342
   58    HG3  LYS   9           HG3      LYS   9   7.938   5.336   2.097
   59    HD2  LYS   9           HD2      LYS   9  10.345   5.248   2.324
   60    HD3  LYS   9           HD3      LYS   9  10.532   4.980   0.594
   61    HE2  LYS   9           HE2      LYS   9   9.326   7.455   1.833
   62    HE3  LYS   9           HE3      LYS   9  11.001   7.318   1.313
   63    HZ1  LYS   9           HZ1      LYS   9   9.739   8.397  -0.377
   64    HZ2  LYS   9           HZ2      LYS   9   8.583   7.210  -0.436
   65    HZ3  LYS   9           HZ3      LYS   9  10.150   6.883  -0.967
   66    H    CYS  10           H        CYS  10   7.661   1.096  -0.504
   67    HA   CYS  10           HA       CYS  10   7.877  -1.143   1.361
   68    HB2  CYS  10           HB2      CYS  10   6.610  -2.563  -0.186
   69    HB3  CYS  10           HB3      CYS  10   5.636  -1.244   0.453
   70    H    ARG  11           H        ARG  11   9.425  -2.562   0.895
   71    HA   ARG  11           HA       ARG  11  10.865  -2.297  -1.648
   72    HB2  ARG  11           HB2      ARG  11  11.665  -3.577   0.980
   73    HB3  ARG  11           HB3      ARG  11  12.663  -3.563  -0.466
   74    HG2  ARG  11           HG2      ARG  11  12.710  -1.110  -0.376
   75    HG3  ARG  11           HG3      ARG  11  11.742  -1.166   1.090
   76    HD2  ARG  11           HD2      ARG  11  13.525  -2.424   2.206
   77    HD3  ARG  11           HD3      ARG  11  14.492  -2.339   0.734
   78    HE   ARG  11           HE       ARG  11  13.816   0.222   1.249
   79   HH11  ARG  11          HH11      ARG  11  15.501  -2.262   3.136
   80   HH12  ARG  11          HH12      ARG  11  16.465  -1.162   3.980
   81   HH21  ARG  11          HH21      ARG  11  15.123   1.740   2.425
   82   HH22  ARG  11          HH22      ARG  11  16.270   1.178   3.556
   83    H    ARG  12           H        ARG  12   9.155  -4.293   0.561
   84    HA   ARG  12           HA       ARG  12   8.444  -6.138  -1.542
   85    HB2  ARG  12           HB2      ARG  12   8.459  -7.972   0.095
   86    HB3  ARG  12           HB3      ARG  12  10.083  -7.513  -0.421
   87    HG2  ARG  12           HG2      ARG  12   8.714  -6.749   2.164
   88    HG3  ARG  12           HG3      ARG  12   9.755  -8.147   1.991
   89    HD2  ARG  12           HD2      ARG  12  10.534  -5.260   1.657
   90    HD3  ARG  12           HD3      ARG  12  10.903  -6.296   3.032
   91    HE   ARG  12           HE       ARG  12  11.835  -7.366   0.590
   92   HH11  ARG  12          HH11      ARG  12  12.560  -5.065   3.172
   93   HH12  ARG  12          HH12      ARG  12  14.229  -5.030   2.926
   94   HH21  ARG  12          HH21      ARG  12  14.192  -7.369   0.233
   95   HH22  ARG  12          HH22      ARG  12  15.194  -6.404   1.206
   96    H    ASP  13           H        ASP  13   6.576  -7.347  -0.956
   97    HA   ASP  13           HA       ASP  13   4.532  -5.604  -0.243
   98    HB2  ASP  13           HB2      ASP  13   4.747  -8.520  -0.727
   99    HB3  ASP  13           HB3      ASP  13   3.246  -7.800  -0.189
  100    H    SER  14           H        SER  14   6.373  -7.881   1.563
  101    HA   SER  14           HA       SER  14   4.573  -8.071   3.729
  102    HB2  SER  14           HB2      SER  14   6.660  -8.897   4.925
  103    HB3  SER  14           HB3      SER  14   6.033  -9.833   3.543
  104    HG   SER  14           HG       SER  14   8.428  -8.975   3.873
  105    H    ASP  15           H        ASP  15   6.726  -5.672   2.801
  106    HA   ASP  15           HA       ASP  15   7.165  -4.381   5.358
  107    HB2  ASP  15           HB2      ASP  15   7.009  -3.093   2.621
  108    HB3  ASP  15           HB3      ASP  15   7.420  -2.226   4.086
  109    H    CYS  16           H        CYS  16   4.473  -4.672   3.305
  110    HA   CYS  16           HA       CYS  16   3.200  -2.281   4.243
  111    HB2  CYS  16           HB2      CYS  16   2.349  -4.395   2.285
  112    HB3  CYS  16           HB3      CYS  16   1.539  -2.856   2.569
  113    HA   PRO  17           HA       PRO  17   1.054  -4.713   7.351
  114    HB2  PRO  17           HB2      PRO  17  -0.082  -2.679   8.632
  115    HB3  PRO  17           HB3      PRO  17   1.666  -2.935   8.720
  116    HG2  PRO  17           HG2      PRO  17   0.112  -0.995   7.055
  117    HG3  PRO  17           HG3      PRO  17   1.614  -0.734   7.957
  118    HD2  PRO  17           HD2      PRO  17   1.491  -1.228   5.253
  119    HD3  PRO  17           HD3      PRO  17   2.905  -1.572   6.270
  120    H    GLY  18           H        GLY  18  -1.288  -4.577   8.243
  121    HA2  GLY  18           HA2      GLY  18  -3.530  -4.802   7.894
  122    HA3  GLY  18           HA3      GLY  18  -3.372  -3.446   6.784
  123    H    ALA  19           H        ALA  19  -4.255  -3.915   4.958
  124    HA   ALA  19           HA       ALA  19  -3.803  -6.569   3.775
  125    HB1  ALA  19           HB1      ALA  19  -5.793  -6.109   2.411
  126    HB2  ALA  19           HB2      ALA  19  -5.981  -4.552   3.215
  127    HB3  ALA  19           HB3      ALA  19  -6.165  -6.044   4.132
  128    H    CYS  20           H        CYS  20  -2.328  -3.816   3.838
  129    HA   CYS  20           HA       CYS  20  -2.450  -2.823   1.194
  130    HB2  CYS  20           HB2      CYS  20  -0.316  -2.467   3.279
  131    HB3  CYS  20           HB3      CYS  20  -0.610  -1.445   1.873
  132    H    ILE  21           H        ILE  21  -0.981  -3.083  -0.417
  133    HA   ILE  21           HA       ILE  21   1.079  -5.146  -0.090
  134    HB   ILE  21           HB       ILE  21   0.704  -5.764  -2.485
  135   HG12  ILE  21          HG12      ILE  21  -1.813  -4.118  -2.159
  136   HG13  ILE  21          HG13      ILE  21  -0.449  -3.733  -3.200
  137   HG21  ILE  21          HG21      ILE  21  -1.274  -7.164  -2.086
  138   HG22  ILE  21          HG22      ILE  21  -1.618  -6.233  -0.629
  139   HG23  ILE  21          HG23      ILE  21  -0.143  -7.194  -0.733
  140   HD11  ILE  21          HD11      ILE  21  -0.871  -5.716  -4.499
  141   HD12  ILE  21          HD12      ILE  21  -2.293  -4.663  -4.465
  142   HD13  ILE  21          HD13      ILE  21  -2.237  -6.125  -3.470
  143    H    CYS  22           H        CYS  22   2.623  -4.943  -2.070
  144    HA   CYS  22           HA       CYS  22   3.510  -2.180  -1.942
  145    HB2  CYS  22           HB2      CYS  22   5.097  -3.964  -1.365
  146    HB3  CYS  22           HB3      CYS  22   4.931  -4.660  -2.968
  147    H    ARG  23           H        ARG  23   2.939  -0.840  -3.492
  148    HA   ARG  23           HA       ARG  23   1.992  -1.811  -6.031
  149    HB2  ARG  23           HB2      ARG  23   2.230   0.957  -4.862
  150    HB3  ARG  23           HB3      ARG  23   1.421   0.538  -6.359
  151    HG2  ARG  23           HG2      ARG  23   0.601  -0.712  -3.782
  152    HG3  ARG  23           HG3      ARG  23  -0.015   0.859  -4.277
  153    HD2  ARG  23           HD2      ARG  23  -0.198  -1.666  -5.932
  154    HD3  ARG  23           HD3      ARG  23  -1.498  -1.055  -4.907
  155    HE   ARG  23           HE       ARG  23  -0.735   1.014  -6.576
  156   HH11  ARG  23          HH11      ARG  23  -2.124  -2.196  -7.051
  157   HH12  ARG  23          HH12      ARG  23  -3.114  -1.692  -8.354
  158   HH21  ARG  23          HH21      ARG  23  -2.030   1.632  -8.376
  159   HH22  ARG  23          HH22      ARG  23  -3.029   0.494  -9.169
  160    H    GLY  24           H        GLY  24   2.739  -0.460  -7.963
  161    HA2  GLY  24           HA2      GLY  24   5.531  -1.026  -8.334
  162    HA3  GLY  24           HA3      GLY  24   4.430  -0.366  -9.530
  163    H    ASN  25           H        ASN  25   4.048   1.580  -7.044
  164    HA   ASN  25           HA       ASN  25   5.971   3.510  -8.008
  165    HB2  ASN  25           HB2      ASN  25   4.767   5.102  -6.442
  166    HB3  ASN  25           HB3      ASN  25   3.797   4.437  -7.748
  167   HD21  ASN  25          HD21      ASN  25   1.905   4.835  -6.648
  168   HD22  ASN  25          HD22      ASN  25   1.407   3.919  -5.269
  169    H    GLY  26           H        GLY  26   5.675   1.294  -5.434
  170    HA2  GLY  26           HA2      GLY  26   7.594   0.729  -4.131
  171    HA3  GLY  26           HA3      GLY  26   8.167   2.386  -4.323
  172    H    TYR  27           H        TYR  27   4.887   2.036  -3.705
  173    HA   TYR  27           HA       TYR  27   5.198   2.593  -0.872
  174    HB2  TYR  27           HB2      TYR  27   3.560   3.837  -2.992
  175    HB3  TYR  27           HB3      TYR  27   3.022   3.940  -1.305
  176    HD1  TYR  27           HD1      TYR  27   4.682   4.991   0.329
  177    HD2  TYR  27           HD2      TYR  27   5.054   5.391  -3.880
  178    HE1  TYR  27           HE1      TYR  27   6.106   6.941   0.658
  179    HE2  TYR  27           HE2      TYR  27   6.498   7.349  -3.571
  180    HH   TYR  27           HH       TYR  27   6.915   9.078  -1.804
  181    H    CYS  28           H        CYS  28   3.479   1.906   0.366
  182    HA   CYS  28           HA       CYS  28   2.260  -0.526  -0.532
  183    HB2  CYS  28           HB2      CYS  28   2.007   0.993   2.063
  184    HB3  CYS  28           HB3      CYS  28   1.354  -0.613   1.758
  185    H    GLY  29           H        GLY  29   0.334  -0.712  -1.376
  186    HA2  GLY  29           HA2      GLY  29  -1.602   1.486  -1.037
  187    HA3  GLY  29           HA3      GLY  29  -1.330   0.715  -2.595
  188    H    GLU  30           H        GLU  30  -3.802   0.535  -1.995
  189    HA   GLU  30           HA       GLU  30  -4.570  -1.477  -0.230
  190    HB2  GLU  30           HB2      GLU  30  -6.106   0.205  -0.914
  191    HB3  GLU  30           HB3      GLU  30  -5.971  -0.258  -2.610
  192    HG2  GLU  30           HG2      GLU  30  -8.074  -1.014  -1.773
  193    HG3  GLU  30           HG3      GLU  30  -7.044  -2.410  -1.998
  194    H    ALA  31           H        ALA  31  -5.537  -3.515  -0.865
  195    HA   ALA  31           HA       ALA  31  -3.742  -4.951  -2.622
  196    HB1  ALA  31           HB1      ALA  31  -6.039  -5.993  -0.984
  197    HB2  ALA  31           HB2      ALA  31  -4.360  -5.890  -0.454
  198    HB3  ALA  31           HB3      ALA  31  -4.802  -6.962  -1.786
  199    H    ILE  32           H        ILE  32  -7.208  -4.463  -2.375
  200    HA   ILE  32           HA       ILE  32  -7.484  -5.541  -5.079
  201    HB   ILE  32           HB       ILE  32  -9.447  -5.632  -2.778
  202   HG12  ILE  32          HG12      ILE  32  -7.641  -7.182  -2.392
  203   HG13  ILE  32          HG13      ILE  32  -9.091  -8.082  -2.816
  204   HG21  ILE  32          HG21      ILE  32 -10.663  -5.487  -4.865
  205   HG22  ILE  32          HG22      ILE  32 -10.861  -7.074  -4.124
  206   HG23  ILE  32          HG23      ILE  32  -9.764  -6.873  -5.488
  207   HD11  ILE  32          HD11      ILE  32  -8.229  -8.372  -5.091
  208   HD12  ILE  32          HD12      ILE  32  -7.130  -9.026  -3.875
  209   HD13  ILE  32          HD13      ILE  32  -6.770  -7.486  -4.642
  210    H    TYR  33           H        TYR  33  -9.027  -4.471  -6.413
  211    HA   TYR  33           HA       TYR  33  -9.375  -1.697  -5.766
  212    HB2  TYR  33           HB2      TYR  33 -10.067  -3.306  -8.233
  213    HB3  TYR  33           HB3      TYR  33 -10.344  -1.578  -8.068
  214    HD1  TYR  33           HD1      TYR  33  -8.376  -0.031  -7.849
  215    HD2  TYR  33           HD2      TYR  33  -7.898  -4.159  -8.753
  216    HE1  TYR  33           HE1      TYR  33  -6.084   0.403  -8.614
  217    HE2  TYR  33           HE2      TYR  33  -5.619  -3.746  -9.510
  218    HH   TYR  33           HH       TYR  33  -4.292  -1.857 -10.382
  219    H    ALA  34           H        ALA  34 -11.241  -0.735  -5.310
  220    HA   ALA  34           HA       ALA  34 -13.314  -0.416  -4.486
  221    HB1  ALA  34           HB1      ALA  34 -14.160  -1.411  -6.602
  222    HB2  ALA  34           HB2      ALA  34 -15.201  -1.810  -5.236
  223    HB3  ALA  34           HB3      ALA  34 -14.076  -3.011  -5.867
  224    H    ALA  35           H        ALA  35 -11.242  -1.952  -3.174
  225    HA   ALA  35           HA       ALA  35 -12.414  -3.968  -1.524
  226    HB1  ALA  35           HB1      ALA  35  -9.883  -2.384  -1.090
  227    HB2  ALA  35           HB2      ALA  35 -10.008  -3.800  -2.113
  228    HB3  ALA  35           HB3      ALA  35 -10.267  -3.954  -0.377
  229    HA   PRO  36           HA       PRO  36 -14.329  -2.049   2.033
  230    HB2  PRO  36           HB2      PRO  36 -11.865  -2.686   3.600
  231    HB3  PRO  36           HB3      PRO  36 -13.563  -2.880   4.054
  232    HG2  PRO  36           HG2      PRO  36 -12.166  -4.972   3.228
  233    HG3  PRO  36           HG3      PRO  36 -13.845  -4.759   2.712
  234    HD2  PRO  36           HD2      PRO  36 -11.338  -4.418   1.188
  235    HD3  PRO  36           HD3      PRO  36 -12.952  -4.868   0.607
  236    H    PHE  37           H        PHE  37 -10.865  -1.237   2.155
  237    HA   PHE  37           HA       PHE  37 -11.691   1.415   3.018
  238    HB2  PHE  37           HB2      PHE  37  -9.969   0.230   4.379
  239    HB3  PHE  37           HB3      PHE  37  -8.895   0.251   2.986
  240    HD1  PHE  37           HD1      PHE  37 -11.071   2.825   4.613
  241    HD2  PHE  37           HD2      PHE  37  -7.170   1.724   3.327
  242    HE1  PHE  37           HE1      PHE  37 -10.218   5.014   5.335
  243    HE2  PHE  37           HE2      PHE  37  -6.317   3.912   4.041
  244    HZ   PHE  37           HZ       PHE  37  -7.836   5.560   5.045
  245    H    ALA  38           H        ALA  38  -9.833  -0.227   0.534
  246    HA   ALA  38           HA       ALA  38  -9.540   0.167  -1.615
  247    HB1  ALA  38           HB1      ALA  38 -11.847   1.015  -1.756
  248    HB2  ALA  38           HB2      ALA  38 -10.776   1.901  -2.846
  249    HB3  ALA  38           HB3      ALA  38 -11.276   2.624  -1.318
  250    H    ARG  39           H        ARG  39  -8.103   1.366   0.593
  251    HA   ARG  39           HA       ARG  39  -6.248   2.998  -0.907
  252    HB2  ARG  39           HB2      ARG  39  -7.676   3.874   1.581
  253    HB3  ARG  39           HB3      ARG  39  -6.197   4.578   0.986
  254    HG2  ARG  39           HG2      ARG  39  -8.766   4.514  -0.580
  255    HG3  ARG  39           HG3      ARG  39  -8.364   5.811   0.542
  256    HD2  ARG  39           HD2      ARG  39  -6.426   6.395  -0.807
  257    HD3  ARG  39           HD3      ARG  39  -6.751   5.037  -1.892
  258    HE   ARG  39           HE       ARG  39  -9.032   6.253  -2.074
  259   HH11  ARG  39          HH11      ARG  39  -5.934   8.009  -1.884
  260   HH12  ARG  39          HH12      ARG  39  -6.384   9.137  -3.071
  261   HH21  ARG  39          HH21      ARG  39  -9.639   7.911  -3.609
  262   HH22  ARG  39          HH22      ARG  39  -8.527   9.124  -4.030
  Start of MODEL   18
    1    H1   CYS   1           H        CYS   1  -4.581   2.217   1.746
    2    HA   CYS   1           HA       CYS   1  -5.359   2.660   4.564
    3    HB2  CYS   1           HB2      CYS   1  -4.491   0.398   5.021
    4    HB3  CYS   1           HB3      CYS   1  -5.764   0.353   3.808
    5    H    GLU   2           H        GLU   2  -3.444   3.960   2.703
    6    HA   GLU   2           HA       GLU   2  -0.845   3.338   3.894
    7    HB2  GLU   2           HB2      GLU   2   0.051   4.637   2.002
    8    HB3  GLU   2           HB3      GLU   2  -0.949   3.290   1.477
    9    HG2  GLU   2           HG2      GLU   2  -2.838   5.135   1.479
   10    HG3  GLU   2           HG3      GLU   2  -1.461   6.211   1.326
   11    H    ALA   3           H        ALA   3   0.552   5.186   4.443
   12    HA   ALA   3           HA       ALA   3  -0.889   7.216   5.790
   13    HB1  ALA   3           HB1      ALA   3   1.362   7.709   6.737
   14    HB2  ALA   3           HB2      ALA   3   2.027   6.426   5.734
   15    HB3  ALA   3           HB3      ALA   3   0.865   6.040   7.001
   16    H    ILE   4           H        ILE   4  -1.115   8.940   4.884
   17    HA   ILE   4           HA       ILE   4  -0.028   9.448   2.224
   18    HB   ILE   4           HB       ILE   4  -2.155  11.037   3.688
   19   HG12  ILE   4          HG12      ILE   4  -2.447   8.869   1.597
   20   HG13  ILE   4          HG13      ILE   4  -2.749   8.662   3.318
   21   HG21  ILE   4          HG21      ILE   4  -2.755  11.890   1.464
   22   HG22  ILE   4          HG22      ILE   4  -1.422  10.989   0.751
   23   HG23  ILE   4          HG23      ILE   4  -1.090  12.314   1.867
   24   HD11  ILE   4          HD11      ILE   4  -4.241  10.513   1.479
   25   HD12  ILE   4          HD12      ILE   4  -4.566  10.272   3.198
   26   HD13  ILE   4          HD13      ILE   4  -4.806   8.949   2.055
   27    H    TYR   5           H        TYR   5   0.287  10.862   5.381
   28    HA   TYR   5           HA       TYR   5   1.735  13.124   4.259
   29    HB2  TYR   5           HB2      TYR   5   0.260  13.397   6.285
   30    HB3  TYR   5           HB3      TYR   5   1.387  12.386   7.171
   31    HD1  TYR   5           HD1      TYR   5   1.270  15.507   5.184
   32    HD2  TYR   5           HD2      TYR   5   3.248  13.340   8.251
   33    HE1  TYR   5           HE1      TYR   5   2.661  17.452   5.642
   34    HE2  TYR   5           HE2      TYR   5   4.659  15.298   8.722
   35    HH   TYR   5           HH       TYR   5   3.956  18.370   7.428
   36    H    ALA   6           H        ALA   6   2.205  10.296   6.150
   37    HA   ALA   6           HA       ALA   6   5.103  10.560   5.793
   38    HB1  ALA   6           HB1      ALA   6   5.341   8.833   7.534
   39    HB2  ALA   6           HB2      ALA   6   3.585   8.707   7.647
   40    HB3  ALA   6           HB3      ALA   6   4.393  10.199   8.125
   41    H    ALA   7           H        ALA   7   4.928  10.048   3.613
   42    HA   ALA   7           HA       ALA   7   3.584   7.933   2.471
   43    HB1  ALA   7           HB1      ALA   7   6.164   9.151   1.512
   44    HB2  ALA   7           HB2      ALA   7   4.552   9.802   1.215
   45    HB3  ALA   7           HB3      ALA   7   5.014   8.241   0.534
   46    HA   PRO   8           HA       PRO   8   6.266   4.676   3.893
   47    HB2  PRO   8           HB2      PRO   8   4.466   2.657   3.513
   48    HB3  PRO   8           HB3      PRO   8   4.483   3.715   4.924
   49    HG2  PRO   8           HG2      PRO   8   2.542   3.600   2.755
   50    HG3  PRO   8           HG3      PRO   8   2.440   4.453   4.298
   51    HD2  PRO   8           HD2      PRO   8   3.118   5.498   1.668
   52    HD3  PRO   8           HD3      PRO   8   2.768   6.359   3.184
   53    H    LYS   9           H        LYS   9   7.827   4.311   2.436
   54    HA   LYS   9           HA       LYS   9   7.085   3.287  -0.162
   55    HB2  LYS   9           HB2      LYS   9   9.500   3.479  -0.744
   56    HB3  LYS   9           HB3      LYS   9   8.769   4.998  -0.268
   57    HG2  LYS   9           HG2      LYS   9   9.807   4.731   1.968
   58    HG3  LYS   9           HG3      LYS   9  10.595   3.270   1.371
   59    HD2  LYS   9           HD2      LYS   9  11.761   4.526  -0.333
   60    HD3  LYS   9           HD3      LYS   9  10.900   5.997   0.112
   61    HE2  LYS   9           HE2      LYS   9  12.849   4.478   1.850
   62    HE3  LYS   9           HE3      LYS   9  13.176   5.979   0.992
   63    HZ1  LYS   9           HZ1      LYS   9  11.403   7.024   2.334
   64    HZ2  LYS   9           HZ2      LYS   9  12.686   6.478   3.262
   65    HZ3  LYS   9           HZ3      LYS   9  11.255   5.602   3.224
   66    H    CYS  10           H        CYS  10   7.824   1.339  -0.977
   67    HA   CYS  10           HA       CYS  10   8.396  -0.596   1.150
   68    HB2  CYS  10           HB2      CYS  10   6.825  -2.125   0.076
   69    HB3  CYS  10           HB3      CYS  10   6.030  -0.650   0.624
   70    H    ARG  11           H        ARG  11   9.443  -2.389   0.539
   71    HA   ARG  11           HA       ARG  11  10.559  -2.489  -2.181
   72    HB2  ARG  11           HB2      ARG  11  11.652  -3.689   0.369
   73    HB3  ARG  11           HB3      ARG  11  12.386  -3.813  -1.220
   74    HG2  ARG  11           HG2      ARG  11  12.044  -1.300   0.426
   75    HG3  ARG  11           HG3      ARG  11  13.561  -2.133   0.076
   76    HD2  ARG  11           HD2      ARG  11  13.352  -1.616  -2.271
   77    HD3  ARG  11           HD3      ARG  11  11.752  -0.928  -2.013
   78    HE   ARG  11           HE       ARG  11  14.222   0.212  -0.925
   79   HH11  ARG  11          HH11      ARG  11  10.932   0.643  -2.255
   80   HH12  ARG  11          HH12      ARG  11  11.111   2.317  -2.495
   81   HH21  ARG  11          HH21      ARG  11  14.413   2.565  -1.247
   82   HH22  ARG  11          HH22      ARG  11  13.106   3.426  -1.901
   83    H    ARG  12           H        ARG  12   9.050  -4.106   0.474
   84    HA   ARG  12           HA       ARG  12   8.112  -6.210  -1.308
   85    HB2  ARG  12           HB2      ARG  12   8.159  -7.638   0.773
   86    HB3  ARG  12           HB3      ARG  12   9.684  -7.367  -0.047
   87    HG2  ARG  12           HG2      ARG  12  10.131  -5.547   1.625
   88    HG3  ARG  12           HG3      ARG  12   8.668  -6.048   2.477
   89    HD2  ARG  12           HD2      ARG  12  10.693  -7.018   3.464
   90    HD3  ARG  12           HD3      ARG  12   9.613  -8.256   2.822
   91    HE   ARG  12           HE       ARG  12  11.337  -7.625   0.797
   92   HH11  ARG  12          HH11      ARG  12  11.686  -8.905   4.070
   93   HH12  ARG  12          HH12      ARG  12  13.057  -9.844   3.705
   94   HH21  ARG  12          HH21      ARG  12  13.192  -8.862   0.299
   95   HH22  ARG  12          HH22      ARG  12  13.944  -9.826   1.482
   96    H    ASP  13           H        ASP  13   6.155  -7.162  -0.593
   97    HA   ASP  13           HA       ASP  13   4.216  -5.233  -0.024
   98    HB2  ASP  13           HB2      ASP  13   4.232  -8.211  -0.148
   99    HB3  ASP  13           HB3      ASP  13   2.788  -7.296   0.233
  100    H    SER  14           H        SER  14   5.917  -7.529   1.864
  101    HA   SER  14           HA       SER  14   4.365  -7.433   4.186
  102    HB2  SER  14           HB2      SER  14   6.543  -8.315   5.121
  103    HB3  SER  14           HB3      SER  14   5.680  -9.252   3.861
  104    HG   SER  14           HG       SER  14   7.908  -9.066   3.473
  105    H    ASP  15           H        ASP  15   6.359  -5.131   2.871
  106    HA   ASP  15           HA       ASP  15   7.319  -3.738   5.146
  107    HB2  ASP  15           HB2      ASP  15   6.544  -2.809   2.404
  108    HB3  ASP  15           HB3      ASP  15   6.779  -1.604   3.659
  109    H    CYS  16           H        CYS  16   4.147  -3.755   3.557
  110    HA   CYS  16           HA       CYS  16   3.067  -2.422   5.872
  111    HB2  CYS  16           HB2      CYS  16   2.450  -1.966   2.962
  112    HB3  CYS  16           HB3      CYS  16   1.581  -1.269   4.320
  113    HA   PRO  17           HA       PRO  17   1.190  -6.464   5.149
  114    HB2  PRO  17           HB2      PRO  17   0.582  -7.042   7.673
  115    HB3  PRO  17           HB3      PRO  17   2.255  -7.041   7.101
  116    HG2  PRO  17           HG2      PRO  17   0.785  -4.956   8.662
  117    HG3  PRO  17           HG3      PRO  17   2.440  -5.555   8.876
  118    HD2  PRO  17           HD2      PRO  17   1.779  -3.230   7.555
  119    HD3  PRO  17           HD3      PRO  17   3.274  -4.146   7.290
  120    H    GLY  18           H        GLY  18  -0.809  -7.515   6.443
  121    HA2  GLY  18           HA2      GLY  18  -3.021  -7.669   6.755
  122    HA3  GLY  18           HA3      GLY  18  -3.028  -5.950   7.101
  123    H    ALA  19           H        ALA  19  -3.982  -4.688   5.764
  124    HA   ALA  19           HA       ALA  19  -5.213  -5.828   3.407
  125    HB1  ALA  19           HB1      ALA  19  -6.568  -4.562   4.993
  126    HB2  ALA  19           HB2      ALA  19  -6.567  -3.804   3.400
  127    HB3  ALA  19           HB3      ALA  19  -5.580  -3.133   4.697
  128    H    CYS  20           H        CYS  20  -2.424  -3.981   4.112
  129    HA   CYS  20           HA       CYS  20  -2.585  -2.503   1.637
  130    HB2  CYS  20           HB2      CYS  20  -0.490  -2.559   3.795
  131    HB3  CYS  20           HB3      CYS  20  -0.557  -1.446   2.438
  132    H    ILE  21           H        ILE  21  -0.938  -2.631   0.066
  133    HA   ILE  21           HA       ILE  21   0.836  -4.965   0.191
  134    HB   ILE  21           HB       ILE  21   0.579  -5.304  -2.234
  135   HG12  ILE  21          HG12      ILE  21  -1.687  -3.292  -2.146
  136   HG13  ILE  21          HG13      ILE  21  -0.079  -2.943  -2.766
  137   HG21  ILE  21          HG21      ILE  21  -1.684  -6.256  -2.284
  138   HG22  ILE  21          HG22      ILE  21  -2.046  -5.424  -0.772
  139   HG23  ILE  21          HG23      ILE  21  -0.796  -6.669  -0.817
  140   HD11  ILE  21          HD11      ILE  21  -0.374  -4.625  -4.498
  141   HD12  ILE  21          HD12      ILE  21  -1.655  -3.415  -4.565
  142   HD13  ILE  21          HD13      ILE  21  -1.973  -5.007  -3.868
  143    H    CYS  22           H        CYS  22   2.437  -4.646  -1.778
  144    HA   CYS  22           HA       CYS  22   3.484  -1.913  -1.579
  145    HB2  CYS  22           HB2      CYS  22   5.047  -3.704  -0.943
  146    HB3  CYS  22           HB3      CYS  22   4.795  -4.499  -2.497
  147    H    ARG  23           H        ARG  23   3.306  -0.630  -3.370
  148    HA   ARG  23           HA       ARG  23   2.061  -1.789  -5.700
  149    HB2  ARG  23           HB2      ARG  23   2.849   1.047  -5.178
  150    HB3  ARG  23           HB3      ARG  23   1.753   0.437  -6.392
  151    HG2  ARG  23           HG2      ARG  23   0.141  -0.129  -4.675
  152    HG3  ARG  23           HG3      ARG  23   1.267   0.447  -3.433
  153    HD2  ARG  23           HD2      ARG  23   1.349   2.629  -4.539
  154    HD3  ARG  23           HD3      ARG  23   0.158   2.072  -5.701
  155    HE   ARG  23           HE       ARG  23  -0.321   2.363  -2.831
  156   HH11  ARG  23          HH11      ARG  23  -1.469   2.446  -6.167
  157   HH12  ARG  23          HH12      ARG  23  -2.848   3.377  -5.854
  158   HH21  ARG  23          HH21      ARG  23  -2.290   3.675  -2.350
  159   HH22  ARG  23          HH22      ARG  23  -3.275   4.114  -3.677
  160    H    GLY  24           H        GLY  24   2.886  -0.979  -7.806
  161    HA2  GLY  24           HA2      GLY  24   5.653  -1.644  -8.139
  162    HA3  GLY  24           HA3      GLY  24   4.534  -1.155  -9.400
  163    H    ASN  25           H        ASN  25   4.150   1.198  -7.301
  164    HA   ASN  25           HA       ASN  25   6.023   2.952  -8.649
  165    HB2  ASN  25           HB2      ASN  25   4.784   4.796  -7.687
  166    HB3  ASN  25           HB3      ASN  25   3.606   3.624  -8.248
  167   HD21  ASN  25          HD21      ASN  25   3.126   5.682  -6.337
  168   HD22  ASN  25          HD22      ASN  25   2.730   4.935  -4.846
  169    H    GLY  26           H        GLY  26   5.841   1.128  -5.792
  170    HA2  GLY  26           HA2      GLY  26   7.854   0.681  -4.622
  171    HA3  GLY  26           HA3      GLY  26   8.388   2.322  -4.959
  172    H    TYR  27           H        TYR  27   5.147   2.125  -4.130
  173    HA   TYR  27           HA       TYR  27   5.704   2.835  -1.362
  174    HB2  TYR  27           HB2      TYR  27   4.034   4.033  -3.456
  175    HB3  TYR  27           HB3      TYR  27   3.599   4.314  -1.753
  176    HD1  TYR  27           HD2      TYR  27   5.380   5.413  -0.303
  177    HD2  TYR  27           HD1      TYR  27   5.661   5.320  -4.541
  178    HE1  TYR  27           HE2      TYR  27   6.995   7.238  -0.221
  179    HE2  TYR  27           HE1      TYR  27   7.288   7.153  -4.478
  180    HH   TYR  27           HH       TYR  27   7.873   8.981  -2.968
  181    H    CYS  28           H        CYS  28   3.964   2.386   0.065
  182    HA   CYS  28           HA       CYS  28   2.616  -0.080  -0.555
  183    HB2  CYS  28           HB2      CYS  28   2.389   1.704   1.864
  184    HB3  CYS  28           HB3      CYS  28   1.790   0.061   1.729
  185    H    GLY  29           H        GLY  29   0.264  -0.317  -0.161
  186    HA2  GLY  29           HA2      GLY  29  -1.501   1.789   0.249
  187    HA3  GLY  29           HA3      GLY  29  -1.276   1.667  -1.488
  188    H    GLU  30           H        GLU  30  -3.714   1.334  -0.962
  189    HA   GLU  30           HA       GLU  30  -4.645  -1.114  -0.114
  190    HB2  GLU  30           HB2      GLU  30  -6.091   0.772  -0.345
  191    HB3  GLU  30           HB3      GLU  30  -5.708   0.925  -2.059
  192    HG2  GLU  30           HG2      GLU  30  -7.957   0.082  -1.718
  193    HG3  GLU  30           HG3      GLU  30  -6.924  -1.113  -2.498
  194    H    ALA  31           H        ALA  31  -5.518  -2.770  -1.432
  195    HA   ALA  31           HA       ALA  31  -3.591  -3.683  -3.383
  196    HB1  ALA  31           HB1      ALA  31  -4.329  -5.171  -1.583
  197    HB2  ALA  31           HB2      ALA  31  -4.656  -5.851  -3.177
  198    HB3  ALA  31           HB3      ALA  31  -5.966  -5.142  -2.236
  199    H    ILE  32           H        ILE  32  -5.812  -1.626  -3.924
  200    HA   ILE  32           HA       ILE  32  -6.993  -2.929  -6.246
  201    HB   ILE  32           HB       ILE  32  -7.328  -0.097  -5.291
  202   HG12  ILE  32          HG12      ILE  32  -8.381  -1.672  -3.702
  203   HG13  ILE  32          HG13      ILE  32  -9.606  -0.724  -4.534
  204   HG21  ILE  32          HG21      ILE  32  -9.252   0.061  -6.847
  205   HG22  ILE  32          HG22      ILE  32  -8.849  -1.546  -7.452
  206   HG23  ILE  32          HG23      ILE  32  -7.713  -0.215  -7.667
  207   HD11  ILE  32          HD11      ILE  32 -10.286  -3.031  -4.319
  208   HD12  ILE  32          HD12      ILE  32  -8.823  -3.568  -5.142
  209   HD13  ILE  32          HD13      ILE  32 -10.034  -2.631  -6.017
  210    H    TYR  33           H        TYR  33  -6.217  -2.562  -8.145
  211    HA   TYR  33           HA       TYR  33  -3.668  -1.183  -8.328
  212    HB2  TYR  33           HB2      TYR  33  -4.998  -3.266 -10.020
  213    HB3  TYR  33           HB3      TYR  33  -3.582  -2.383 -10.578
  214    HD1  TYR  33           HD1      TYR  33  -4.800  -4.604  -7.828
  215    HD2  TYR  33           HD2      TYR  33  -1.445  -3.014  -9.898
  216    HE1  TYR  33           HE1      TYR  33  -3.334  -6.137  -6.613
  217    HE2  TYR  33           HE2      TYR  33   0.024  -4.541  -8.701
  218    HH   TYR  33           HH       TYR  33  -0.016  -5.731  -6.532
  219    H    ALA  34           H        ALA  34  -6.869  -0.901  -9.379
  220    HA   ALA  34           HA       ALA  34  -6.306   1.108 -11.364
  221    HB1  ALA  34           HB1      ALA  34  -8.912   0.221 -10.112
  222    HB2  ALA  34           HB2      ALA  34  -8.246  -0.380 -11.630
  223    HB3  ALA  34           HB3      ALA  34  -8.763   1.300 -11.497
  224    H    ALA  35           H        ALA  35  -8.221   3.061 -10.747
  225    HA   ALA  35           HA       ALA  35  -6.915   4.592  -8.783
  226    HB1  ALA  35           HB1      ALA  35  -8.754   6.185  -9.071
  227    HB2  ALA  35           HB2      ALA  35  -9.692   4.963  -9.925
  228    HB3  ALA  35           HB3      ALA  35  -8.205   5.585 -10.637
  229    HA   PRO  36           HA       PRO  36  -9.087   2.627  -5.366
  230    HB2  PRO  36           HB2      PRO  36  -7.386   3.331  -3.424
  231    HB3  PRO  36           HB3      PRO  36  -6.944   2.108  -4.620
  232    HG2  PRO  36           HG2      PRO  36  -6.097   4.954  -4.423
  233    HG3  PRO  36           HG3      PRO  36  -5.177   3.547  -4.974
  234    HD2  PRO  36           HD2      PRO  36  -6.460   5.434  -6.610
  235    HD3  PRO  36           HD3      PRO  36  -5.849   3.847  -7.121
  236    H    PHE  37           H        PHE  37  -9.457   3.607  -2.947
  237    HA   PHE  37           HA       PHE  37 -10.122   6.412  -3.058
  238    HB2  PHE  37           HB2      PHE  37 -12.059   5.203  -4.063
  239    HB3  PHE  37           HB3      PHE  37 -12.200   4.262  -2.593
  240    HD1  PHE  37           HD1      PHE  37 -12.396   7.705  -3.933
  241    HD2  PHE  37           HD2      PHE  37 -13.475   5.051  -0.788
  242    HE1  PHE  37           HE1      PHE  37 -13.929   9.399  -3.034
  243    HE2  PHE  37           HE2      PHE  37 -15.010   6.748   0.117
  244    HZ   PHE  37           HZ       PHE  37 -15.237   8.922  -1.013
  245    H    ALA  38           H        ALA  38 -10.817   3.458  -1.237
  246    HA   ALA  38           HA       ALA  38 -10.097   4.807   1.220
  247    HB1  ALA  38           HB1      ALA  38 -10.984   1.987   0.749
  248    HB2  ALA  38           HB2      ALA  38 -12.053   3.322   1.226
  249    HB3  ALA  38           HB3      ALA  38 -10.775   2.748   2.319
  250    H    ARG  39           H        ARG  39  -7.917   5.098   0.580
  251    HA   ARG  39           HA       ARG  39  -6.251   2.817   0.277
  252    HB2  ARG  39           HB2      ARG  39  -5.557   5.728   0.726
  253    HB3  ARG  39           HB3      ARG  39  -4.391   4.451   0.399
  254    HG2  ARG  39           HG2      ARG  39  -5.464   4.038  -1.764
  255    HG3  ARG  39           HG3      ARG  39  -6.597   5.348  -1.438
  256    HD2  ARG  39           HD2      ARG  39  -3.600   5.680  -1.550
  257    HD3  ARG  39           HD3      ARG  39  -4.672   5.964  -2.914
  258    HE   ARG  39           HE       ARG  39  -5.745   7.559  -1.137
  259   HH11  ARG  39          HH11      ARG  39  -2.220   7.084  -1.627
  260   HH12  ARG  39          HH12      ARG  39  -1.894   8.751  -1.583
  261   HH21  ARG  39          HH21      ARG  39  -5.187   9.845  -0.992
  262   HH22  ARG  39          HH22      ARG  39  -3.568  10.325  -1.178
  Start of MODEL   19
    1    H1   CYS   1           H        CYS   1  -4.007   2.670   3.298
    2    HA   CYS   1           HA       CYS   1  -2.370   2.992   5.744
    3    HB2  CYS   1           HB2      CYS   1  -0.857   1.218   4.861
    4    HB3  CYS   1           HB3      CYS   1  -2.459   0.618   5.279
    5    H    GLU   2           H        GLU   2  -3.153   4.330   3.124
    6    HA   GLU   2           HA       GLU   2  -0.557   4.855   1.914
    7    HB2  GLU   2           HB2      GLU   2  -3.205   6.136   1.144
    8    HB3  GLU   2           HB3      GLU   2  -1.725   6.188   0.236
    9    HG2  GLU   2           HG2      GLU   2  -2.911   4.636  -0.962
   10    HG3  GLU   2           HG3      GLU   2  -2.018   3.591   0.132
   11    H    ALA   3           H        ALA   3  -0.247   7.299   1.324
   12    HA   ALA   3           HA       ALA   3  -1.176   9.176   3.225
   13    HB1  ALA   3           HB1      ALA   3   1.055   9.813   4.044
   14    HB2  ALA   3           HB2      ALA   3   1.763   8.449   3.188
   15    HB3  ALA   3           HB3      ALA   3   0.652   8.170   4.527
   16    H    ILE   4           H        ILE   4  -1.164  11.050   2.308
   17    HA   ILE   4           HA       ILE   4  -0.378  11.161  -0.488
   18    HB   ILE   4           HB       ILE   4  -1.970  13.185   1.119
   19   HG12  ILE   4          HG12      ILE   4  -3.005  10.965  -0.664
   20   HG13  ILE   4          HG13      ILE   4  -3.017  10.921   1.094
   21   HG21  ILE   4          HG21      ILE   4  -1.727  12.750  -1.861
   22   HG22  ILE   4          HG22      ILE   4  -1.024  14.088  -0.952
   23   HG23  ILE   4          HG23      ILE   4  -2.778  13.935  -1.082
   24   HD11  ILE   4          HD11      ILE   4  -5.198  11.507   0.207
   25   HD12  ILE   4          HD12      ILE   4  -4.495  12.885  -0.642
   26   HD13  ILE   4          HD13      ILE   4  -4.516  12.854   1.120
   27    H    TYR   5           H        TYR   5   0.526  12.498   2.563
   28    HA   TYR   5           HA       TYR   5   2.040  14.682   1.374
   29    HB2  TYR   5           HB2      TYR   5   0.839  14.935   3.529
   30    HB3  TYR   5           HB3      TYR   5   1.882  13.722   4.227
   31    HD1  TYR   5           HD1      TYR   5   2.021  17.085   2.633
   32    HD2  TYR   5           HD2      TYR   5   3.927  14.293   5.210
   33    HE1  TYR   5           HE1      TYR   5   3.682  18.778   3.231
   34    HE2  TYR   5           HE2      TYR   5   5.591  15.981   5.822
   35    HH   TYR   5           HH       TYR   5   5.210  19.236   5.145
   36    H    ALA   6           H        ALA   6   2.551  11.703   3.006
   37    HA   ALA   6           HA       ALA   6   5.195  11.467   1.826
   38    HB1  ALA   6           HB1      ALA   6   6.323  10.922   3.928
   39    HB2  ALA   6           HB2      ALA   6   4.835  11.242   4.819
   40    HB3  ALA   6           HB3      ALA   6   5.661  12.556   3.979
   41    H    ALA   7           H        ALA   7   4.328   9.862   0.642
   42    HA   ALA   7           HA       ALA   7   2.801   7.730   1.624
   43    HB1  ALA   7           HB1      ALA   7   4.496   7.880  -0.860
   44    HB2  ALA   7           HB2      ALA   7   2.822   8.420  -0.715
   45    HB3  ALA   7           HB3      ALA   7   3.217   6.708  -0.542
   46    HA   PRO   8           HA       PRO   8   6.015   5.261   3.474
   47    HB2  PRO   8           HB2      PRO   8   4.612   2.945   3.736
   48    HB3  PRO   8           HB3      PRO   8   4.353   4.337   4.796
   49    HG2  PRO   8           HG2      PRO   8   2.774   3.455   2.411
   50    HG3  PRO   8           HG3      PRO   8   2.189   4.058   3.970
   51    HD2  PRO   8           HD2      PRO   8   2.314   5.588   1.742
   52    HD3  PRO   8           HD3      PRO   8   2.519   6.251   3.374
   53    H    LYS   9           H        LYS   9   7.654   4.421   2.364
   54    HA   LYS   9           HA       LYS   9   7.297   3.298  -0.268
   55    HB2  LYS   9           HB2      LYS   9   9.792   3.446   1.432
   56    HB3  LYS   9           HB3      LYS   9   9.719   3.037  -0.276
   57    HG2  LYS   9           HG2      LYS   9   8.787   5.290  -0.714
   58    HG3  LYS   9           HG3      LYS   9   9.058   5.690   0.982
   59    HD2  LYS   9           HD2      LYS   9  10.887   6.544  -0.337
   60    HD3  LYS   9           HD3      LYS   9  11.473   5.196   0.641
   61    HE2  LYS   9           HE2      LYS   9  11.357   3.711  -1.259
   62    HE3  LYS   9           HE3      LYS   9  10.629   4.973  -2.252
   63    HZ1  LYS   9           HZ1      LYS   9  13.353   4.975  -1.096
   64    HZ2  LYS   9           HZ2      LYS   9  12.683   6.243  -1.996
   65    HZ3  LYS   9           HZ3      LYS   9  12.960   4.746  -2.721
   66    H    CYS  10           H        CYS  10   7.689   1.194  -0.884
   67    HA   CYS  10           HA       CYS  10   7.621  -0.740   1.338
   68    HB2  CYS  10           HB2      CYS  10   6.349  -2.191  -0.164
   69    HB3  CYS  10           HB3      CYS  10   5.522  -0.667   0.137
   70    H    ARG  11           H        ARG  11   8.916  -2.551   1.172
   71    HA   ARG  11           HA       ARG  11  10.701  -2.624  -1.166
   72    HB2  ARG  11           HB2      ARG  11  11.027  -3.997   1.522
   73    HB3  ARG  11           HB3      ARG  11  12.189  -4.019   0.207
   74    HG2  ARG  11           HG2      ARG  11  11.385  -1.646   1.874
   75    HG3  ARG  11           HG3      ARG  11  12.933  -2.485   1.896
   76    HD2  ARG  11           HD2      ARG  11  11.775  -0.901  -0.402
   77    HD3  ARG  11           HD3      ARG  11  13.101  -0.412   0.644
   78    HE   ARG  11           HE       ARG  11  13.993  -2.718  -0.351
   79   HH11  ARG  11          HH11      ARG  11  12.653   0.191  -1.912
   80   HH12  ARG  11          HH12      ARG  11  13.525  -0.027  -3.354
   81   HH21  ARG  11          HH21      ARG  11  15.189  -2.976  -2.369
   82   HH22  ARG  11          HH22      ARG  11  14.955  -1.850  -3.633
   83    H    ARG  12           H        ARG  12   8.726  -4.471   1.026
   84    HA   ARG  12           HA       ARG  12   7.933  -6.215  -1.152
   85    HB2  ARG  12           HB2      ARG  12   7.881  -8.077   0.565
   86    HB3  ARG  12           HB3      ARG  12   9.435  -7.669  -0.127
   87    HG2  ARG  12           HG2      ARG  12   9.990  -6.417   1.908
   88    HG3  ARG  12           HG3      ARG  12   8.398  -6.781   2.574
   89    HD2  ARG  12           HD2      ARG  12  10.153  -8.256   3.481
   90    HD3  ARG  12           HD3      ARG  12   8.917  -9.144   2.594
   91    HE   ARG  12           HE       ARG  12  10.955  -8.547   0.822
   92   HH11  ARG  12          HH11      ARG  12  10.469 -10.590   3.673
   93   HH12  ARG  12          HH12      ARG  12  11.693 -11.698   3.264
   94   HH21  ARG  12          HH21      ARG  12  12.587 -10.057   0.259
   95   HH22  ARG  12          HH22      ARG  12  12.945 -11.390   1.254
   96    H    ASP  13           H        ASP  13   5.949  -7.219  -0.792
   97    HA   ASP  13           HA       ASP  13   3.997  -5.414  -0.050
   98    HB2  ASP  13           HB2      ASP  13   4.011  -8.362  -0.558
   99    HB3  ASP  13           HB3      ASP  13   2.545  -7.451  -0.253
  100    H    SER  14           H        SER  14   5.500  -8.006   1.610
  101    HA   SER  14           HA       SER  14   3.720  -8.193   3.767
  102    HB2  SER  14           HB2      SER  14   5.711  -9.345   4.831
  103    HB3  SER  14           HB3      SER  14   4.965 -10.035   3.363
  104    HG   SER  14           HG       SER  14   7.359  -9.798   3.585
  105    H    ASP  15           H        ASP  15   6.109  -5.883   3.149
  106    HA   ASP  15           HA       ASP  15   6.152  -5.190   5.995
  107    HB2  ASP  15           HB2      ASP  15   7.852  -3.474   5.657
  108    HB3  ASP  15           HB3      ASP  15   8.346  -4.959   4.880
  109    H    CYS  16           H        CYS  16   4.122  -4.622   3.577
  110    HA   CYS  16           HA       CYS  16   3.444  -1.942   4.348
  111    HB2  CYS  16           HB2      CYS  16   2.257  -3.869   2.360
  112    HB3  CYS  16           HB3      CYS  16   1.715  -2.213   2.599
  113    HA   PRO  17           HA       PRO  17   0.728  -2.938   7.710
  114    HB2  PRO  17           HB2      PRO  17  -1.086  -1.005   6.336
  115    HB3  PRO  17           HB3      PRO  17  -0.632  -1.094   8.042
  116    HG2  PRO  17           HG2      PRO  17   0.508   0.706   6.490
  117    HG3  PRO  17           HG3      PRO  17   1.478  -0.201   7.662
  118    HD2  PRO  17           HD2      PRO  17   1.325  -0.503   4.699
  119    HD3  PRO  17           HD3      PRO  17   2.707  -0.711   5.796
  120    H    GLY  18           H        GLY  18  -0.367  -4.727   7.865
  121    HA2  GLY  18           HA2      GLY  18  -1.960  -6.300   7.653
  122    HA3  GLY  18           HA3      GLY  18  -2.967  -5.057   6.927
  123    H    ALA  19           H        ALA  19  -3.616  -5.480   5.014
  124    HA   ALA  19           HA       ALA  19  -2.185  -7.475   3.447
  125    HB1  ALA  19           HB1      ALA  19  -4.300  -7.876   2.303
  126    HB2  ALA  19           HB2      ALA  19  -5.061  -6.603   3.258
  127    HB3  ALA  19           HB3      ALA  19  -4.473  -8.063   4.047
  128    H    CYS  20           H        CYS  20  -2.078  -4.283   3.681
  129    HA   CYS  20           HA       CYS  20  -2.555  -3.359   1.075
  130    HB2  CYS  20           HB2      CYS  20  -0.602  -2.482   3.171
  131    HB3  CYS  20           HB3      CYS  20  -0.888  -1.616   1.674
  132    H    ILE  21           H        ILE  21  -1.065  -3.030  -0.590
  133    HA   ILE  21           HA       ILE  21   1.002  -5.089  -0.531
  134    HB   ILE  21           HB       ILE  21   0.683  -5.413  -2.921
  135   HG12  ILE  21          HG12      ILE  21  -1.628  -3.463  -2.689
  136   HG13  ILE  21          HG13      ILE  21  -0.104  -3.139  -3.513
  137   HG21  ILE  21          HG21      ILE  21  -1.532  -6.480  -2.848
  138   HG22  ILE  21          HG22      ILE  21  -1.881  -5.619  -1.349
  139   HG23  ILE  21          HG23      ILE  21  -0.576  -6.804  -1.401
  140   HD11  ILE  21          HD11      ILE  21  -1.856  -3.730  -5.106
  141   HD12  ILE  21          HD12      ILE  21  -2.105  -5.255  -4.266
  142   HD13  ILE  21          HD13      ILE  21  -0.579  -4.943  -5.088
  143    H    CYS  22           H        CYS  22   2.673  -4.733  -2.182
  144    HA   CYS  22           HA       CYS  22   3.680  -2.014  -1.902
  145    HB2  CYS  22           HB2      CYS  22   5.202  -3.841  -1.268
  146    HB3  CYS  22           HB3      CYS  22   5.002  -4.575  -2.852
  147    H    ARG  23           H        ARG  23   2.956  -0.726  -3.484
  148    HA   ARG  23           HA       ARG  23   2.116  -1.845  -5.961
  149    HB2  ARG  23           HB2      ARG  23   2.191   0.978  -4.968
  150    HB3  ARG  23           HB3      ARG  23   1.410   0.428  -6.434
  151    HG2  ARG  23           HG2      ARG  23  -0.095  -0.976  -5.182
  152    HG3  ARG  23           HG3      ARG  23   0.707  -0.535  -3.689
  153    HD2  ARG  23           HD2      ARG  23  -0.575   1.502  -5.482
  154    HD3  ARG  23           HD3      ARG  23  -1.433   0.714  -4.158
  155    HE   ARG  23           HE       ARG  23   0.529   1.578  -2.785
  156   HH11  ARG  23          HH11      ARG  23  -0.704   3.352  -5.591
  157   HH12  ARG  23          HH12      ARG  23  -0.514   4.878  -4.885
  158   HH21  ARG  23          HH21      ARG  23   0.760   3.662  -1.781
  159   HH22  ARG  23          HH22      ARG  23   0.375   5.062  -2.661
  160    H    GLY  24           H        GLY  24   2.697  -0.711  -7.954
  161    HA2  GLY  24           HA2      GLY  24   5.463  -1.105  -8.456
  162    HA3  GLY  24           HA3      GLY  24   4.268  -0.528  -9.606
  163    H    ASN  25           H        ASN  25   3.915   1.556  -7.239
  164    HA   ASN  25           HA       ASN  25   5.654   3.500  -8.492
  165    HB2  ASN  25           HB2      ASN  25   4.414   5.164  -7.218
  166    HB3  ASN  25           HB3      ASN  25   3.277   4.065  -7.978
  167   HD21  ASN  25          HD21      ASN  25   2.745   5.752  -5.805
  168   HD22  ASN  25          HD22      ASN  25   2.356   4.813  -4.430
  169    H    GLY  26           H        GLY  26   5.582   1.463  -5.777
  170    HA2  GLY  26           HA2      GLY  26   7.678   0.930  -4.745
  171    HA3  GLY  26           HA3      GLY  26   8.141   2.619  -4.934
  172    H    TYR  27           H        TYR  27   4.944   2.273  -4.053
  173    HA   TYR  27           HA       TYR  27   5.600   2.806  -1.277
  174    HB2  TYR  27           HB2      TYR  27   3.678   4.022  -3.161
  175    HB3  TYR  27           HB3      TYR  27   3.599   4.343  -1.414
  176    HD1  TYR  27           HD1      TYR  27   6.068   5.158  -0.515
  177    HD2  TYR  27           HD2      TYR  27   4.624   5.607  -4.476
  178    HE1  TYR  27           HE1      TYR  27   7.635   7.005  -0.871
  179    HE2  TYR  27           HE2      TYR  27   6.194   7.447  -4.853
  180    HH   TYR  27           HH       TYR  27   8.778   8.068  -2.872
  181    H    CYS  28           H        CYS  28   4.087   2.120   0.183
  182    HA   CYS  28           HA       CYS  28   2.575  -0.230  -0.466
  183    HB2  CYS  28           HB2      CYS  28   2.675   1.444   2.048
  184    HB3  CYS  28           HB3      CYS  28   1.828  -0.086   1.892
  185    H    GLY  29           H        GLY  29   0.388  -0.442  -0.569
  186    HA2  GLY  29           HA2      GLY  29  -1.342   1.647   0.214
  187    HA3  GLY  29           HA3      GLY  29  -1.180   1.565  -1.543
  188    H    GLU  30           H        GLU  30  -3.529   1.085  -0.095
  189    HA   GLU  30           HA       GLU  30  -4.054  -1.601   0.203
  190    HB2  GLU  30           HB2      GLU  30  -5.426   0.130   1.124
  191    HB3  GLU  30           HB3      GLU  30  -5.863   0.736  -0.469
  192    HG2  GLU  30           HG2      GLU  30  -7.689  -0.509   0.562
  193    HG3  GLU  30           HG3      GLU  30  -7.091  -1.343  -0.865
  194    H    ALA  31           H        ALA  31  -5.544  -2.821  -1.202
  195    HA   ALA  31           HA       ALA  31  -4.434  -3.099  -3.852
  196    HB1  ALA  31           HB1      ALA  31  -5.807  -5.109  -3.964
  197    HB2  ALA  31           HB2      ALA  31  -6.663  -4.622  -2.503
  198    HB3  ALA  31           HB3      ALA  31  -4.950  -5.031  -2.425
  199    H    ILE  32           H        ILE  32  -5.694  -0.701  -3.667
  200    HA   ILE  32           HA       ILE  32  -8.303  -0.856  -4.938
  201    HB   ILE  32           HB       ILE  32  -6.654   1.582  -4.385
  202   HG12  ILE  32          HG12      ILE  32  -8.720   0.383  -2.532
  203   HG13  ILE  32          HG13      ILE  32  -6.979   0.279  -2.296
  204   HG21  ILE  32          HG21      ILE  32  -8.518   1.965  -5.879
  205   HG22  ILE  32          HG22      ILE  32  -8.844   2.743  -4.331
  206   HG23  ILE  32          HG23      ILE  32  -9.626   1.215  -4.728
  207   HD11  ILE  32          HD11      ILE  32  -8.596   2.817  -2.334
  208   HD12  ILE  32          HD12      ILE  32  -6.856   2.688  -2.062
  209   HD13  ILE  32          HD13      ILE  32  -7.979   1.999  -0.898
  210    H    TYR  33           H        TYR  33  -8.413  -0.592  -7.118
  211    HA   TYR  33           HA       TYR  33  -5.956   0.032  -8.543
  212    HB2  TYR  33           HB2      TYR  33  -7.214  -0.868 -10.531
  213    HB3  TYR  33           HB3      TYR  33  -6.782  -2.054  -9.298
  214    HD1  TYR  33           HD2      TYR  33  -9.526  -0.145 -10.857
  215    HD2  TYR  33           HD1      TYR  33  -8.513  -3.236  -8.118
  216    HE1  TYR  33           HE2      TYR  33 -11.859  -0.858 -10.799
  217    HE2  TYR  33           HE1      TYR  33 -10.850  -3.955  -8.062
  218    HH   TYR  33           HH       TYR  33 -13.103  -2.887 -10.321
  219    H    ALA  34           H        ALA  34  -8.696   1.393  -7.523
  220    HA   ALA  34           HA       ALA  34  -8.820   3.441  -9.600
  221    HB1  ALA  34           HB1      ALA  34 -10.491   2.940  -7.131
  222    HB2  ALA  34           HB2      ALA  34 -10.921   2.483  -8.776
  223    HB3  ALA  34           HB3      ALA  34 -10.808   4.186  -8.338
  224    H    ALA  35           H        ALA  35  -9.589   5.551  -7.763
  225    HA   ALA  35           HA       ALA  35  -7.056   6.504  -6.967
  226    HB1  ALA  35           HB1      ALA  35  -9.805   7.498  -6.198
  227    HB2  ALA  35           HB2      ALA  35  -8.886   8.001  -7.617
  228    HB3  ALA  35           HB3      ALA  35  -8.295   8.389  -6.001
  229    HA   PRO  36           HA       PRO  36  -6.518   4.499  -2.987
  230    HB2  PRO  36           HB2      PRO  36  -5.166   7.076  -2.330
  231    HB3  PRO  36           HB3      PRO  36  -4.587   5.419  -2.122
  232    HG2  PRO  36           HG2      PRO  36  -3.653   6.895  -4.104
  233    HG3  PRO  36           HG3      PRO  36  -4.045   5.186  -4.372
  234    HD2  PRO  36           HD2      PRO  36  -5.602   7.626  -5.141
  235    HD3  PRO  36           HD3      PRO  36  -5.328   6.114  -6.045
  236    H    PHE  37           H        PHE  37  -7.349   4.597  -0.954
  237    HA   PHE  37           HA       PHE  37  -9.278   6.757  -0.465
  238    HB2  PHE  37           HB2      PHE  37 -10.222   4.448  -0.828
  239    HB3  PHE  37           HB3      PHE  37  -9.356   3.914   0.602
  240    HD1  PHE  37           HD2      PHE  37 -12.014   6.193  -0.591
  241    HD2  PHE  37           HD1      PHE  37 -10.306   4.195   2.759
  242    HE1  PHE  37           HE2      PHE  37 -13.938   6.851   0.782
  243    HE2  PHE  37           HE1      PHE  37 -12.230   4.853   4.138
  244    HZ   PHE  37           HZ       PHE  37 -14.052   6.189   3.145
  245    H    ALA  38           H        ALA  38  -6.375   5.480   0.468
  246    HA   ALA  38           HA       ALA  38  -4.940   5.822   2.020
  247    HB1  ALA  38           HB1      ALA  38  -6.770   7.876   3.275
  248    HB2  ALA  38           HB2      ALA  38  -5.600   8.211   1.996
  249    HB3  ALA  38           HB3      ALA  38  -5.043   7.671   3.582
  250    H    ARG  39           H        ARG  39  -5.531   3.669   2.379
  251    HA   ARG  39           HA       ARG  39  -6.809   3.153   4.932
  252    HB2  ARG  39           HB2      ARG  39  -5.429   1.304   2.988
  253    HB3  ARG  39           HB3      ARG  39  -6.316   0.802   4.410
  254    HG2  ARG  39           HG2      ARG  39  -7.510   2.180   2.016
  255    HG3  ARG  39           HG3      ARG  39  -7.533   0.447   2.324
  256    HD2  ARG  39           HD2      ARG  39  -8.801   0.861   4.399
  257    HD3  ARG  39           HD3      ARG  39  -8.832   2.584   4.007
  258    HE   ARG  39           HE       ARG  39  -9.783   1.366   1.782
  259   HH11  ARG  39          HH11      ARG  39 -10.863   1.425   5.174
  260   HH12  ARG  39          HH12      ARG  39 -12.471   1.070   4.785
  261   HH21  ARG  39          HH21      ARG  39 -11.977   0.874   1.290
  262   HH22  ARG  39          HH22      ARG  39 -13.134   0.756   2.512
  Start of MODEL   20
    1    H1   CYS   1           H        CYS   1  -3.358   1.116   3.327
    2    HA   CYS   1           HA       CYS   1  -4.790   1.806   5.753
    3    HB2  CYS   1           HB2      CYS   1  -4.692  -0.495   6.371
    4    HB3  CYS   1           HB3      CYS   1  -5.219  -0.387   4.706
    5    H    GLU   2           H        GLU   2  -1.950   2.283   4.663
    6    HA   GLU   2           HA       GLU   2  -0.541   1.839   7.210
    7    HB2  GLU   2           HB2      GLU   2   0.538   2.554   4.487
    8    HB3  GLU   2           HB3      GLU   2   1.527   2.554   5.940
    9    HG2  GLU   2           HG2      GLU   2   0.063   0.190   4.796
   10    HG3  GLU   2           HG3      GLU   2   1.800   0.500   4.689
   11    H    ALA   3           H        ALA   3  -0.919   4.407   4.781
   12    HA   ALA   3           HA       ALA   3  -1.386   6.366   6.727
   13    HB1  ALA   3           HB1      ALA   3   0.523   7.769   6.057
   14    HB2  ALA   3           HB2      ALA   3   1.141   6.459   5.056
   15    HB3  ALA   3           HB3      ALA   3   1.083   6.274   6.809
   16    H    ILE   4           H        ILE   4  -2.329   8.035   5.709
   17    HA   ILE   4           HA       ILE   4  -3.026   7.502   2.905
   18    HB   ILE   4           HB       ILE   4  -4.658   8.965   4.994
   19   HG12  ILE   4          HG12      ILE   4  -5.128   6.321   3.606
   20   HG13  ILE   4          HG13      ILE   4  -4.564   6.507   5.259
   21   HG21  ILE   4          HG21      ILE   4  -6.437   9.029   3.296
   22   HG22  ILE   4          HG22      ILE   4  -5.315   8.365   2.109
   23   HG23  ILE   4          HG23      ILE   4  -5.020   9.958   2.810
   24   HD11  ILE   4          HD11      ILE   4  -7.237   7.362   4.170
   25   HD12  ILE   4          HD12      ILE   4  -6.688   7.609   5.827
   26   HD13  ILE   4          HD13      ILE   4  -6.920   5.972   5.211
   27    H    TYR   5           H        TYR   5  -2.164  10.059   5.095
   28    HA   TYR   5           HA       TYR   5  -2.043  12.021   2.963
   29    HB2  TYR   5           HB2      TYR   5  -2.874  12.628   5.202
   30    HB3  TYR   5           HB3      TYR   5  -1.355  12.138   5.900
   31    HD1  TYR   5           HD1      TYR   5  -2.732  14.589   3.441
   32    HD2  TYR   5           HD2      TYR   5   0.351  13.662   6.220
   33    HE1  TYR   5           HE1      TYR   5  -1.811  16.839   3.160
   34    HE2  TYR   5           HE2      TYR   5   1.281  15.900   5.949
   35    HH   TYR   5           HH       TYR   5  -0.389  18.405   4.404
   36    H    ALA   6           H        ALA   6  -0.067  10.235   5.124
   37    HA   ALA   6           HA       ALA   6   2.401  11.265   3.960
   38    HB1  ALA   6           HB1      ALA   6   2.027   9.200   6.134
   39    HB2  ALA   6           HB2      ALA   6   2.310  10.922   6.383
   40    HB3  ALA   6           HB3      ALA   6   3.559   9.923   5.642
   41    H    ALA   7           H        ALA   7   3.697  10.168   2.588
   42    HA   ALA   7           HA       ALA   7   2.566   7.890   1.259
   43    HB1  ALA   7           HB1      ALA   7   5.142   9.367   0.737
   44    HB2  ALA   7           HB2      ALA   7   3.589   9.720  -0.016
   45    HB3  ALA   7           HB3      ALA   7   4.391   8.179  -0.326
   46    HA   PRO   8           HA       PRO   8   5.309   5.247   3.710
   47    HB2  PRO   8           HB2      PRO   8   3.715   3.021   3.581
   48    HB3  PRO   8           HB3      PRO   8   3.488   4.303   4.771
   49    HG2  PRO   8           HG2      PRO   8   1.817   3.613   2.476
   50    HG3  PRO   8           HG3      PRO   8   1.454   4.678   3.836
   51    HD2  PRO   8           HD2      PRO   8   2.298   5.371   1.144
   52    HD3  PRO   8           HD3      PRO   8   1.735   6.432   2.449
   53    H    LYS   9           H        LYS   9   7.006   4.248   2.703
   54    HA   LYS   9           HA       LYS   9   6.498   3.291  -0.016
   55    HB2  LYS   9           HB2      LYS   9   8.874   3.527  -0.446
   56    HB3  LYS   9           HB3      LYS   9   8.162   5.041   0.082
   57    HG2  LYS   9           HG2      LYS   9   9.106   4.633   2.328
   58    HG3  LYS   9           HG3      LYS   9   9.883   3.177   1.694
   59    HD2  LYS   9           HD2      LYS   9  11.017   4.565   0.002
   60    HD3  LYS   9           HD3      LYS   9  10.300   5.997   0.737
   61    HE2  LYS   9           HE2      LYS   9  11.413   5.400   2.854
   62    HE3  LYS   9           HE3      LYS   9  12.211   4.068   2.022
   63    HZ1  LYS   9           HZ1      LYS   9  12.496   6.945   1.383
   64    HZ2  LYS   9           HZ2      LYS   9  13.171   5.722   0.487
   65    HZ3  LYS   9           HZ3      LYS   9  13.685   5.969   2.069
   66    H    CYS  10           H        CYS  10   7.278   1.313  -0.753
   67    HA   CYS  10           HA       CYS  10   7.841  -0.612   1.409
   68    HB2  CYS  10           HB2      CYS  10   6.521  -2.239   0.121
   69    HB3  CYS  10           HB3      CYS  10   5.554  -0.866   0.653
   70    H    ARG  11           H        ARG  11   9.221  -2.293   0.870
   71    HA   ARG  11           HA       ARG  11  10.419  -2.156  -1.819
   72    HB2  ARG  11           HB2      ARG  11  11.499  -3.464   0.687
   73    HB3  ARG  11           HB3      ARG  11  12.281  -3.512  -0.882
   74    HG2  ARG  11           HG2      ARG  11  12.502  -1.026  -0.760
   75    HG3  ARG  11           HG3      ARG  11  11.850  -1.114   0.878
   76    HD2  ARG  11           HD2      ARG  11  14.275  -1.012   0.960
   77    HD3  ARG  11           HD3      ARG  11  13.718  -2.589   1.521
   78    HE   ARG  11           HE       ARG  11  14.241  -2.706  -1.227
   79   HH11  ARG  11          HH11      ARG  11  16.087  -2.374   1.764
   80   HH12  ARG  11          HH12      ARG  11  17.468  -3.185   1.165
   81   HH21  ARG  11          HH21      ARG  11  16.144  -3.773  -2.048
   82   HH22  ARG  11          HH22      ARG  11  17.498  -3.987  -1.047
   83    H    ARG  12           H        ARG  12   8.941  -4.051   0.663
   84    HA   ARG  12           HA       ARG  12   8.134  -6.052  -1.296
   85    HB2  ARG  12           HB2      ARG  12   8.275  -7.688   0.606
   86    HB3  ARG  12           HB3      ARG  12   9.784  -7.225  -0.141
   87    HG2  ARG  12           HG2      ARG  12   9.949  -5.510   1.802
   88    HG3  ARG  12           HG3      ARG  12   8.641  -6.425   2.541
   89    HD2  ARG  12           HD2      ARG  12  11.342  -7.524   1.757
   90    HD3  ARG  12           HD3      ARG  12  10.849  -7.096   3.392
   91    HE   ARG  12           HE       ARG  12   8.988  -8.866   2.561
   92   HH11  ARG  12          HH11      ARG  12  12.509  -8.916   2.884
   93   HH12  ARG  12          HH12      ARG  12  12.615 -10.603   3.116
   94   HH21  ARG  12          HH21      ARG  12   9.159 -11.213   2.803
   95   HH22  ARG  12          HH22      ARG  12  10.668 -11.948   3.039
   96    H    ASP  13           H        ASP  13   6.190  -7.044  -0.798
   97    HA   ASP  13           HA       ASP  13   4.185  -5.232  -0.076
   98    HB2  ASP  13           HB2      ASP  13   4.165  -8.239  -0.298
   99    HB3  ASP  13           HB3      ASP  13   2.753  -7.214  -0.171
  100    H    SER  14           H        SER  14   5.757  -7.818   1.507
  101    HA   SER  14           HA       SER  14   4.198  -8.017   3.795
  102    HB2  SER  14           HB2      SER  14   6.306  -9.111   4.661
  103    HB3  SER  14           HB3      SER  14   5.460  -9.806   3.253
  104    HG   SER  14           HG       SER  14   7.082  -9.426   2.088
  105    H    ASP  15           H        ASP  15   6.540  -5.643   3.000
  106    HA   ASP  15           HA       ASP  15   6.974  -5.133   5.802
  107    HB2  ASP  15           HB2      ASP  15   8.459  -3.232   5.331
  108    HB3  ASP  15           HB3      ASP  15   8.942  -4.638   4.418
  109    H    CYS  16           H        CYS  16   4.499  -4.351   3.775
  110    HA   CYS  16           HA       CYS  16   3.614  -2.522   5.803
  111    HB2  CYS  16           HB2      CYS  16   3.313  -2.378   2.829
  112    HB3  CYS  16           HB3      CYS  16   2.126  -1.634   3.895
  113    HA   PRO  17           HA       PRO  17   1.104  -6.138   6.277
  114    HB2  PRO  17           HB2      PRO  17   0.047  -5.494   8.654
  115    HB3  PRO  17           HB3      PRO  17   1.736  -5.974   8.476
  116    HG2  PRO  17           HG2      PRO  17   0.556  -3.237   8.721
  117    HG3  PRO  17           HG3      PRO  17   1.989  -3.911   9.516
  118    HD2  PRO  17           HD2      PRO  17   2.114  -2.316   7.323
  119    HD3  PRO  17           HD3      PRO  17   3.321  -3.564   7.690
  120    H    GLY  18           H        GLY  18  -1.164  -6.413   7.408
  121    HA2  GLY  18           HA2      GLY  18  -3.411  -6.203   7.358
  122    HA3  GLY  18           HA3      GLY  18  -3.170  -4.494   7.021
  123    H    ALA  19           H        ALA  19  -4.266  -3.975   5.353
  124    HA   ALA  19           HA       ALA  19  -4.714  -5.862   3.195
  125    HB1  ALA  19           HB1      ALA  19  -6.626  -4.670   4.108
  126    HB2  ALA  19           HB2      ALA  19  -6.357  -4.202   2.426
  127    HB3  ALA  19           HB3      ALA  19  -5.861  -3.130   3.732
  128    H    CYS  20           H        CYS  20  -2.194  -3.915   3.877
  129    HA   CYS  20           HA       CYS  20  -2.127  -2.654   1.305
  130    HB2  CYS  20           HB2      CYS  20  -0.403  -2.366   3.738
  131    HB3  CYS  20           HB3      CYS  20  -0.117  -1.542   2.215
  132    H    ILE  21           H        ILE  21  -0.518  -2.835  -0.054
  133    HA   ILE  21           HA       ILE  21   1.286  -5.113   0.108
  134    HB   ILE  21           HB       ILE  21   0.740  -5.576  -2.307
  135   HG12  ILE  21          HG12      ILE  21  -1.666  -3.817  -1.724
  136   HG13  ILE  21          HG13      ILE  21  -0.366  -3.451  -2.846
  137   HG21  ILE  21          HG21      ILE  21  -1.292  -6.886  -1.841
  138   HG22  ILE  21          HG22      ILE  21  -1.451  -6.040  -0.301
  139   HG23  ILE  21          HG23      ILE  21  -0.051  -7.071  -0.601
  140   HD11  ILE  21          HD11      ILE  21  -2.356  -5.697  -3.110
  141   HD12  ILE  21          HD12      ILE  21  -1.056  -5.332  -4.246
  142   HD13  ILE  21          HD13      ILE  21  -2.365  -4.179  -4.007
  143    H    CYS  22           H        CYS  22   2.675  -4.888  -2.069
  144    HA   CYS  22           HA       CYS  22   3.629  -2.134  -1.936
  145    HB2  CYS  22           HB2      CYS  22   5.166  -4.112  -1.420
  146    HB3  CYS  22           HB3      CYS  22   5.064  -4.508  -3.134
  147    H    ARG  23           H        ARG  23   3.254  -0.821  -3.628
  148    HA   ARG  23           HA       ARG  23   2.176  -2.018  -6.029
  149    HB2  ARG  23           HB2      ARG  23   2.261   0.816  -5.048
  150    HB3  ARG  23           HB3      ARG  23   1.385   0.231  -6.449
  151    HG2  ARG  23           HG2      ARG  23   0.880  -0.881  -3.726
  152    HG3  ARG  23           HG3      ARG  23   0.078   0.579  -4.269
  153    HD2  ARG  23           HD2      ARG  23  -1.359  -1.379  -4.626
  154    HD3  ARG  23           HD3      ARG  23  -0.877  -0.715  -6.176
  155    HE   ARG  23           HE       ARG  23   0.774  -2.884  -5.224
  156   HH11  ARG  23          HH11      ARG  23  -2.187  -2.084  -7.023
  157   HH12  ARG  23          HH12      ARG  23  -2.133  -3.480  -7.987
  158   HH21  ARG  23          HH21      ARG  23   0.802  -4.851  -6.578
  159   HH22  ARG  23          HH22      ARG  23  -0.439  -5.054  -7.727
  160    H    GLY  24           H        GLY  24   2.756  -0.765  -8.062
  161    HA2  GLY  24           HA2      GLY  24   5.513  -1.281  -8.555
  162    HA3  GLY  24           HA3      GLY  24   4.357  -0.637  -9.708
  163    H    ASN  25           H        ASN  25   4.056   1.473  -7.380
  164    HA   ASN  25           HA       ASN  25   5.976   3.318  -8.527
  165    HB2  ASN  25           HB2      ASN  25   4.750   5.037  -7.289
  166    HB3  ASN  25           HB3      ASN  25   3.624   4.018  -8.171
  167   HD21  ASN  25          HD21      ASN  25   2.944   5.667  -6.015
  168   HD22  ASN  25          HD22      ASN  25   2.398   4.687  -4.713
  169    H    GLY  26           H        GLY  26   5.611   1.302  -5.815
  170    HA2  GLY  26           HA2      GLY  26   7.516   0.677  -4.535
  171    HA3  GLY  26           HA3      GLY  26   8.151   2.306  -4.754
  172    H    TYR  27           H        TYR  27   4.816   2.090  -4.101
  173    HA   TYR  27           HA       TYR  27   5.327   2.798  -1.350
  174    HB2  TYR  27           HB2      TYR  27   3.573   3.946  -3.410
  175    HB3  TYR  27           HB3      TYR  27   3.207   4.236  -1.693
  176    HD1  TYR  27           HD1      TYR  27   5.139   5.285  -0.324
  177    HD2  TYR  27           HD2      TYR  27   5.062   5.314  -4.563
  178    HE1  TYR  27           HE1      TYR  27   6.774   7.108  -0.328
  179    HE2  TYR  27           HE2      TYR  27   6.701   7.137  -4.591
  180    HH   TYR  27           HH       TYR  27   7.351   9.001  -2.933
  181    H    CYS  28           H        CYS  28   3.744   2.319   0.132
  182    HA   CYS  28           HA       CYS  28   2.549  -0.256  -0.267
  183    HB2  CYS  28           HB2      CYS  28   2.352   1.590   2.112
  184    HB3  CYS  28           HB3      CYS  28   2.024  -0.137   2.079
  185    H    GLY  29           H        GLY  29   0.702  -0.372  -1.278
  186    HA2  GLY  29           HA2      GLY  29  -1.324   1.697  -0.737
  187    HA3  GLY  29           HA3      GLY  29  -1.139   0.897  -2.304
  188    H    GLU  30           H        GLU  30  -3.579   0.804  -0.939
  189    HA   GLU  30           HA       GLU  30  -3.610  -1.673   0.391
  190    HB2  GLU  30           HB2      GLU  30  -4.984   0.175   1.130
  191    HB3  GLU  30           HB3      GLU  30  -5.832   0.259  -0.406
  192    HG2  GLU  30           HG2      GLU  30  -5.971  -2.132   1.415
  193    HG3  GLU  30           HG3      GLU  30  -6.979  -0.719   1.693
  194    H    ALA  31           H        ALA  31  -5.363  -3.233  -0.530
  195    HA   ALA  31           HA       ALA  31  -4.270  -4.209  -2.939
  196    HB1  ALA  31           HB1      ALA  31  -5.268  -5.689  -1.235
  197    HB2  ALA  31           HB2      ALA  31  -5.945  -5.959  -2.841
  198    HB3  ALA  31           HB3      ALA  31  -6.859  -5.044  -1.644
  199    H    ILE  32           H        ILE  32  -7.146  -2.385  -2.196
  200    HA   ILE  32           HA       ILE  32  -7.574  -2.236  -5.019
  201    HB   ILE  32           HB       ILE  32  -9.450  -1.342  -2.820
  202   HG12  ILE  32          HG12      ILE  32  -9.624  -3.678  -4.747
  203   HG13  ILE  32          HG13      ILE  32  -9.229  -3.794  -3.039
  204   HG21  ILE  32          HG21      ILE  32  -9.714   0.066  -4.804
  205   HG22  ILE  32          HG22      ILE  32 -11.109  -0.998  -4.622
  206   HG23  ILE  32          HG23      ILE  32  -9.868  -1.368  -5.819
  207   HD11  ILE  32          HD11      ILE  32 -11.469  -2.996  -2.471
  208   HD12  ILE  32          HD12      ILE  32 -11.533  -4.436  -3.486
  209   HD13  ILE  32          HD13      ILE  32 -11.847  -2.849  -4.187
  210    H    TYR  33           H        TYR  33  -7.578  -0.123  -2.365
  211    HA   TYR  33           HA       TYR  33  -7.127   2.152  -4.102
  212    HB2  TYR  33           HB2      TYR  33  -7.653   1.986  -1.155
  213    HB3  TYR  33           HB3      TYR  33  -7.332   3.487  -2.001
  214    HD1  TYR  33           HD2      TYR  33  -9.728   0.731  -1.576
  215    HD2  TYR  33           HD1      TYR  33  -9.020   4.488  -3.423
  216    HE1  TYR  33           HE2      TYR  33 -12.096   0.875  -2.163
  217    HE2  TYR  33           HE1      TYR  33 -11.391   4.650  -4.017
  218    HH   TYR  33           HH       TYR  33 -13.751   2.544  -2.734
  219    H    ALA  34           H        ALA  34  -5.130   2.103  -4.825
  220    HA   ALA  34           HA       ALA  34  -2.868   1.854  -2.995
  221    HB1  ALA  34           HB1      ALA  34  -2.792   0.586  -5.057
  222    HB2  ALA  34           HB2      ALA  34  -1.510   1.800  -5.033
  223    HB3  ALA  34           HB3      ALA  34  -2.964   2.069  -5.992
  224    H    ALA  35           H        ALA  35  -4.637   4.194  -4.711
  225    HA   ALA  35           HA       ALA  35  -2.611   6.203  -4.804
  226    HB1  ALA  35           HB1      ALA  35  -4.451   7.686  -5.507
  227    HB2  ALA  35           HB2      ALA  35  -5.613   6.420  -5.112
  228    HB3  ALA  35           HB3      ALA  35  -4.457   6.178  -6.421
  229    HA   PRO  36           HA       PRO  36  -3.167   7.766  -0.697
  230    HB2  PRO  36           HB2      PRO  36  -2.957  10.511  -1.547
  231    HB3  PRO  36           HB3      PRO  36  -1.836   9.544  -0.574
  232    HG2  PRO  36           HG2      PRO  36  -1.231  10.313  -3.133
  233    HG3  PRO  36           HG3      PRO  36  -0.655   8.798  -2.419
  234    HD2  PRO  36           HD2      PRO  36  -2.941   9.261  -4.291
  235    HD3  PRO  36           HD3      PRO  36  -1.736   7.954  -4.277
  236    H    PHE  37           H        PHE  37  -5.206   7.196  -0.788
  237    HA   PHE  37           HA       PHE  37  -7.124   9.321  -0.282
  238    HB2  PHE  37           HB2      PHE  37  -7.478   8.726  -2.619
  239    HB3  PHE  37           HB3      PHE  37  -7.655   7.039  -2.186
  240    HD1  PHE  37           HD1      PHE  37  -9.161  10.337  -1.243
  241    HD2  PHE  37           HD2      PHE  37  -9.791   6.202  -2.058
  242    HE1  PHE  37           HE1      PHE  37 -11.573  10.645  -0.955
  243    HE2  PHE  37           HE2      PHE  37 -12.202   6.512  -1.768
  244    HZ   PHE  37           HZ       PHE  37 -13.101   8.738  -1.213
  245    H    ALA  38           H        ALA  38  -6.656   5.818  -0.488
  246    HA   ALA  38           HA       ALA  38  -7.507   5.585   2.270
  247    HB1  ALA  38           HB1      ALA  38  -9.191   3.902   1.831
  248    HB2  ALA  38           HB2      ALA  38  -8.894   4.030   0.098
  249    HB3  ALA  38           HB3      ALA  38  -9.583   5.394   0.975
  250    H    ARG  39           H        ARG  39  -5.152   5.121   2.278
  251    HA   ARG  39           HA       ARG  39  -4.573   2.360   1.539
  252    HB2  ARG  39           HB2      ARG  39  -2.741   4.637   2.341
  253    HB3  ARG  39           HB3      ARG  39  -2.211   3.003   1.977
  254    HG2  ARG  39           HG2      ARG  39  -3.051   3.253  -0.321
  255    HG3  ARG  39           HG3      ARG  39  -3.555   4.898   0.057
  256    HD2  ARG  39           HD2      ARG  39  -0.725   3.850   0.129
  257    HD3  ARG  39           HD3      ARG  39  -1.420   4.855  -1.139
  258    HE   ARG  39           HE       ARG  39  -1.430   5.905   1.584
  259   HH11  ARG  39          HH11      ARG  39   0.196   5.886  -1.588
  260   HH12  ARG  39          HH12      ARG  39   0.913   7.394  -1.370
  261   HH21  ARG  39          HH21      ARG  39  -0.386   7.996   1.864
  262   HH22  ARG  39          HH22      ARG  39   0.550   8.628   0.612