*HEADER    VIRAL PROTEIN                           21-JUL-19   6PVT              
*TITLE     INFLUENZA B M2 PROTON CHANNEL IN THE OPEN STATE - SSNMR STRUCTURE AT  
*TITLE    2 PH 4.5                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BM2 PROTEIN;                                               
*COMPND   3 CHAIN: A, B, C, D;                                                   
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: INFLUENZA B VIRUS (B/MARYLAND/1/2001);          
*SOURCE   3 ORGANISM_TAXID: 1601064;                                             
*SOURCE   4 STRAIN: B/MARYLAND/1/2001;                                           
*SOURCE   5 GENE: BM2;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET-SUMO                                  
*KEYWDS    PROTON CHANNEL, CLOSED STATE, FOUR HELIX BUNDLE, VIRAL PROTEIN        
*EXPDTA    SOLID-STATE NMR                                                       
*NUMMDL    10                                                                    
*AUTHOR    V.S.MANDALA,A.R.LOFTIS,A.S.SHCHERBAKOV,B.L.PENTELUTE,M.HONG           
*REVDAT   1   05-FEB-20 6PVT    0                                                
# Restraints file 1: bm2dihA.tbl

!    3 E  -68.761  148.278   11.026   15.772    0.717 0.818 25  9 Strong
assign (resid    2 and name C and segid A   ) (resid    3 and name N and segid A   )
       (resid    3 and name CA and segid A  ) (resid    3 and name C and segid A   )    1.0  -68.8   22.1 2
assign (resid    3 and name N and segid A   ) (resid    3 and name CA and segid A  )
       (resid    3 and name C and segid A   ) (resid    4 and name N and segid A   )    1.0  148.3   31.5 2

!    4 P  -52.563  -37.709    3.860    5.230    0.507 0.832 25  9 Strong
assign (resid    3 and name C and segid A   ) (resid    4 and name N and segid A   )
       (resid    4 and name CA and segid A  ) (resid    4 and name C and segid A   )    1.0  -52.6   20.0 2
assign (resid    4 and name N and segid A   ) (resid    4 and name CA and segid A  )
       (resid    4 and name C and segid A   ) (resid    5 and name N and segid A   )    1.0  -37.7   20.0 2

!    7 I  -62.214  -37.639    5.245    6.340    0.248 0.888 25 10 Strong
assign (resid    6 and name C and segid A   ) (resid    7 and name N and segid A   )
       (resid    7 and name CA and segid A  ) (resid    7 and name C and segid A   )    1.0  -62.2   20.0 2
assign (resid    7 and name N and segid A   ) (resid    7 and name CA and segid A  )
       (resid    7 and name C and segid A   ) (resid    8 and name N and segid A   )    1.0  -37.6   20.0 2

!    8 L  -65.940  -37.716    4.412    5.084    0.198 0.911 25 12 Strong
assign (resid    7 and name C and segid A   ) (resid    8 and name N and segid A   )
       (resid    8 and name CA and segid A  ) (resid    8 and name C and segid A   )    1.0  -65.9   20.0 2
assign (resid    8 and name N and segid A   ) (resid    8 and name CA and segid A  )
       (resid    8 and name C and segid A   ) (resid    9 and name N and segid A   )    1.0  -37.7   20.0 2

!    9 S  -66.410  -36.378    5.465    5.012    0.142 0.925 25 12 Strong
assign (resid    8 and name C and segid A   ) (resid    9 and name N and segid A   )
       (resid    9 and name CA and segid A  ) (resid    9 and name C and segid A   )    1.0  -66.4   20.0 2
assign (resid    9 and name N and segid A   ) (resid    9 and name CA and segid A  )
       (resid    9 and name C and segid A   ) (resid   10 and name N and segid A   )    1.0  -36.4   20.0 2

!   10 I  -64.917  -40.614    4.296    4.189    0.121 0.927 25 12 Strong
assign (resid    9 and name C and segid A   ) (resid   10 and name N and segid A   )
       (resid   10 and name CA and segid A  ) (resid   10 and name C and segid A   )    1.0  -64.9   20.0 2
assign (resid   10 and name N and segid A   ) (resid   10 and name CA and segid A  )
       (resid   10 and name C and segid A   ) (resid   11 and name N and segid A   )    1.0  -40.6   20.0 2

!   11 C  -61.795  -41.863    3.757    4.623    0.130 0.925 25 12 Strong
assign (resid   10 and name C and segid A   ) (resid   11 and name N and segid A   )
       (resid   11 and name CA and segid A  ) (resid   11 and name C and segid A   )    1.0  -61.8   20.0 2
assign (resid   11 and name N and segid A   ) (resid   11 and name CA and segid A  )
       (resid   11 and name C and segid A   ) (resid   12 and name N and segid A   )    1.0  -41.9   20.0 2

!   12 S  -66.298  -37.990    5.748    5.469    0.116 0.918 25 12 Strong
assign (resid   11 and name C and segid A   ) (resid   12 and name N and segid A   )
       (resid   12 and name CA and segid A  ) (resid   12 and name C and segid A   )    1.0  -66.3   20.0 2
assign (resid   12 and name N and segid A   ) (resid   12 and name CA and segid A  )
       (resid   12 and name C and segid A   ) (resid   13 and name N and segid A   )    1.0  -38.0   20.0 2

!   13 F  -63.484  -43.655    3.803    5.126    0.116 0.911 25 12 Strong
assign (resid   12 and name C and segid A   ) (resid   13 and name N and segid A   )
       (resid   13 and name CA and segid A  ) (resid   13 and name C and segid A   )    1.0  -63.5   20.0 2
assign (resid   13 and name N and segid A   ) (resid   13 and name CA and segid A  )
       (resid   13 and name C and segid A   ) (resid   14 and name N and segid A   )    1.0  -43.7   20.0 2

!   14 I  -65.192  -39.945    5.159    4.978    0.119 0.910 25 12 Strong
assign (resid   13 and name C and segid A   ) (resid   14 and name N and segid A   )
       (resid   14 and name CA and segid A  ) (resid   14 and name C and segid A   )    1.0  -65.2   20.0 2
assign (resid   14 and name N and segid A   ) (resid   14 and name CA and segid A  )
       (resid   14 and name C and segid A   ) (resid   15 and name N and segid A   )    1.0  -39.9   20.0 2

!   15 L  -66.110  -37.007    5.959    5.698    0.102 0.901 25 12 Strong
assign (resid   14 and name C and segid A   ) (resid   15 and name N and segid A   )
       (resid   15 and name CA and segid A  ) (resid   15 and name C and segid A   )    1.0  -66.1   20.0 2
assign (resid   15 and name N and segid A   ) (resid   15 and name CA and segid A  )
       (resid   15 and name C and segid A   ) (resid   16 and name N and segid A   )    1.0  -37.0   20.0 2

!   16 S  -66.425  -37.927    3.832    5.611    0.118 0.887 25 12 Strong
assign (resid   15 and name C and segid A   ) (resid   16 and name N and segid A   )
       (resid   16 and name CA and segid A  ) (resid   16 and name C and segid A   )    1.0  -66.4   20.0 2
assign (resid   16 and name N and segid A   ) (resid   16 and name CA and segid A  )
       (resid   16 and name C and segid A   ) (resid   17 and name N and segid A   )    1.0  -37.9   20.0 2

!   17 A  -63.753  -40.045    4.717    5.791    0.116 0.875 25 12 Strong
assign (resid   16 and name C and segid A   ) (resid   17 and name N and segid A   )
       (resid   17 and name CA and segid A  ) (resid   17 and name C and segid A   )    1.0  -63.8   20.0 2
assign (resid   17 and name N and segid A   ) (resid   17 and name CA and segid A  )
       (resid   17 and name C and segid A   ) (resid   18 and name N and segid A   )    1.0  -40.0   20.0 2

!   18 L  -64.693  -37.765    5.378    6.381    0.130 0.879 25 11 Strong
assign (resid   17 and name C and segid A   ) (resid   18 and name N and segid A   )
       (resid   18 and name CA and segid A  ) (resid   18 and name C and segid A   )    1.0  -64.7   20.0 2
assign (resid   18 and name N and segid A   ) (resid   18 and name CA and segid A  )
       (resid   18 and name C and segid A   ) (resid   19 and name N and segid A   )    1.0  -37.8   20.0 2

!   19 H  -65.528  -36.962    4.191    5.216    0.134 0.893 25 11 Strong
assign (resid   18 and name C and segid A   ) (resid   19 and name N and segid A   )
       (resid   19 and name CA and segid A  ) (resid   19 and name C and segid A   )    1.0  -65.5   20.0 2
assign (resid   19 and name N and segid A   ) (resid   19 and name CA and segid A  )
       (resid   19 and name C and segid A   ) (resid   20 and name N and segid A   )    1.0  -37.0   20.0 2

!   20 F  -66.499  -39.800    3.561    5.916    0.132 0.898 25 11 Strong
assign (resid   19 and name C and segid A   ) (resid   20 and name N and segid A   )
       (resid   20 and name CA and segid A  ) (resid   20 and name C and segid A   )    1.0  -66.5   20.0 2
assign (resid   20 and name N and segid A   ) (resid   20 and name CA and segid A  )
       (resid   20 and name C and segid A   ) (resid   21 and name N and segid A   )    1.0  -39.8   20.0 2

!   21 M  -63.971  -41.345    3.729    4.270    0.148 0.900 25 12 Strong
assign (resid   20 and name C and segid A   ) (resid   21 and name N and segid A   )
       (resid   21 and name CA and segid A  ) (resid   21 and name C and segid A   )    1.0  -64.0   20.0 2
assign (resid   21 and name N and segid A   ) (resid   21 and name CA and segid A  )
       (resid   21 and name C and segid A   ) (resid   22 and name N and segid A   )    1.0  -41.3   20.0 2

!   22 A  -64.224  -37.754    5.055    4.404    0.140 0.901 25 12 Strong
assign (resid   21 and name C and segid A   ) (resid   22 and name N and segid A   )
       (resid   22 and name CA and segid A  ) (resid   22 and name C and segid A   )    1.0  -64.2   20.0 2
assign (resid   22 and name N and segid A   ) (resid   22 and name CA and segid A  )
       (resid   22 and name C and segid A   ) (resid   23 and name N and segid A   )    1.0  -37.8   20.0 2

!   23 W  -64.863  -41.538    5.036    6.467    0.149 0.907 25 12 Strong
assign (resid   22 and name C and segid A   ) (resid   23 and name N and segid A   )
       (resid   23 and name CA and segid A  ) (resid   23 and name C and segid A   )    1.0  -64.9   20.0 2
assign (resid   23 and name N and segid A   ) (resid   23 and name CA and segid A  )
       (resid   23 and name C and segid A   ) (resid   24 and name N and segid A   )    1.0  -41.5   20.0 2

!   24 T  -66.987  -38.938    3.494    4.692    0.176 0.907 25 12 Strong
assign (resid   23 and name C and segid A   ) (resid   24 and name N and segid A   )
       (resid   24 and name CA and segid A  ) (resid   24 and name C and segid A   )    1.0  -67.0   20.0 2
assign (resid   24 and name N and segid A   ) (resid   24 and name CA and segid A  )
       (resid   24 and name C and segid A   ) (resid   25 and name N and segid A   )    1.0  -38.9   20.0 2

!   25 I  -66.764  -38.829    4.142    4.649    0.260 0.899 25 11 Strong
assign (resid   24 and name C and segid A   ) (resid   25 and name N and segid A   )
       (resid   25 and name CA and segid A  ) (resid   25 and name C and segid A   )    1.0  -66.8   20.0 2
assign (resid   25 and name N and segid A   ) (resid   25 and name CA and segid A  )
       (resid   25 and name C and segid A   ) (resid   26 and name N and segid A   )    1.0  -38.8   20.0 2

!   26 G  -66.292  -26.277    5.656    8.713    0.423 0.888 25 10 Strong
assign (resid   25 and name C and segid A   ) (resid   26 and name N and segid A   )
       (resid   26 and name CA and segid A  ) (resid   26 and name C and segid A   )    1.0  -66.3   20.0 2
assign (resid   26 and name N and segid A   ) (resid   26 and name CA and segid A  )
       (resid   26 and name C and segid A   ) (resid   27 and name N and segid A   )    1.0  -26.3   20.0 2

!   27 H  -84.888  -11.980   12.508   12.724    0.512 0.886 10 10 Generous
assign (resid   26 and name C and segid A   ) (resid   27 and name N and segid A   )
       (resid   27 and name CA and segid A  ) (resid   27 and name C and segid A   )    1.0  -84.9   37.5 2
assign (resid   27 and name N and segid A   ) (resid   27 and name CA and segid A  )
       (resid   27 and name C and segid A   ) (resid   28 and name N and segid A   )    1.0  -12.0   38.2 2

!   28 L  -82.362  132.420   13.066   10.026    0.616 0.894 25 11 Strong
assign (resid   27 and name C and segid A   ) (resid   28 and name N and segid A   )
       (resid   28 and name CA and segid A  ) (resid   28 and name C and segid A   )    1.0  -82.4   26.1 2
assign (resid   28 and name N and segid A   ) (resid   28 and name CA and segid A  )
       (resid   28 and name C and segid A   ) (resid   29 and name N and segid A   )    1.0  132.4   20.1 2

!   29 N -110.369  138.687   14.615    9.544    0.567 0.905 25 12 Strong
assign (resid   28 and name C and segid A   ) (resid   29 and name N and segid A   )
       (resid   29 and name CA and segid A  ) (resid   29 and name C and segid A   )    1.0 -110.4   29.2 2
assign (resid   29 and name N and segid A   ) (resid   29 and name CA and segid A  )
       (resid   29 and name C and segid A   ) (resid   30 and name N and segid A   )    1.0  138.7   20.0 2

!   30 Q -121.296  143.162   12.474   11.345    0.552 0.905 25 12 Strong
assign (resid   29 and name C and segid A   ) (resid   30 and name N and segid A   )
       (resid   30 and name CA and segid A  ) (resid   30 and name C and segid A   )    1.0 -121.3   24.9 2
assign (resid   30 and name N and segid A   ) (resid   30 and name CA and segid A  )
       (resid   30 and name C and segid A   ) (resid   31 and name N and segid A   )    1.0  143.2   22.7 2

!   31 I -125.555  133.187   12.745    8.929    0.490 0.892 25 12 Strong
assign (resid   30 and name C and segid A   ) (resid   31 and name N and segid A   )
       (resid   31 and name CA and segid A  ) (resid   31 and name C and segid A   )    1.0 -125.6   25.5 2
assign (resid   31 and name N and segid A   ) (resid   31 and name CA and segid A  )
       (resid   31 and name C and segid A   ) (resid   32 and name N and segid A   )    1.0  133.2   20.0 2

!   32 K  -93.113  120.342   15.834   13.174    0.501 0.866 25 12 Strong
assign (resid   31 and name C and segid A   ) (resid   32 and name N and segid A   )
       (resid   32 and name CA and segid A  ) (resid   32 and name C and segid A   )    1.0  -93.1   31.7 2
assign (resid   32 and name N and segid A   ) (resid   32 and name CA and segid A  )
       (resid   32 and name C and segid A   ) (resid   33 and name N and segid A   )    1.0  120.3   26.3 2

!   33 R  -71.859  135.002   15.310   12.214    0.602 0.856 25 11 Strong
assign (resid   32 and name C and segid A   ) (resid   33 and name N and segid A   )
       (resid   33 and name CA and segid A  ) (resid   33 and name C and segid A   )    1.0  -71.9   30.6 2
assign (resid   33 and name N and segid A   ) (resid   33 and name CA and segid A  )
       (resid   33 and name C and segid A   ) (resid   34 and name N and segid A   )    1.0  135.0   24.4 2
# Restraints file 2: bm2dihD.tbl

!    3 E  -68.761  148.278   11.026   15.772    0.717 0.818 25  9 Strong
assign (resid    2 and name C and segid D   ) (resid    3 and name N and segid D   )
       (resid    3 and name CA and segid D  ) (resid    3 and name C and segid D   )    1.0  -68.8   22.1 2
assign (resid    3 and name N and segid D   ) (resid    3 and name CA and segid D  )
       (resid    3 and name C and segid D   ) (resid    4 and name N and segid D   )    1.0  148.3   31.5 2

!    4 P  -52.563  -37.709    3.860    5.230    0.507 0.832 25  9 Strong
assign (resid    3 and name C and segid D   ) (resid    4 and name N and segid D   )
       (resid    4 and name CA and segid D  ) (resid    4 and name C and segid D   )    1.0  -52.6   20.0 2
assign (resid    4 and name N and segid D   ) (resid    4 and name CA and segid D  )
       (resid    4 and name C and segid D   ) (resid    5 and name N and segid D   )    1.0  -37.7   20.0 2

!    7 I  -62.214  -37.639    5.245    6.340    0.248 0.888 25 10 Strong
assign (resid    6 and name C and segid D   ) (resid    7 and name N and segid D   )
       (resid    7 and name CA and segid D  ) (resid    7 and name C and segid D   )    1.0  -62.2   20.0 2
assign (resid    7 and name N and segid D   ) (resid    7 and name CA and segid D  )
       (resid    7 and name C and segid D   ) (resid    8 and name N and segid D   )    1.0  -37.6   20.0 2

!    8 L  -65.940  -37.716    4.412    5.084    0.198 0.911 25 12 Strong
assign (resid    7 and name C and segid D   ) (resid    8 and name N and segid D   )
       (resid    8 and name CA and segid D  ) (resid    8 and name C and segid D   )    1.0  -65.9   20.0 2
assign (resid    8 and name N and segid D   ) (resid    8 and name CA and segid D  )
       (resid    8 and name C and segid D   ) (resid    9 and name N and segid D   )    1.0  -37.7   20.0 2

!    9 S  -66.410  -36.378    5.465    5.012    0.142 0.925 25 12 Strong
assign (resid    8 and name C and segid D   ) (resid    9 and name N and segid D   )
       (resid    9 and name CA and segid D  ) (resid    9 and name C and segid D   )    1.0  -66.4   20.0 2
assign (resid    9 and name N and segid D   ) (resid    9 and name CA and segid D  )
       (resid    9 and name C and segid D   ) (resid   10 and name N and segid D   )    1.0  -36.4   20.0 2

!   10 I  -64.917  -40.614    4.296    4.189    0.121 0.927 25 12 Strong
assign (resid    9 and name C and segid D   ) (resid   10 and name N and segid D   )
       (resid   10 and name CA and segid D  ) (resid   10 and name C and segid D   )    1.0  -64.9   20.0 2
assign (resid   10 and name N and segid D   ) (resid   10 and name CA and segid D  )
       (resid   10 and name C and segid D   ) (resid   11 and name N and segid D   )    1.0  -40.6   20.0 2

!   11 C  -61.795  -41.863    3.757    4.623    0.130 0.925 25 12 Strong
assign (resid   10 and name C and segid D   ) (resid   11 and name N and segid D   )
       (resid   11 and name CA and segid D  ) (resid   11 and name C and segid D   )    1.0  -61.8   20.0 2
assign (resid   11 and name N and segid D   ) (resid   11 and name CA and segid D  )
       (resid   11 and name C and segid D   ) (resid   12 and name N and segid D   )    1.0  -41.9   20.0 2

!   12 S  -66.298  -37.990    5.748    5.469    0.116 0.918 25 12 Strong
assign (resid   11 and name C and segid D   ) (resid   12 and name N and segid D   )
       (resid   12 and name CA and segid D  ) (resid   12 and name C and segid D   )    1.0  -66.3   20.0 2
assign (resid   12 and name N and segid D   ) (resid   12 and name CA and segid D  )
       (resid   12 and name C and segid D   ) (resid   13 and name N and segid D   )    1.0  -38.0   20.0 2

!   13 F  -63.484  -43.655    3.803    5.126    0.116 0.911 25 12 Strong
assign (resid   12 and name C and segid D   ) (resid   13 and name N and segid D   )
       (resid   13 and name CA and segid D  ) (resid   13 and name C and segid D   )    1.0  -63.5   20.0 2
assign (resid   13 and name N and segid D   ) (resid   13 and name CA and segid D  )
       (resid   13 and name C and segid D   ) (resid   14 and name N and segid D   )    1.0  -43.7   20.0 2

!   14 I  -65.192  -39.945    5.159    4.978    0.119 0.910 25 12 Strong
assign (resid   13 and name C and segid D   ) (resid   14 and name N and segid D   )
       (resid   14 and name CA and segid D  ) (resid   14 and name C and segid D   )    1.0  -65.2   20.0 2
assign (resid   14 and name N and segid D   ) (resid   14 and name CA and segid D  )
       (resid   14 and name C and segid D   ) (resid   15 and name N and segid D   )    1.0  -39.9   20.0 2

!   15 L  -66.110  -37.007    5.959    5.698    0.102 0.901 25 12 Strong
assign (resid   14 and name C and segid D   ) (resid   15 and name N and segid D   )
       (resid   15 and name CA and segid D  ) (resid   15 and name C and segid D   )    1.0  -66.1   20.0 2
assign (resid   15 and name N and segid D   ) (resid   15 and name CA and segid D  )
       (resid   15 and name C and segid D   ) (resid   16 and name N and segid D   )    1.0  -37.0   20.0 2

!   16 S  -66.425  -37.927    3.832    5.611    0.118 0.887 25 12 Strong
assign (resid   15 and name C and segid D   ) (resid   16 and name N and segid D   )
       (resid   16 and name CA and segid D  ) (resid   16 and name C and segid D   )    1.0  -66.4   20.0 2
assign (resid   16 and name N and segid D   ) (resid   16 and name CA and segid D  )
       (resid   16 and name C and segid D   ) (resid   17 and name N and segid D   )    1.0  -37.9   20.0 2

!   17 A  -63.753  -40.045    4.717    5.791    0.116 0.875 25 12 Strong
assign (resid   16 and name C and segid D   ) (resid   17 and name N and segid D   )
       (resid   17 and name CA and segid D  ) (resid   17 and name C and segid D   )    1.0  -63.8   20.0 2
assign (resid   17 and name N and segid D   ) (resid   17 and name CA and segid D  )
       (resid   17 and name C and segid D   ) (resid   18 and name N and segid D   )    1.0  -40.0   20.0 2

!   18 L  -64.693  -37.765    5.378    6.381    0.130 0.879 25 11 Strong
assign (resid   17 and name C and segid D   ) (resid   18 and name N and segid D   )
       (resid   18 and name CA and segid D  ) (resid   18 and name C and segid D   )    1.0  -64.7   20.0 2
assign (resid   18 and name N and segid D   ) (resid   18 and name CA and segid D  )
       (resid   18 and name C and segid D   ) (resid   19 and name N and segid D   )    1.0  -37.8   20.0 2

!   19 H  -65.528  -36.962    4.191    5.216    0.134 0.893 25 11 Strong
assign (resid   18 and name C and segid D   ) (resid   19 and name N and segid D   )
       (resid   19 and name CA and segid D  ) (resid   19 and name C and segid D   )    1.0  -65.5   20.0 2
assign (resid   19 and name N and segid D   ) (resid   19 and name CA and segid D  )
       (resid   19 and name C and segid D   ) (resid   20 and name N and segid D   )    1.0  -37.0   20.0 2

!   20 F  -66.499  -39.800    3.561    5.916    0.132 0.898 25 11 Strong
assign (resid   19 and name C and segid D   ) (resid   20 and name N and segid D   )
       (resid   20 and name CA and segid D  ) (resid   20 and name C and segid D   )    1.0  -66.5   20.0 2
assign (resid   20 and name N and segid D   ) (resid   20 and name CA and segid D  )
       (resid   20 and name C and segid D   ) (resid   21 and name N and segid D   )    1.0  -39.8   20.0 2

!   21 M  -63.971  -41.345    3.729    4.270    0.148 0.900 25 12 Strong
assign (resid   20 and name C and segid D   ) (resid   21 and name N and segid D   )
       (resid   21 and name CA and segid D  ) (resid   21 and name C and segid D   )    1.0  -64.0   20.0 2
assign (resid   21 and name N and segid D   ) (resid   21 and name CA and segid D  )
       (resid   21 and name C and segid D   ) (resid   22 and name N and segid D   )    1.0  -41.3   20.0 2

!   22 A  -64.224  -37.754    5.055    4.404    0.140 0.901 25 12 Strong
assign (resid   21 and name C and segid D   ) (resid   22 and name N and segid D   )
       (resid   22 and name CA and segid D  ) (resid   22 and name C and segid D   )    1.0  -64.2   20.0 2
assign (resid   22 and name N and segid D   ) (resid   22 and name CA and segid D  )
       (resid   22 and name C and segid D   ) (resid   23 and name N and segid D   )    1.0  -37.8   20.0 2

!   23 W  -64.863  -41.538    5.036    6.467    0.149 0.907 25 12 Strong
assign (resid   22 and name C and segid D   ) (resid   23 and name N and segid D   )
       (resid   23 and name CA and segid D  ) (resid   23 and name C and segid D   )    1.0  -64.9   20.0 2
assign (resid   23 and name N and segid D   ) (resid   23 and name CA and segid D  )
       (resid   23 and name C and segid D   ) (resid   24 and name N and segid D   )    1.0  -41.5   20.0 2

!   24 T  -66.987  -38.938    3.494    4.692    0.176 0.907 25 12 Strong
assign (resid   23 and name C and segid D   ) (resid   24 and name N and segid D   )
       (resid   24 and name CA and segid D  ) (resid   24 and name C and segid D   )    1.0  -67.0   20.0 2
assign (resid   24 and name N and segid D   ) (resid   24 and name CA and segid D  )
       (resid   24 and name C and segid D   ) (resid   25 and name N and segid D   )    1.0  -38.9   20.0 2

!   25 I  -66.764  -38.829    4.142    4.649    0.260 0.899 25 11 Strong
assign (resid   24 and name C and segid D   ) (resid   25 and name N and segid D   )
       (resid   25 and name CA and segid D  ) (resid   25 and name C and segid D   )    1.0  -66.8   20.0 2
assign (resid   25 and name N and segid D   ) (resid   25 and name CA and segid D  )
       (resid   25 and name C and segid D   ) (resid   26 and name N and segid D   )    1.0  -38.8   20.0 2

!   26 G  -66.292  -26.277    5.656    8.713    0.423 0.888 25 10 Strong
assign (resid   25 and name C and segid D   ) (resid   26 and name N and segid D   )
       (resid   26 and name CA and segid D  ) (resid   26 and name C and segid D   )    1.0  -66.3   20.0 2
assign (resid   26 and name N and segid D   ) (resid   26 and name CA and segid D  )
       (resid   26 and name C and segid D   ) (resid   27 and name N and segid D   )    1.0  -26.3   20.0 2

!   27 H  -84.888  -11.980   12.508   12.724    0.512 0.886 10 10 Generous
assign (resid   26 and name C and segid D   ) (resid   27 and name N and segid D   )
       (resid   27 and name CA and segid D  ) (resid   27 and name C and segid D   )    1.0  -84.9   37.5 2
assign (resid   27 and name N and segid D   ) (resid   27 and name CA and segid D  )
       (resid   27 and name C and segid D   ) (resid   28 and name N and segid D   )    1.0  -12.0   38.2 2

!   28 L  -82.362  132.420   13.066   10.026    0.616 0.894 25 11 Strong
assign (resid   27 and name C and segid D   ) (resid   28 and name N and segid D   )
       (resid   28 and name CA and segid D  ) (resid   28 and name C and segid D   )    1.0  -82.4   26.1 2
assign (resid   28 and name N and segid D   ) (resid   28 and name CA and segid D  )
       (resid   28 and name C and segid D   ) (resid   29 and name N and segid D   )    1.0  132.4   20.1 2

!   29 N -110.369  138.687   14.615    9.544    0.567 0.905 25 12 Strong
assign (resid   28 and name C and segid D   ) (resid   29 and name N and segid D   )
       (resid   29 and name CA and segid D  ) (resid   29 and name C and segid D   )    1.0 -110.4   29.2 2
assign (resid   29 and name N and segid D   ) (resid   29 and name CA and segid D  )
       (resid   29 and name C and segid D   ) (resid   30 and name N and segid D   )    1.0  138.7   20.0 2

!   30 Q -121.296  143.162   12.474   11.345    0.552 0.905 25 12 Strong
assign (resid   29 and name C and segid D   ) (resid   30 and name N and segid D   )
       (resid   30 and name CA and segid D  ) (resid   30 and name C and segid D   )    1.0 -121.3   24.9 2
assign (resid   30 and name N and segid D   ) (resid   30 and name CA and segid D  )
       (resid   30 and name C and segid D   ) (resid   31 and name N and segid D   )    1.0  143.2   22.7 2

!   31 I -125.555  133.187   12.745    8.929    0.490 0.892 25 12 Strong
assign (resid   30 and name C and segid D   ) (resid   31 and name N and segid D   )
       (resid   31 and name CA and segid D  ) (resid   31 and name C and segid D   )    1.0 -125.6   25.5 2
assign (resid   31 and name N and segid D   ) (resid   31 and name CA and segid D  )
       (resid   31 and name C and segid D   ) (resid   32 and name N and segid D   )    1.0  133.2   20.0 2

!   32 K  -93.113  120.342   15.834   13.174    0.501 0.866 25 12 Strong
assign (resid   31 and name C and segid D   ) (resid   32 and name N and segid D   )
       (resid   32 and name CA and segid D  ) (resid   32 and name C and segid D   )    1.0  -93.1   31.7 2
assign (resid   32 and name N and segid D   ) (resid   32 and name CA and segid D  )
       (resid   32 and name C and segid D   ) (resid   33 and name N and segid D   )    1.0  120.3   26.3 2

!   33 R  -71.859  135.002   15.310   12.214    0.602 0.856 25 11 Strong
assign (resid   32 and name C and segid D   ) (resid   33 and name N and segid D   )
       (resid   33 and name CA and segid D  ) (resid   33 and name C and segid D   )    1.0  -71.9   30.6 2
assign (resid   33 and name N and segid D   ) (resid   33 and name CA and segid D  )
       (resid   33 and name C and segid D   ) (resid   34 and name N and segid D   )    1.0  135.0   24.4 2
# Restraints file 3: bm2dihB.tbl

!    3 E  -68.761  148.278   11.026   15.772    0.717 0.818 25  9 Strong
assign (resid    2 and name C and segid B   ) (resid    3 and name N and segid B   )
       (resid    3 and name CA and segid B  ) (resid    3 and name C and segid B   )    1.0  -68.8   22.1 2
assign (resid    3 and name N and segid B   ) (resid    3 and name CA and segid B  )
       (resid    3 and name C and segid B   ) (resid    4 and name N and segid B   )    1.0  148.3   31.5 2

!    4 P  -52.563  -37.709    3.860    5.230    0.507 0.832 25  9 Strong
assign (resid    3 and name C and segid B   ) (resid    4 and name N and segid B   )
       (resid    4 and name CA and segid B  ) (resid    4 and name C and segid B   )    1.0  -52.6   20.0 2
assign (resid    4 and name N and segid B   ) (resid    4 and name CA and segid B  )
       (resid    4 and name C and segid B   ) (resid    5 and name N and segid B   )    1.0  -37.7   20.0 2

!    7 I  -62.214  -37.639    5.245    6.340    0.248 0.888 25 10 Strong
assign (resid    6 and name C and segid B   ) (resid    7 and name N and segid B   )
       (resid    7 and name CA and segid B  ) (resid    7 and name C and segid B   )    1.0  -62.2   20.0 2
assign (resid    7 and name N and segid B   ) (resid    7 and name CA and segid B  )
       (resid    7 and name C and segid B   ) (resid    8 and name N and segid B   )    1.0  -37.6   20.0 2

!    8 L  -65.940  -37.716    4.412    5.084    0.198 0.911 25 12 Strong
assign (resid    7 and name C and segid B   ) (resid    8 and name N and segid B   )
       (resid    8 and name CA and segid B  ) (resid    8 and name C and segid B   )    1.0  -65.9   20.0 2
assign (resid    8 and name N and segid B   ) (resid    8 and name CA and segid B  )
       (resid    8 and name C and segid B   ) (resid    9 and name N and segid B   )    1.0  -37.7   20.0 2

!    9 S  -66.410  -36.378    5.465    5.012    0.142 0.925 25 12 Strong
assign (resid    8 and name C and segid B   ) (resid    9 and name N and segid B   )
       (resid    9 and name CA and segid B  ) (resid    9 and name C and segid B   )    1.0  -66.4   20.0 2
assign (resid    9 and name N and segid B   ) (resid    9 and name CA and segid B  )
       (resid    9 and name C and segid B   ) (resid   10 and name N and segid B   )    1.0  -36.4   20.0 2

!   10 I  -64.917  -40.614    4.296    4.189    0.121 0.927 25 12 Strong
assign (resid    9 and name C and segid B   ) (resid   10 and name N and segid B   )
       (resid   10 and name CA and segid B  ) (resid   10 and name C and segid B   )    1.0  -64.9   20.0 2
assign (resid   10 and name N and segid B   ) (resid   10 and name CA and segid B  )
       (resid   10 and name C and segid B   ) (resid   11 and name N and segid B   )    1.0  -40.6   20.0 2

!   11 C  -61.795  -41.863    3.757    4.623    0.130 0.925 25 12 Strong
assign (resid   10 and name C and segid B   ) (resid   11 and name N and segid B   )
       (resid   11 and name CA and segid B  ) (resid   11 and name C and segid B   )    1.0  -61.8   20.0 2
assign (resid   11 and name N and segid B   ) (resid   11 and name CA and segid B  )
       (resid   11 and name C and segid B   ) (resid   12 and name N and segid B   )    1.0  -41.9   20.0 2

!   12 S  -66.298  -37.990    5.748    5.469    0.116 0.918 25 12 Strong
assign (resid   11 and name C and segid B   ) (resid   12 and name N and segid B   )
       (resid   12 and name CA and segid B  ) (resid   12 and name C and segid B   )    1.0  -66.3   20.0 2
assign (resid   12 and name N and segid B   ) (resid   12 and name CA and segid B  )
       (resid   12 and name C and segid B   ) (resid   13 and name N and segid B   )    1.0  -38.0   20.0 2

!   13 F  -63.484  -43.655    3.803    5.126    0.116 0.911 25 12 Strong
assign (resid   12 and name C and segid B   ) (resid   13 and name N and segid B   )
       (resid   13 and name CA and segid B  ) (resid   13 and name C and segid B   )    1.0  -63.5   20.0 2
assign (resid   13 and name N and segid B   ) (resid   13 and name CA and segid B  )
       (resid   13 and name C and segid B   ) (resid   14 and name N and segid B   )    1.0  -43.7   20.0 2

!   14 I  -65.192  -39.945    5.159    4.978    0.119 0.910 25 12 Strong
assign (resid   13 and name C and segid B   ) (resid   14 and name N and segid B   )
       (resid   14 and name CA and segid B  ) (resid   14 and name C and segid B   )    1.0  -65.2   20.0 2
assign (resid   14 and name N and segid B   ) (resid   14 and name CA and segid B  )
       (resid   14 and name C and segid B   ) (resid   15 and name N and segid B   )    1.0  -39.9   20.0 2

!   15 L  -66.110  -37.007    5.959    5.698    0.102 0.901 25 12 Strong
assign (resid   14 and name C and segid B   ) (resid   15 and name N and segid B   )
       (resid   15 and name CA and segid B  ) (resid   15 and name C and segid B   )    1.0  -66.1   20.0 2
assign (resid   15 and name N and segid B   ) (resid   15 and name CA and segid B  )
       (resid   15 and name C and segid B   ) (resid   16 and name N and segid B   )    1.0  -37.0   20.0 2

!   16 S  -66.425  -37.927    3.832    5.611    0.118 0.887 25 12 Strong
assign (resid   15 and name C and segid B   ) (resid   16 and name N and segid B   )
       (resid   16 and name CA and segid B  ) (resid   16 and name C and segid B   )    1.0  -66.4   20.0 2
assign (resid   16 and name N and segid B   ) (resid   16 and name CA and segid B  )
       (resid   16 and name C and segid B   ) (resid   17 and name N and segid B   )    1.0  -37.9   20.0 2

!   17 A  -63.753  -40.045    4.717    5.791    0.116 0.875 25 12 Strong
assign (resid   16 and name C and segid B   ) (resid   17 and name N and segid B   )
       (resid   17 and name CA and segid B  ) (resid   17 and name C and segid B   )    1.0  -63.8   20.0 2
assign (resid   17 and name N and segid B   ) (resid   17 and name CA and segid B  )
       (resid   17 and name C and segid B   ) (resid   18 and name N and segid B   )    1.0  -40.0   20.0 2

!   18 L  -64.693  -37.765    5.378    6.381    0.130 0.879 25 11 Strong
assign (resid   17 and name C and segid B   ) (resid   18 and name N and segid B   )
       (resid   18 and name CA and segid B  ) (resid   18 and name C and segid B   )    1.0  -64.7   20.0 2
assign (resid   18 and name N and segid B   ) (resid   18 and name CA and segid B  )
       (resid   18 and name C and segid B   ) (resid   19 and name N and segid B   )    1.0  -37.8   20.0 2

!   19 H  -65.528  -36.962    4.191    5.216    0.134 0.893 25 11 Strong
assign (resid   18 and name C and segid B   ) (resid   19 and name N and segid B   )
       (resid   19 and name CA and segid B  ) (resid   19 and name C and segid B   )    1.0  -65.5   20.0 2
assign (resid   19 and name N and segid B   ) (resid   19 and name CA and segid B  )
       (resid   19 and name C and segid B   ) (resid   20 and name N and segid B   )    1.0  -37.0   20.0 2

!   20 F  -66.499  -39.800    3.561    5.916    0.132 0.898 25 11 Strong
assign (resid   19 and name C and segid B   ) (resid   20 and name N and segid B   )
       (resid   20 and name CA and segid B  ) (resid   20 and name C and segid B   )    1.0  -66.5   20.0 2
assign (resid   20 and name N and segid B   ) (resid   20 and name CA and segid B  )
       (resid   20 and name C and segid B   ) (resid   21 and name N and segid B   )    1.0  -39.8   20.0 2

!   21 M  -63.971  -41.345    3.729    4.270    0.148 0.900 25 12 Strong
assign (resid   20 and name C and segid B   ) (resid   21 and name N and segid B   )
       (resid   21 and name CA and segid B  ) (resid   21 and name C and segid B   )    1.0  -64.0   20.0 2
assign (resid   21 and name N and segid B   ) (resid   21 and name CA and segid B  )
       (resid   21 and name C and segid B   ) (resid   22 and name N and segid B   )    1.0  -41.3   20.0 2

!   22 A  -64.224  -37.754    5.055    4.404    0.140 0.901 25 12 Strong
assign (resid   21 and name C and segid B   ) (resid   22 and name N and segid B   )
       (resid   22 and name CA and segid B  ) (resid   22 and name C and segid B   )    1.0  -64.2   20.0 2
assign (resid   22 and name N and segid B   ) (resid   22 and name CA and segid B  )
       (resid   22 and name C and segid B   ) (resid   23 and name N and segid B   )    1.0  -37.8   20.0 2

!   23 W  -64.863  -41.538    5.036    6.467    0.149 0.907 25 12 Strong
assign (resid   22 and name C and segid B   ) (resid   23 and name N and segid B   )
       (resid   23 and name CA and segid B  ) (resid   23 and name C and segid B   )    1.0  -64.9   20.0 2
assign (resid   23 and name N and segid B   ) (resid   23 and name CA and segid B  )
       (resid   23 and name C and segid B   ) (resid   24 and name N and segid B   )    1.0  -41.5   20.0 2

!   24 T  -66.987  -38.938    3.494    4.692    0.176 0.907 25 12 Strong
assign (resid   23 and name C and segid B   ) (resid   24 and name N and segid B   )
       (resid   24 and name CA and segid B  ) (resid   24 and name C and segid B   )    1.0  -67.0   20.0 2
assign (resid   24 and name N and segid B   ) (resid   24 and name CA and segid B  )
       (resid   24 and name C and segid B   ) (resid   25 and name N and segid B   )    1.0  -38.9   20.0 2

!   25 I  -66.764  -38.829    4.142    4.649    0.260 0.899 25 11 Strong
assign (resid   24 and name C and segid B   ) (resid   25 and name N and segid B   )
       (resid   25 and name CA and segid B  ) (resid   25 and name C and segid B   )    1.0  -66.8   20.0 2
assign (resid   25 and name N and segid B   ) (resid   25 and name CA and segid B  )
       (resid   25 and name C and segid B   ) (resid   26 and name N and segid B   )    1.0  -38.8   20.0 2

!   26 G  -66.292  -26.277    5.656    8.713    0.423 0.888 25 10 Strong
assign (resid   25 and name C and segid B   ) (resid   26 and name N and segid B   )
       (resid   26 and name CA and segid B  ) (resid   26 and name C and segid B   )    1.0  -66.3   20.0 2
assign (resid   26 and name N and segid B   ) (resid   26 and name CA and segid B  )
       (resid   26 and name C and segid B   ) (resid   27 and name N and segid B   )    1.0  -26.3   20.0 2

!   27 H  -84.888  -11.980   12.508   12.724    0.512 0.886 10 10 Generous
assign (resid   26 and name C and segid B   ) (resid   27 and name N and segid B   )
       (resid   27 and name CA and segid B  ) (resid   27 and name C and segid B   )    1.0  -84.9   37.5 2
assign (resid   27 and name N and segid B   ) (resid   27 and name CA and segid B  )
       (resid   27 and name C and segid B   ) (resid   28 and name N and segid B   )    1.0  -12.0   38.2 2

!   28 L  -82.362  132.420   13.066   10.026    0.616 0.894 25 11 Strong
assign (resid   27 and name C and segid B   ) (resid   28 and name N and segid B   )
       (resid   28 and name CA and segid B  ) (resid   28 and name C and segid B   )    1.0  -82.4   26.1 2
assign (resid   28 and name N and segid B   ) (resid   28 and name CA and segid B  )
       (resid   28 and name C and segid B   ) (resid   29 and name N and segid B   )    1.0  132.4   20.1 2

!   29 N -110.369  138.687   14.615    9.544    0.567 0.905 25 12 Strong
assign (resid   28 and name C and segid B   ) (resid   29 and name N and segid B   )
       (resid   29 and name CA and segid B  ) (resid   29 and name C and segid B   )    1.0 -110.4   29.2 2
assign (resid   29 and name N and segid B   ) (resid   29 and name CA and segid B  )
       (resid   29 and name C and segid B   ) (resid   30 and name N and segid B   )    1.0  138.7   20.0 2

!   30 Q -121.296  143.162   12.474   11.345    0.552 0.905 25 12 Strong
assign (resid   29 and name C and segid B   ) (resid   30 and name N and segid B   )
       (resid   30 and name CA and segid B  ) (resid   30 and name C and segid B   )    1.0 -121.3   24.9 2
assign (resid   30 and name N and segid B   ) (resid   30 and name CA and segid B  )
       (resid   30 and name C and segid B   ) (resid   31 and name N and segid B   )    1.0  143.2   22.7 2

!   31 I -125.555  133.187   12.745    8.929    0.490 0.892 25 12 Strong
assign (resid   30 and name C and segid B   ) (resid   31 and name N and segid B   )
       (resid   31 and name CA and segid B  ) (resid   31 and name C and segid B   )    1.0 -125.6   25.5 2
assign (resid   31 and name N and segid B   ) (resid   31 and name CA and segid B  )
       (resid   31 and name C and segid B   ) (resid   32 and name N and segid B   )    1.0  133.2   20.0 2

!   32 K  -93.113  120.342   15.834   13.174    0.501 0.866 25 12 Strong
assign (resid   31 and name C and segid B   ) (resid   32 and name N and segid B   )
       (resid   32 and name CA and segid B  ) (resid   32 and name C and segid B   )    1.0  -93.1   31.7 2
assign (resid   32 and name N and segid B   ) (resid   32 and name CA and segid B  )
       (resid   32 and name C and segid B   ) (resid   33 and name N and segid B   )    1.0  120.3   26.3 2

!   33 R  -71.859  135.002   15.310   12.214    0.602 0.856 25 11 Strong
assign (resid   32 and name C and segid B   ) (resid   33 and name N and segid B   )
       (resid   33 and name CA and segid B  ) (resid   33 and name C and segid B   )    1.0  -71.9   30.6 2
assign (resid   33 and name N and segid B   ) (resid   33 and name CA and segid B  )
       (resid   33 and name C and segid B   ) (resid   34 and name N and segid B   )    1.0  135.0   24.4 2
# Restraints file 4: bm2dihC.tbl

!    3 E  -68.761  148.278   11.026   15.772    0.717 0.818 25  9 Strong
assign (resid    2 and name C and segid C   ) (resid    3 and name N and segid C   )
       (resid    3 and name CA and segid C  ) (resid    3 and name C and segid C   )    1.0  -68.8   22.1 2
assign (resid    3 and name N and segid C   ) (resid    3 and name CA and segid C  )
       (resid    3 and name C and segid C   ) (resid    4 and name N and segid C   )    1.0  148.3   31.5 2

!    4 P  -52.563  -37.709    3.860    5.230    0.507 0.832 25  9 Strong
assign (resid    3 and name C and segid C   ) (resid    4 and name N and segid C   )
       (resid    4 and name CA and segid C  ) (resid    4 and name C and segid C   )    1.0  -52.6   20.0 2
assign (resid    4 and name N and segid C   ) (resid    4 and name CA and segid C  )
       (resid    4 and name C and segid C   ) (resid    5 and name N and segid C   )    1.0  -37.7   20.0 2

!    7 I  -62.214  -37.639    5.245    6.340    0.248 0.888 25 10 Strong
assign (resid    6 and name C and segid C   ) (resid    7 and name N and segid C   )
       (resid    7 and name CA and segid C  ) (resid    7 and name C and segid C   )    1.0  -62.2   20.0 2
assign (resid    7 and name N and segid C   ) (resid    7 and name CA and segid C  )
       (resid    7 and name C and segid C   ) (resid    8 and name N and segid C   )    1.0  -37.6   20.0 2

!    8 L  -65.940  -37.716    4.412    5.084    0.198 0.911 25 12 Strong
assign (resid    7 and name C and segid C   ) (resid    8 and name N and segid C   )
       (resid    8 and name CA and segid C  ) (resid    8 and name C and segid C   )    1.0  -65.9   20.0 2
assign (resid    8 and name N and segid C   ) (resid    8 and name CA and segid C  )
       (resid    8 and name C and segid C   ) (resid    9 and name N and segid C   )    1.0  -37.7   20.0 2

!    9 S  -66.410  -36.378    5.465    5.012    0.142 0.925 25 12 Strong
assign (resid    8 and name C and segid C   ) (resid    9 and name N and segid C   )
       (resid    9 and name CA and segid C  ) (resid    9 and name C and segid C   )    1.0  -66.4   20.0 2
assign (resid    9 and name N and segid C   ) (resid    9 and name CA and segid C  )
       (resid    9 and name C and segid C   ) (resid   10 and name N and segid C   )    1.0  -36.4   20.0 2

!   10 I  -64.917  -40.614    4.296    4.189    0.121 0.927 25 12 Strong
assign (resid    9 and name C and segid C   ) (resid   10 and name N and segid C   )
       (resid   10 and name CA and segid C  ) (resid   10 and name C and segid C   )    1.0  -64.9   20.0 2
assign (resid   10 and name N and segid C   ) (resid   10 and name CA and segid C  )
       (resid   10 and name C and segid C   ) (resid   11 and name N and segid C   )    1.0  -40.6   20.0 2

!   11 C  -61.795  -41.863    3.757    4.623    0.130 0.925 25 12 Strong
assign (resid   10 and name C and segid C   ) (resid   11 and name N and segid C   )
       (resid   11 and name CA and segid C  ) (resid   11 and name C and segid C   )    1.0  -61.8   20.0 2
assign (resid   11 and name N and segid C   ) (resid   11 and name CA and segid C  )
       (resid   11 and name C and segid C   ) (resid   12 and name N and segid C   )    1.0  -41.9   20.0 2

!   12 S  -66.298  -37.990    5.748    5.469    0.116 0.918 25 12 Strong
assign (resid   11 and name C and segid C   ) (resid   12 and name N and segid C   )
       (resid   12 and name CA and segid C  ) (resid   12 and name C and segid C   )    1.0  -66.3   20.0 2
assign (resid   12 and name N and segid C   ) (resid   12 and name CA and segid C  )
       (resid   12 and name C and segid C   ) (resid   13 and name N and segid C   )    1.0  -38.0   20.0 2

!   13 F  -63.484  -43.655    3.803    5.126    0.116 0.911 25 12 Strong
assign (resid   12 and name C and segid C   ) (resid   13 and name N and segid C   )
       (resid   13 and name CA and segid C  ) (resid   13 and name C and segid C   )    1.0  -63.5   20.0 2
assign (resid   13 and name N and segid C   ) (resid   13 and name CA and segid C  )
       (resid   13 and name C and segid C   ) (resid   14 and name N and segid C   )    1.0  -43.7   20.0 2

!   14 I  -65.192  -39.945    5.159    4.978    0.119 0.910 25 12 Strong
assign (resid   13 and name C and segid C   ) (resid   14 and name N and segid C   )
       (resid   14 and name CA and segid C  ) (resid   14 and name C and segid C   )    1.0  -65.2   20.0 2
assign (resid   14 and name N and segid C   ) (resid   14 and name CA and segid C  )
       (resid   14 and name C and segid C   ) (resid   15 and name N and segid C   )    1.0  -39.9   20.0 2

!   15 L  -66.110  -37.007    5.959    5.698    0.102 0.901 25 12 Strong
assign (resid   14 and name C and segid C   ) (resid   15 and name N and segid C   )
       (resid   15 and name CA and segid C  ) (resid   15 and name C and segid C   )    1.0  -66.1   20.0 2
assign (resid   15 and name N and segid C   ) (resid   15 and name CA and segid C  )
       (resid   15 and name C and segid C   ) (resid   16 and name N and segid C   )    1.0  -37.0   20.0 2

!   16 S  -66.425  -37.927    3.832    5.611    0.118 0.887 25 12 Strong
assign (resid   15 and name C and segid C   ) (resid   16 and name N and segid C   )
       (resid   16 and name CA and segid C  ) (resid   16 and name C and segid C   )    1.0  -66.4   20.0 2
assign (resid   16 and name N and segid C   ) (resid   16 and name CA and segid C  )
       (resid   16 and name C and segid C   ) (resid   17 and name N and segid C   )    1.0  -37.9   20.0 2

!   17 A  -63.753  -40.045    4.717    5.791    0.116 0.875 25 12 Strong
assign (resid   16 and name C and segid C   ) (resid   17 and name N and segid C   )
       (resid   17 and name CA and segid C  ) (resid   17 and name C and segid C   )    1.0  -63.8   20.0 2
assign (resid   17 and name N and segid C   ) (resid   17 and name CA and segid C  )
       (resid   17 and name C and segid C   ) (resid   18 and name N and segid C   )    1.0  -40.0   20.0 2

!   18 L  -64.693  -37.765    5.378    6.381    0.130 0.879 25 11 Strong
assign (resid   17 and name C and segid C   ) (resid   18 and name N and segid C   )
       (resid   18 and name CA and segid C  ) (resid   18 and name C and segid C   )    1.0  -64.7   20.0 2
assign (resid   18 and name N and segid C   ) (resid   18 and name CA and segid C  )
       (resid   18 and name C and segid C   ) (resid   19 and name N and segid C   )    1.0  -37.8   20.0 2

!   19 H  -65.528  -36.962    4.191    5.216    0.134 0.893 25 11 Strong
assign (resid   18 and name C and segid C   ) (resid   19 and name N and segid C   )
       (resid   19 and name CA and segid C  ) (resid   19 and name C and segid C   )    1.0  -65.5   20.0 2
assign (resid   19 and name N and segid C   ) (resid   19 and name CA and segid C  )
       (resid   19 and name C and segid C   ) (resid   20 and name N and segid C   )    1.0  -37.0   20.0 2

!   20 F  -66.499  -39.800    3.561    5.916    0.132 0.898 25 11 Strong
assign (resid   19 and name C and segid C   ) (resid   20 and name N and segid C   )
       (resid   20 and name CA and segid C  ) (resid   20 and name C and segid C   )    1.0  -66.5   20.0 2
assign (resid   20 and name N and segid C   ) (resid   20 and name CA and segid C  )
       (resid   20 and name C and segid C   ) (resid   21 and name N and segid C   )    1.0  -39.8   20.0 2

!   21 M  -63.971  -41.345    3.729    4.270    0.148 0.900 25 12 Strong
assign (resid   20 and name C and segid C   ) (resid   21 and name N and segid C   )
       (resid   21 and name CA and segid C  ) (resid   21 and name C and segid C   )    1.0  -64.0   20.0 2
assign (resid   21 and name N and segid C   ) (resid   21 and name CA and segid C  )
       (resid   21 and name C and segid C   ) (resid   22 and name N and segid C   )    1.0  -41.3   20.0 2

!   22 A  -64.224  -37.754    5.055    4.404    0.140 0.901 25 12 Strong
assign (resid   21 and name C and segid C   ) (resid   22 and name N and segid C   )
       (resid   22 and name CA and segid C  ) (resid   22 and name C and segid C   )    1.0  -64.2   20.0 2
assign (resid   22 and name N and segid C   ) (resid   22 and name CA and segid C  )
       (resid   22 and name C and segid C   ) (resid   23 and name N and segid C   )    1.0  -37.8   20.0 2

!   23 W  -64.863  -41.538    5.036    6.467    0.149 0.907 25 12 Strong
assign (resid   22 and name C and segid C   ) (resid   23 and name N and segid C   )
       (resid   23 and name CA and segid C  ) (resid   23 and name C and segid C   )    1.0  -64.9   20.0 2
assign (resid   23 and name N and segid C   ) (resid   23 and name CA and segid C  )
       (resid   23 and name C and segid C   ) (resid   24 and name N and segid C   )    1.0  -41.5   20.0 2

!   24 T  -66.987  -38.938    3.494    4.692    0.176 0.907 25 12 Strong
assign (resid   23 and name C and segid C   ) (resid   24 and name N and segid C   )
       (resid   24 and name CA and segid C  ) (resid   24 and name C and segid C   )    1.0  -67.0   20.0 2
assign (resid   24 and name N and segid C   ) (resid   24 and name CA and segid C  )
       (resid   24 and name C and segid C   ) (resid   25 and name N and segid C   )    1.0  -38.9   20.0 2

!   25 I  -66.764  -38.829    4.142    4.649    0.260 0.899 25 11 Strong
assign (resid   24 and name C and segid C   ) (resid   25 and name N and segid C   )
       (resid   25 and name CA and segid C  ) (resid   25 and name C and segid C   )    1.0  -66.8   20.0 2
assign (resid   25 and name N and segid C   ) (resid   25 and name CA and segid C  )
       (resid   25 and name C and segid C   ) (resid   26 and name N and segid C   )    1.0  -38.8   20.0 2

!   26 G  -66.292  -26.277    5.656    8.713    0.423 0.888 25 10 Strong
assign (resid   25 and name C and segid C   ) (resid   26 and name N and segid C   )
       (resid   26 and name CA and segid C  ) (resid   26 and name C and segid C   )    1.0  -66.3   20.0 2
assign (resid   26 and name N and segid C   ) (resid   26 and name CA and segid C  )
       (resid   26 and name C and segid C   ) (resid   27 and name N and segid C   )    1.0  -26.3   20.0 2

!   27 H  -84.888  -11.980   12.508   12.724    0.512 0.886 10 10 Generous
assign (resid   26 and name C and segid C   ) (resid   27 and name N and segid C   )
       (resid   27 and name CA and segid C  ) (resid   27 and name C and segid C   )    1.0  -84.9   37.5 2
assign (resid   27 and name N and segid C   ) (resid   27 and name CA and segid C  )
       (resid   27 and name C and segid C   ) (resid   28 and name N and segid C   )    1.0  -12.0   38.2 2

!   28 L  -82.362  132.420   13.066   10.026    0.616 0.894 25 11 Strong
assign (resid   27 and name C and segid C   ) (resid   28 and name N and segid C   )
       (resid   28 and name CA and segid C  ) (resid   28 and name C and segid C   )    1.0  -82.4   26.1 2
assign (resid   28 and name N and segid C   ) (resid   28 and name CA and segid C  )
       (resid   28 and name C and segid C   ) (resid   29 and name N and segid C   )    1.0  132.4   20.1 2

!   29 N -110.369  138.687   14.615    9.544    0.567 0.905 25 12 Strong
assign (resid   28 and name C and segid C   ) (resid   29 and name N and segid C   )
       (resid   29 and name CA and segid C  ) (resid   29 and name C and segid C   )    1.0 -110.4   29.2 2
assign (resid   29 and name N and segid C   ) (resid   29 and name CA and segid C  )
       (resid   29 and name C and segid C   ) (resid   30 and name N and segid C   )    1.0  138.7   20.0 2

!   30 Q -121.296  143.162   12.474   11.345    0.552 0.905 25 12 Strong
assign (resid   29 and name C and segid C   ) (resid   30 and name N and segid C   )
       (resid   30 and name CA and segid C  ) (resid   30 and name C and segid C   )    1.0 -121.3   24.9 2
assign (resid   30 and name N and segid C   ) (resid   30 and name CA and segid C  )
       (resid   30 and name C and segid C   ) (resid   31 and name N and segid C   )    1.0  143.2   22.7 2

!   31 I -125.555  133.187   12.745    8.929    0.490 0.892 25 12 Strong
assign (resid   30 and name C and segid C   ) (resid   31 and name N and segid C   )
       (resid   31 and name CA and segid C  ) (resid   31 and name C and segid C   )    1.0 -125.6   25.5 2
assign (resid   31 and name N and segid C   ) (resid   31 and name CA and segid C  )
       (resid   31 and name C and segid C   ) (resid   32 and name N and segid C   )    1.0  133.2   20.0 2

!   32 K  -93.113  120.342   15.834   13.174    0.501 0.866 25 12 Strong
assign (resid   31 and name C and segid C   ) (resid   32 and name N and segid C   )
       (resid   32 and name CA and segid C  ) (resid   32 and name C and segid C   )    1.0  -93.1   31.7 2
assign (resid   32 and name N and segid C   ) (resid   32 and name CA and segid C  )
       (resid   32 and name C and segid C   ) (resid   33 and name N and segid C   )    1.0  120.3   26.3 2

!   33 R  -71.859  135.002   15.310   12.214    0.602 0.856 25 11 Strong
assign (resid   32 and name C and segid C   ) (resid   33 and name N and segid C   )
       (resid   33 and name CA and segid C  ) (resid   33 and name C and segid C   )    1.0  -71.9   30.6 2
assign (resid   33 and name N and segid C   ) (resid   33 and name CA and segid C  )
       (resid   33 and name C and segid C   ) (resid   34 and name N and segid C   )    1.0  135.0   24.4 2
# Restraints file 5: ehb.tbl
!helix hydrogen bond restraints
!helix A
assign (resid 10 and name N and segid A) (resid  6 and name O and segid A)	2.95 0.1 0.1
assign (resid 11 and name N and segid A) (resid  7 and name O and segid A)	2.95 0.1 0.1
assign (resid 12 and name N and segid A) (resid  8 and name O and segid A)	2.95 0.1 0.1
assign (resid 13 and name N and segid A) (resid  9 and name O and segid A)	2.95 0.1 0.1
assign (resid 14 and name N and segid A) (resid 10 and name O and segid A)	2.95 0.1 0.1
assign (resid 15 and name N and segid A) (resid 11 and name O and segid A)	2.95 0.1 0.1
assign (resid 16 and name N and segid A) (resid 12 and name O and segid A)	2.95 0.1 0.1
assign (resid 17 and name N and segid A) (resid 13 and name O and segid A)	2.95 0.1 0.1
assign (resid 18 and name N and segid A) (resid 14 and name O and segid A)	2.95 0.1 0.1
assign (resid 19 and name N and segid A) (resid 15 and name O and segid A)	2.95 0.1 0.1
assign (resid 20 and name N and segid A) (resid 16 and name O and segid A)	2.95 0.1 0.1
assign (resid 21 and name N and segid A) (resid 17 and name O and segid A)	2.95 0.1 0.1
assign (resid 22 and name N and segid A) (resid 18 and name O and segid A)	2.95 0.1 0.1
assign (resid 23 and name N and segid A) (resid 19 and name O and segid A)	2.95 0.1 0.1
assign (resid 24 and name N and segid A) (resid 20 and name O and segid A)	2.95 0.1 0.1
assign (resid 25 and name N and segid A) (resid 21 and name O and segid A)	2.95 0.1 0.1
assign (resid 26 and name N and segid A) (resid 22 and name O and segid A)	2.95 0.1 0.1
assign (resid 27 and name N and segid A) (resid 23 and name O and segid A)	2.95 0.1 0.1
assign (resid 28 and name N and segid A) (resid 24 and name O and segid A)	2.95 0.1 0.1
assign (resid 10 and name HN and segid A) (resid  6 and name O and segid A)	2.0 0.1 0.1
assign (resid 11 and name HN and segid A) (resid  7 and name O and segid A)	2.0 0.1 0.1
assign (resid 12 and name HN and segid A) (resid  8 and name O and segid A)	2.0 0.1 0.1
assign (resid 13 and name HN and segid A) (resid  9 and name O and segid A)	2.0 0.1 0.1
assign (resid 14 and name HN and segid A) (resid 10 and name O and segid A)	2.0 0.1 0.1
assign (resid 15 and name HN and segid A) (resid 11 and name O and segid A)	2.0 0.1 0.1
assign (resid 16 and name HN and segid A) (resid 12 and name O and segid A)	2.0 0.1 0.1
assign (resid 17 and name HN and segid A) (resid 13 and name O and segid A)	2.0 0.1 0.1
assign (resid 18 and name HN and segid A) (resid 14 and name O and segid A)	2.0 0.1 0.1
assign (resid 19 and name HN and segid A) (resid 15 and name O and segid A)	2.0 0.1 0.1
assign (resid 20 and name HN and segid A) (resid 16 and name O and segid A)	2.0 0.1 0.1
assign (resid 21 and name HN and segid A) (resid 17 and name O and segid A)	2.0 0.1 0.1
assign (resid 22 and name HN and segid A) (resid 18 and name O and segid A)	2.0 0.1 0.1
assign (resid 23 and name HN and segid A) (resid 19 and name O and segid A)	2.0 0.1 0.1
assign (resid 24 and name HN and segid A) (resid 20 and name O and segid A)	2.0 0.1 0.1
assign (resid 25 and name HN and segid A) (resid 21 and name O and segid A)	2.0 0.1 0.1
assign (resid 26 and name HN and segid A) (resid 22 and name O and segid A)	2.0 0.1 0.1
assign (resid 27 and name HN and segid A) (resid 23 and name O and segid A)	2.0 0.1 0.1
assign (resid 28 and name HN and segid A) (resid 24 and name O and segid A)	2.0 0.1 0.1

helix B
assign (resid 10 and name N and segid B) (resid  6 and name O and segid B)	2.95 0.1 0.1
assign (resid 11 and name N and segid B) (resid  7 and name O and segid B)	2.95 0.1 0.1
assign (resid 12 and name N and segid B) (resid  8 and name O and segid B)	2.95 0.1 0.1
assign (resid 13 and name N and segid B) (resid  9 and name O and segid B)	2.95 0.1 0.1
assign (resid 14 and name N and segid B) (resid 10 and name O and segid B)	2.95 0.1 0.1
assign (resid 15 and name N and segid B) (resid 11 and name O and segid B)	2.95 0.1 0.1
assign (resid 16 and name N and segid B) (resid 12 and name O and segid B)	2.95 0.1 0.1
assign (resid 17 and name N and segid B) (resid 13 and name O and segid B)	2.95 0.1 0.1
assign (resid 18 and name N and segid B) (resid 14 and name O and segid B)	2.95 0.1 0.1
assign (resid 19 and name N and segid B) (resid 15 and name O and segid B)	2.95 0.1 0.1
assign (resid 20 and name N and segid B) (resid 16 and name O and segid B)	2.95 0.1 0.1
assign (resid 21 and name N and segid B) (resid 17 and name O and segid B)	2.95 0.1 0.1
assign (resid 22 and name N and segid B) (resid 18 and name O and segid B)	2.95 0.1 0.1
assign (resid 23 and name N and segid B) (resid 19 and name O and segid B)	2.95 0.1 0.1
assign (resid 24 and name N and segid B) (resid 20 and name O and segid B)	2.95 0.1 0.1
assign (resid 25 and name N and segid B) (resid 21 and name O and segid B)	2.95 0.1 0.1
assign (resid 26 and name N and segid B) (resid 22 and name O and segid B)	2.95 0.1 0.1
assign (resid 27 and name N and segid B) (resid 23 and name O and segid B)	2.95 0.1 0.1
assign (resid 28 and name N and segid B) (resid 24 and name O and segid B)	2.95 0.1 0.1
assign (resid 10 and name HN and segid B) (resid  6 and name O and segid B)	2.0 0.1 0.1
assign (resid 11 and name HN and segid B) (resid  7 and name O and segid B)	2.0 0.1 0.1
assign (resid 12 and name HN and segid B) (resid  8 and name O and segid B)	2.0 0.1 0.1
assign (resid 13 and name HN and segid B) (resid  9 and name O and segid B)	2.0 0.1 0.1
assign (resid 14 and name HN and segid B) (resid 10 and name O and segid B)	2.0 0.1 0.1
assign (resid 15 and name HN and segid B) (resid 11 and name O and segid B)	2.0 0.1 0.1
assign (resid 16 and name HN and segid B) (resid 12 and name O and segid B)	2.0 0.1 0.1
assign (resid 17 and name HN and segid B) (resid 13 and name O and segid B)	2.0 0.1 0.1
assign (resid 18 and name HN and segid B) (resid 14 and name O and segid B)	2.0 0.1 0.1
assign (resid 19 and name HN and segid B) (resid 15 and name O and segid B)	2.0 0.1 0.1
assign (resid 20 and name HN and segid B) (resid 16 and name O and segid B)	2.0 0.1 0.1
assign (resid 21 and name HN and segid B) (resid 17 and name O and segid B)	2.0 0.1 0.1
assign (resid 22 and name HN and segid B) (resid 18 and name O and segid B)	2.0 0.1 0.1
assign (resid 23 and name HN and segid B) (resid 19 and name O and segid B)	2.0 0.1 0.1
assign (resid 24 and name HN and segid B) (resid 20 and name O and segid B)	2.0 0.1 0.1
assign (resid 25 and name HN and segid B) (resid 21 and name O and segid B)	2.0 0.1 0.1
assign (resid 26 and name HN and segid B) (resid 22 and name O and segid B)	2.0 0.1 0.1
assign (resid 27 and name HN and segid B) (resid 23 and name O and segid B)	2.0 0.1 0.1
assign (resid 28 and name HN and segid B) (resid 24 and name O and segid B)	2.0 0.1 0.1


!helix C
assign (resid 10 and name N and segid C) (resid  6 and name O and segid C)	2.95 0.1 0.1
assign (resid 11 and name N and segid C) (resid  7 and name O and segid C)	2.95 0.1 0.1
assign (resid 12 and name N and segid C) (resid  8 and name O and segid C)	2.95 0.1 0.1
assign (resid 13 and name N and segid C) (resid  9 and name O and segid C)	2.95 0.1 0.1
assign (resid 14 and name N and segid C) (resid 10 and name O and segid C)	2.95 0.1 0.1
assign (resid 15 and name N and segid C) (resid 11 and name O and segid C)	2.95 0.1 0.1
assign (resid 16 and name N and segid C) (resid 12 and name O and segid C)	2.95 0.1 0.1
assign (resid 17 and name N and segid C) (resid 13 and name O and segid C)	2.95 0.1 0.1
assign (resid 18 and name N and segid C) (resid 14 and name O and segid C)	2.95 0.1 0.1
assign (resid 19 and name N and segid C) (resid 15 and name O and segid C)	2.95 0.1 0.1
assign (resid 20 and name N and segid C) (resid 16 and name O and segid C)	2.95 0.1 0.1
assign (resid 21 and name N and segid C) (resid 17 and name O and segid C)	2.95 0.1 0.1
assign (resid 22 and name N and segid C) (resid 18 and name O and segid C)	2.95 0.1 0.1
assign (resid 23 and name N and segid C) (resid 19 and name O and segid C)	2.95 0.1 0.1
assign (resid 24 and name N and segid C) (resid 20 and name O and segid C)	2.95 0.1 0.1
assign (resid 25 and name N and segid C) (resid 21 and name O and segid C)	2.95 0.1 0.1
assign (resid 26 and name N and segid C) (resid 22 and name O and segid C)	2.95 0.1 0.1
assign (resid 27 and name N and segid C) (resid 23 and name O and segid C)	2.95 0.1 0.1
assign (resid 28 and name N and segid C) (resid 24 and name O and segid C)	2.95 0.1 0.1
assign (resid 10 and name HN and segid C) (resid  6 and name O and segid C)	2.0 0.1 0.1
assign (resid 11 and name HN and segid C) (resid  7 and name O and segid C)	2.0 0.1 0.1
assign (resid 12 and name HN and segid C) (resid  8 and name O and segid C)	2.0 0.1 0.1
assign (resid 13 and name HN and segid C) (resid  9 and name O and segid C)	2.0 0.1 0.1
assign (resid 14 and name HN and segid C) (resid 10 and name O and segid C)	2.0 0.1 0.1
assign (resid 15 and name HN and segid C) (resid 11 and name O and segid C)	2.0 0.1 0.1
assign (resid 16 and name HN and segid C) (resid 12 and name O and segid C)	2.0 0.1 0.1
assign (resid 17 and name HN and segid C) (resid 13 and name O and segid C)	2.0 0.1 0.1
assign (resid 18 and name HN and segid C) (resid 14 and name O and segid C)	2.0 0.1 0.1
assign (resid 19 and name HN and segid C) (resid 15 and name O and segid C)	2.0 0.1 0.1
assign (resid 20 and name HN and segid C) (resid 16 and name O and segid C)	2.0 0.1 0.1
assign (resid 21 and name HN and segid C) (resid 17 and name O and segid C)	2.0 0.1 0.1
assign (resid 22 and name HN and segid C) (resid 18 and name O and segid C)	2.0 0.1 0.1
assign (resid 23 and name HN and segid C) (resid 19 and name O and segid C)	2.0 0.1 0.1
assign (resid 24 and name HN and segid C) (resid 20 and name O and segid C)	2.0 0.1 0.1
assign (resid 25 and name HN and segid C) (resid 21 and name O and segid C)	2.0 0.1 0.1
assign (resid 26 and name HN and segid C) (resid 22 and name O and segid C)	2.0 0.1 0.1
assign (resid 27 and name HN and segid C) (resid 23 and name O and segid C)	2.0 0.1 0.1
assign (resid 28 and name HN and segid C) (resid 24 and name O and segid C)	2.0 0.1 0.1


!helix D
assign (resid 10 and name N and segid D) (resid  6 and name O and segid D)	2.95 0.1 0.1
assign (resid 11 and name N and segid D) (resid  7 and name O and segid D)	2.95 0.1 0.1
assign (resid 12 and name N and segid D) (resid  8 and name O and segid D)	2.95 0.1 0.1
assign (resid 13 and name N and segid D) (resid  9 and name O and segid D)	2.95 0.1 0.1
assign (resid 14 and name N and segid D) (resid 10 and name O and segid D)	2.95 0.1 0.1
assign (resid 15 and name N and segid D) (resid 11 and name O and segid D)	2.95 0.1 0.1
assign (resid 16 and name N and segid D) (resid 12 and name O and segid D)	2.95 0.1 0.1
assign (resid 17 and name N and segid D) (resid 13 and name O and segid D)	2.95 0.1 0.1
assign (resid 18 and name N and segid D) (resid 14 and name O and segid D)	2.95 0.1 0.1
assign (resid 19 and name N and segid D) (resid 15 and name O and segid D)	2.95 0.1 0.1
assign (resid 20 and name N and segid D) (resid 16 and name O and segid D)	2.95 0.1 0.1
assign (resid 21 and name N and segid D) (resid 17 and name O and segid D)	2.95 0.1 0.1
assign (resid 22 and name N and segid D) (resid 18 and name O and segid D)	2.95 0.1 0.1
assign (resid 23 and name N and segid D) (resid 19 and name O and segid D)	2.95 0.1 0.1
assign (resid 24 and name N and segid D) (resid 20 and name O and segid D)	2.95 0.1 0.1
assign (resid 25 and name N and segid D) (resid 21 and name O and segid D)	2.95 0.1 0.1
assign (resid 26 and name N and segid D) (resid 22 and name O and segid D)	2.95 0.1 0.1
assign (resid 27 and name N and segid D) (resid 23 and name O and segid D)	2.95 0.1 0.1
assign (resid 28 and name N and segid D) (resid 24 and name O and segid D)	2.95 0.1 0.1
assign (resid 10 and name HN and segid D) (resid  6 and name O and segid D)	2.0 0.1 0.1
assign (resid 11 and name HN and segid D) (resid  7 and name O and segid D)	2.0 0.1 0.1
assign (resid 12 and name HN and segid D) (resid  8 and name O and segid D)	2.0 0.1 0.1
assign (resid 13 and name HN and segid D) (resid  9 and name O and segid D)	2.0 0.1 0.1
assign (resid 14 and name HN and segid D) (resid 10 and name O and segid D)	2.0 0.1 0.1
assign (resid 15 and name HN and segid D) (resid 11 and name O and segid D)	2.0 0.1 0.1
assign (resid 16 and name HN and segid D) (resid 12 and name O and segid D)	2.0 0.1 0.1
assign (resid 17 and name HN and segid D) (resid 13 and name O and segid D)	2.0 0.1 0.1
assign (resid 18 and name HN and segid D) (resid 14 and name O and segid D)	2.0 0.1 0.1
assign (resid 19 and name HN and segid D) (resid 15 and name O and segid D)	2.0 0.1 0.1
assign (resid 20 and name HN and segid D) (resid 16 and name O and segid D)	2.0 0.1 0.1
assign (resid 21 and name HN and segid D) (resid 17 and name O and segid D)	2.0 0.1 0.1
assign (resid 22 and name HN and segid D) (resid 18 and name O and segid D)	2.0 0.1 0.1
assign (resid 23 and name HN and segid D) (resid 19 and name O and segid D)	2.0 0.1 0.1
assign (resid 24 and name HN and segid D) (resid 20 and name O and segid D)	2.0 0.1 0.1
assign (resid 25 and name HN and segid D) (resid 21 and name O and segid D)	2.0 0.1 0.1
assign (resid 26 and name HN and segid D) (resid 22 and name O and segid D)	2.0 0.1 0.1
assign (resid 27 and name HN and segid D) (resid 23 and name O and segid D)	2.0 0.1 0.1
assign (resid 28 and name HN and segid D) (resid 24 and name O and segid D)	2.0 0.1 0.1

# Restraints file 6: hb.tbl
!helix hydrogen bond restraints
!helix A
assign (resid 10 and name N and segid A)(resid 10 and name HN and segid A) (resid 6 and name O and segid A)
assign (resid 11 and name N and segid A)(resid 11 and name HN and segid A) (resid 7 and name O and segid A)
assign (resid 12 and name N and segid A)(resid 12 and name HN and segid A) (resid 8 and name O and segid A)
assign (resid 13 and name N and segid A)(resid 13 and name HN and segid A) (resid 9 and name O and segid A)
assign (resid 14 and name N and segid A)(resid 14 and name HN and segid A) (resid 10 and name O and segid A)
assign (resid 15 and name N and segid A)(resid 15 and name HN and segid A) (resid 11 and name O and segid A)
assign (resid 16 and name N and segid A)(resid 16 and name HN and segid A) (resid 12 and name O and segid A)
assign (resid 17 and name N and segid A)(resid 17 and name HN and segid A) (resid 13 and name O and segid A)
assign (resid 18 and name N and segid A)(resid 18 and name HN and segid A) (resid 14 and name O and segid A)
assign (resid 19 and name N and segid A)(resid 19 and name HN and segid A) (resid 15 and name O and segid A)
assign (resid 20 and name N and segid A)(resid 20 and name HN and segid A) (resid 16 and name O and segid A)
assign (resid 21 and name N and segid A)(resid 21 and name HN and segid A) (resid 17 and name O and segid A)
assign (resid 22 and name N and segid A)(resid 22 and name HN and segid A) (resid 18 and name O and segid A)
assign (resid 23 and name N and segid A)(resid 23 and name HN and segid A) (resid 19 and name O and segid A)
assign (resid 24 and name N and segid A)(resid 24 and name HN and segid A) (resid 20 and name O and segid A)
assign (resid 25 and name N and segid A)(resid 25 and name HN and segid A) (resid 21 and name O and segid A)
assign (resid 26 and name N and segid A)(resid 26 and name HN and segid A) (resid 22 and name O and segid A)
assign (resid 27 and name N and segid A)(resid 27 and name HN and segid A) (resid 23 and name O and segid A)
assign (resid 28 and name N and segid A)(resid 28 and name HN and segid A) (resid 24 and name O and segid A)

!helix B
assign (resid 10 and name N and segid B)(resid 10 and name HN and segid B) (resid 6 and name O and segid B)
assign (resid 11 and name N and segid B)(resid 11 and name HN and segid B) (resid 7 and name O and segid B)
assign (resid 12 and name N and segid B)(resid 12 and name HN and segid B) (resid 8 and name O and segid B)
assign (resid 13 and name N and segid B)(resid 13 and name HN and segid B) (resid 9 and name O and segid B)
assign (resid 14 and name N and segid B)(resid 14 and name HN and segid B) (resid 10 and name O and segid B)
assign (resid 15 and name N and segid B)(resid 15 and name HN and segid B) (resid 11 and name O and segid B)
assign (resid 16 and name N and segid B)(resid 16 and name HN and segid B) (resid 12 and name O and segid B)
assign (resid 17 and name N and segid B)(resid 17 and name HN and segid B) (resid 13 and name O and segid B)
assign (resid 18 and name N and segid B)(resid 18 and name HN and segid B) (resid 14 and name O and segid B)
assign (resid 19 and name N and segid B)(resid 19 and name HN and segid B) (resid 15 and name O and segid B)
assign (resid 20 and name N and segid B)(resid 20 and name HN and segid B) (resid 16 and name O and segid B)
assign (resid 21 and name N and segid B)(resid 21 and name HN and segid B) (resid 17 and name O and segid B)
assign (resid 22 and name N and segid B)(resid 22 and name HN and segid B) (resid 18 and name O and segid B)
assign (resid 23 and name N and segid B)(resid 23 and name HN and segid B) (resid 19 and name O and segid B)
assign (resid 24 and name N and segid B)(resid 24 and name HN and segid B) (resid 20 and name O and segid B)
assign (resid 25 and name N and segid B)(resid 25 and name HN and segid B) (resid 21 and name O and segid B)
assign (resid 26 and name N and segid B)(resid 26 and name HN and segid B) (resid 22 and name O and segid B)
assign (resid 27 and name N and segid B)(resid 27 and name HN and segid B) (resid 23 and name O and segid B)
assign (resid 28 and name N and segid B)(resid 28 and name HN and segid B) (resid 24 and name O and segid B)

!helix C
assign (resid 10 and name N and segid C)(resid 10 and name HN and segid C) (resid 6 and name O and segid C)
assign (resid 11 and name N and segid C)(resid 11 and name HN and segid C) (resid 7 and name O and segid C)
assign (resid 12 and name N and segid C)(resid 12 and name HN and segid C) (resid 8 and name O and segid C)
assign (resid 13 and name N and segid C)(resid 13 and name HN and segid C) (resid 9 and name O and segid C)
assign (resid 14 and name N and segid C)(resid 14 and name HN and segid C) (resid 10 and name O and segid C)
assign (resid 15 and name N and segid C)(resid 15 and name HN and segid C) (resid 11 and name O and segid C)
assign (resid 16 and name N and segid C)(resid 16 and name HN and segid C) (resid 12 and name O and segid C)
assign (resid 17 and name N and segid C)(resid 17 and name HN and segid C) (resid 13 and name O and segid C)
assign (resid 18 and name N and segid C)(resid 18 and name HN and segid C) (resid 14 and name O and segid C)
assign (resid 19 and name N and segid C)(resid 19 and name HN and segid C) (resid 15 and name O and segid C)
assign (resid 20 and name N and segid C)(resid 20 and name HN and segid C) (resid 16 and name O and segid C)
assign (resid 21 and name N and segid C)(resid 21 and name HN and segid C) (resid 17 and name O and segid C)
assign (resid 22 and name N and segid C)(resid 22 and name HN and segid C) (resid 18 and name O and segid C)
assign (resid 23 and name N and segid C)(resid 23 and name HN and segid C) (resid 19 and name O and segid C)
assign (resid 24 and name N and segid C)(resid 24 and name HN and segid C) (resid 20 and name O and segid C)
assign (resid 25 and name N and segid C)(resid 25 and name HN and segid C) (resid 21 and name O and segid C)
assign (resid 26 and name N and segid C)(resid 26 and name HN and segid C) (resid 22 and name O and segid C)
assign (resid 27 and name N and segid C)(resid 27 and name HN and segid C) (resid 23 and name O and segid C)
assign (resid 28 and name N and segid C)(resid 28 and name HN and segid C) (resid 24 and name O and segid C)

!helix D
assign (resid 10 and name N and segid D)(resid 10 and name HN and segid D) (resid 6 and name O and segid D)
assign (resid 11 and name N and segid D)(resid 11 and name HN and segid D) (resid 7 and name O and segid D)
assign (resid 12 and name N and segid D)(resid 12 and name HN and segid D) (resid 8 and name O and segid D)
assign (resid 13 and name N and segid D)(resid 13 and name HN and segid D) (resid 9 and name O and segid D)
assign (resid 14 and name N and segid D)(resid 14 and name HN and segid D) (resid 10 and name O and segid D)
assign (resid 15 and name N and segid D)(resid 15 and name HN and segid D) (resid 11 and name O and segid D)
assign (resid 16 and name N and segid D)(resid 16 and name HN and segid D) (resid 12 and name O and segid D)
assign (resid 17 and name N and segid D)(resid 17 and name HN and segid D) (resid 13 and name O and segid D)
assign (resid 18 and name N and segid D)(resid 18 and name HN and segid D) (resid 14 and name O and segid D)
assign (resid 19 and name N and segid D)(resid 19 and name HN and segid D) (resid 15 and name O and segid D)
assign (resid 20 and name N and segid D)(resid 20 and name HN and segid D) (resid 16 and name O and segid D)
assign (resid 21 and name N and segid D)(resid 21 and name HN and segid D) (resid 17 and name O and segid D)
assign (resid 22 and name N and segid D)(resid 22 and name HN and segid D) (resid 18 and name O and segid D)
assign (resid 23 and name N and segid D)(resid 23 and name HN and segid D) (resid 19 and name O and segid D)
assign (resid 24 and name N and segid D)(resid 24 and name HN and segid D) (resid 20 and name O and segid D)
assign (resid 25 and name N and segid D)(resid 25 and name HN and segid D) (resid 21 and name O and segid D)
assign (resid 26 and name N and segid D)(resid 26 and name HN and segid D) (resid 22 and name O and segid D)
assign (resid 27 and name N and segid D)(resid 27 and name HN and segid D) (resid 23 and name O and segid D)
assign (resid 28 and name N and segid D)(resid 28 and name HN and segid D) (resid 24 and name O and segid D)
# Restraints file 7: intranoe.tbl
!	NOE restraints for pH 4.5 BM2 from 13C-13C spin diffusion experiments


!==================Contacts from Helix A to Helix A

assign (resid	4 and name	CD and segid	A)	assign (resid	3 and name	C and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	7 and name	C and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	5 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	4 and name	CD and segid	A)	assign (resid	5 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	5 and name	CD# and segid	A)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	A)	assign (resid	5 and name	CE# and segid	A)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	A)	assign (resid	6 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	A)	assign (resid	7 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	4 and name	CD and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	6 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	4 and name	CG and segid	A)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	8 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	9 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	A)	assign (resid	9 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	7 and name	CB and segid	A)	assign (resid	3 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	A)	assign (resid	3 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	A)	assign (resid	6 and name	CG and segid	A)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	A)	assign (resid	7 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	A)	assign (resid	9 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	8 and name	CD1 and segid	A)	assign (resid	7 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	8 and name	CD1 and segid	A)	assign (resid	9 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	A)	assign (resid	6 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	A)	assign (resid	9 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	A)	assign (resid	9 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	A)	assign (resid	10 and name	CD1 and segid	A)	4.0	3.0	3.5
assign (resid	9 and name	CB and segid	A)	assign (resid	10 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	A)	assign (resid	8 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	A)	assign (resid	11 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	A)	assign (resid	12 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	A)	assign (resid	12 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	A)	assign (resid	11 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	11 and name	CB and segid	A)	assign (resid	12 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	A)	assign (resid	8 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	A)	assign (resid	10 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	12 and name	CA and segid	A)	assign (resid	13 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	13 and name	CA and segid	A)	assign (resid	11 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	A)	assign (resid	14 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	A)	assign (resid	14 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	13 and name	CD# and segid	A)	assign (resid	14 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	A)	assign (resid	15 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	14 and name	CB and segid	A)	assign (resid	15 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	A)	assign (resid	15 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	14 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	14 and name	CG1 and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	A)	assign (resid	16 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	15 and name	CD2 and segid	A)	assign (resid	14 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	15 and name	CB and segid	A)	assign (resid	14 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	A)	assign (resid	15 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	16 and name	CA and segid	A)	assign (resid	17 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	A)	assign (resid	17 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	16 and name	CB and segid	A)	assign (resid	15 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	A)	assign (resid	15 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	16 and name	CB and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	16 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	A)	assign (resid	14 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	A)	assign (resid	16 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	18 and name	CA and segid	A)	assign (resid	17 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	A)	assign (resid	18 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	A)	assign (resid	17 and name	CB and segid	A)	4.0	3.0	2.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	18 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	21 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	A)	assign (resid	21 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	A)	assign (resid	20 and name	CD# and segid	A)	4.0	3.0	3.5
assign (resid	18 and name	CD2 and segid	A)	assign (resid	16 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	A)	assign (resid	17 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	18 and name	CG and segid	A)	assign (resid	19 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	20 and name	CB and segid	A)	assign (resid	18 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	20 and name	CE# and segid	A)	assign (resid	21 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	A)	assign (resid	23 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	A)	assign (resid	18 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	A)	assign (resid	18 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	A)	assign (resid	19 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	A)	assign (resid	22 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	21 and name	CA and segid	A)	assign (resid	23 and name	CE3 and segid	A)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	A)	assign (resid	23 and name	CE3 and segid	A)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	21 and name	CG and segid	A)	assign (resid	19 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	21 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	21 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	19 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	20 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	23 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	23 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	24 and name	CG2 and segid	A)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	25 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	A)	assign (resid	23 and name	CE3 and segid	A)	5.0	4.0	7.0
assign (resid	22 and name	CA and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	A)	assign (resid	18 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	23 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	23 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	25 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	A)	assign (resid	25 and name	CG1 and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	A)	assign (resid	24 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	19 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	25 and name	C and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	A)	assign (resid	24 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	A)	assign (resid	23 and name	CE2 and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CA and segid	A)	assign (resid	23 and name	CE3 and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	C and segid	A)	4.0	3.0	2.5
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	22 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	22 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	25 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	25 and name	CB and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	25 and name	CG1 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	25 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	25 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	26 and name	C and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	20 and name	CE# and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	A)	assign (resid	23 and name	CE3 and segid	A)	5.0	4.0	7.0
assign (resid	24 and name	CG2 and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	A)	assign (resid	23 and name	CG and segid	A)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	A)	assign (resid	24 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	A)	assign (resid	24 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	A)	assign (resid	27 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	A)	assign (resid	26 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	A)	assign (resid	27 and name	CD2 and segid	A)	5.0	4.0	3.5
assign (resid	27 and name	CB and segid	A)	assign (resid	26 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	28 and name	CA and segid	A)	assign (resid	26 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	28 and name	CA and segid	A)	assign (resid	30 and name	CB and segid	A)	4.0	3.0	3.5
assign (resid	28 and name	CA and segid	A)	assign (resid	30 and name	CG and segid	A)	4.0	3.0	3.5
assign (resid	28 and name	CD# and segid	A)	assign (resid	25 and name	CG2 and segid	A)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	A)	assign (resid	28 and name	CB and segid	A)	4.0	3.0	2.5
assign (resid	29 and name	CB and segid	A)	assign (resid	30 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	A)	assign (resid	30 and name	CG and segid	A)	5.0	4.0	3.5
assign (resid	29 and name	CB and segid	A)	assign (resid	31 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	30 and name	CA and segid	A)	assign (resid	28 and name	CD# and segid	A)	4.0	3.0	3.5
assign (resid	30 and name	CG and segid	A)	assign (resid	28 and name	CD# and segid	A)	5.0	4.0	3.5
assign (resid	30 and name	CG and segid	A)	assign (resid	31 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	31 and name	CB and segid	A)	assign (resid	29 and name	CA and segid	A)	4.0	3.0	2.5
assign (resid	31 and name	CB and segid	A)	assign (resid	32 and name	CA and segid	A)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	A)	assign (resid	31 and name	CA and segid	A)	4.0	3.0	3.5
assign (resid	31 and name	CB and segid	A)	assign (resid	33 and name	CZ and segid	A)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	A)	assign (resid	31 and name	CD1 and segid	A)	5.0	4.0	3.5
assign (resid	33 and name	CB and segid	A)	assign (resid	31 and name	CD1 and segid	A)	5.0	4.0	3.5

!==================Contacts from Helix B to Helix B

assign (resid	4 and name	CD and segid	B)	assign (resid	3 and name	C and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	7 and name	C and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	5 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	4 and name	CD and segid	B)	assign (resid	5 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	5 and name	CD# and segid	B)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	B)	assign (resid	5 and name	CE# and segid	B)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	B)	assign (resid	6 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	B)	assign (resid	7 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	4 and name	CD and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	6 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	4 and name	CG and segid	B)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	8 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	9 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	B)	assign (resid	9 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	7 and name	CB and segid	B)	assign (resid	3 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	B)	assign (resid	3 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	B)	assign (resid	6 and name	CG and segid	B)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	B)	assign (resid	7 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	B)	assign (resid	9 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	8 and name	CD1 and segid	B)	assign (resid	7 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	8 and name	CD1 and segid	B)	assign (resid	9 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	B)	assign (resid	6 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	B)	assign (resid	9 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	B)	assign (resid	9 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	B)	assign (resid	10 and name	CD1 and segid	B)	4.0	3.0	3.5
assign (resid	9 and name	CB and segid	B)	assign (resid	10 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	B)	assign (resid	8 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	B)	assign (resid	11 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	B)	assign (resid	12 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	B)	assign (resid	12 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	B)	assign (resid	11 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	11 and name	CB and segid	B)	assign (resid	12 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	B)	assign (resid	8 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	B)	assign (resid	10 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	12 and name	CA and segid	B)	assign (resid	13 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	13 and name	CA and segid	B)	assign (resid	11 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	B)	assign (resid	14 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	B)	assign (resid	14 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	13 and name	CD# and segid	B)	assign (resid	14 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	B)	assign (resid	15 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	14 and name	CB and segid	B)	assign (resid	15 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	B)	assign (resid	15 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	14 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	14 and name	CG1 and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	B)	assign (resid	16 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	15 and name	CD2 and segid	B)	assign (resid	14 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	15 and name	CB and segid	B)	assign (resid	14 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	B)	assign (resid	15 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	16 and name	CA and segid	B)	assign (resid	17 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	B)	assign (resid	17 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	16 and name	CB and segid	B)	assign (resid	15 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	B)	assign (resid	15 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	16 and name	CB and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	16 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	B)	assign (resid	14 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	B)	assign (resid	16 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	18 and name	CA and segid	B)	assign (resid	17 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	B)	assign (resid	18 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	B)	assign (resid	17 and name	CB and segid	B)	4.0	3.0	2.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	18 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	21 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	B)	assign (resid	21 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	B)	assign (resid	20 and name	CD# and segid	B)	4.0	3.0	3.5
assign (resid	18 and name	CD2 and segid	B)	assign (resid	16 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	B)	assign (resid	17 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	18 and name	CG and segid	B)	assign (resid	19 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	20 and name	CB and segid	B)	assign (resid	18 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	20 and name	CE# and segid	B)	assign (resid	21 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	B)	assign (resid	23 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	B)	assign (resid	18 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	B)	assign (resid	18 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	B)	assign (resid	19 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	B)	assign (resid	22 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	21 and name	CA and segid	B)	assign (resid	23 and name	CE3 and segid	B)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	B)	assign (resid	23 and name	CE3 and segid	B)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	21 and name	CG and segid	B)	assign (resid	19 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	21 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	21 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	19 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	20 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	23 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	23 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	24 and name	CG2 and segid	B)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	25 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	B)	assign (resid	23 and name	CE3 and segid	B)	5.0	4.0	7.0
assign (resid	22 and name	CA and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	B)	assign (resid	18 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	23 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	23 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	25 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	B)	assign (resid	25 and name	CG1 and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	B)	assign (resid	24 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	19 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	25 and name	C and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	B)	assign (resid	24 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	B)	assign (resid	23 and name	CE2 and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CA and segid	B)	assign (resid	23 and name	CE3 and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	C and segid	B)	4.0	3.0	2.5
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	22 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	22 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	25 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	25 and name	CB and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	25 and name	CG1 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	25 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	25 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	26 and name	C and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	20 and name	CE# and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	B)	assign (resid	23 and name	CE3 and segid	B)	5.0	4.0	7.0
assign (resid	24 and name	CG2 and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	B)	assign (resid	23 and name	CG and segid	B)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	B)	assign (resid	24 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	B)	assign (resid	24 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	B)	assign (resid	27 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	B)	assign (resid	26 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	B)	assign (resid	27 and name	CD2 and segid	B)	5.0	4.0	3.5
assign (resid	27 and name	CB and segid	B)	assign (resid	26 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	28 and name	CA and segid	B)	assign (resid	26 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	28 and name	CA and segid	B)	assign (resid	30 and name	CB and segid	B)	4.0	3.0	3.5
assign (resid	28 and name	CA and segid	B)	assign (resid	30 and name	CG and segid	B)	4.0	3.0	3.5
assign (resid	28 and name	CD# and segid	B)	assign (resid	25 and name	CG2 and segid	B)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	B)	assign (resid	28 and name	CB and segid	B)	4.0	3.0	2.5
assign (resid	29 and name	CB and segid	B)	assign (resid	30 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	B)	assign (resid	30 and name	CG and segid	B)	5.0	4.0	3.5
assign (resid	29 and name	CB and segid	B)	assign (resid	31 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	30 and name	CA and segid	B)	assign (resid	28 and name	CD# and segid	B)	4.0	3.0	3.5
assign (resid	30 and name	CG and segid	B)	assign (resid	28 and name	CD# and segid	B)	5.0	4.0	3.5
assign (resid	30 and name	CG and segid	B)	assign (resid	31 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	31 and name	CB and segid	B)	assign (resid	29 and name	CA and segid	B)	4.0	3.0	2.5
assign (resid	31 and name	CB and segid	B)	assign (resid	32 and name	CA and segid	B)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	B)	assign (resid	31 and name	CA and segid	B)	4.0	3.0	3.5
assign (resid	31 and name	CB and segid	B)	assign (resid	33 and name	CZ and segid	B)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	B)	assign (resid	31 and name	CD1 and segid	B)	5.0	4.0	3.5
assign (resid	33 and name	CB and segid	B)	assign (resid	31 and name	CD1 and segid	B)	5.0	4.0	3.5

!==================Contacts from Helix C to Helix C

assign (resid	4 and name	CD and segid	C)	assign (resid	3 and name	C and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	7 and name	C and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	5 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	4 and name	CD and segid	C)	assign (resid	5 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	5 and name	CD# and segid	C)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	C)	assign (resid	5 and name	CE# and segid	C)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	C)	assign (resid	6 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	C)	assign (resid	7 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	4 and name	CD and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	6 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	4 and name	CG and segid	C)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	8 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	9 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	C)	assign (resid	9 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	7 and name	CB and segid	C)	assign (resid	3 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	C)	assign (resid	3 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	C)	assign (resid	6 and name	CG and segid	C)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	C)	assign (resid	7 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	C)	assign (resid	9 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	8 and name	CD1 and segid	C)	assign (resid	7 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	8 and name	CD1 and segid	C)	assign (resid	9 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	C)	assign (resid	6 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	C)	assign (resid	9 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	C)	assign (resid	9 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	C)	assign (resid	10 and name	CD1 and segid	C)	4.0	3.0	3.5
assign (resid	9 and name	CB and segid	C)	assign (resid	10 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	C)	assign (resid	8 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	C)	assign (resid	11 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	C)	assign (resid	12 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	C)	assign (resid	12 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	C)	assign (resid	11 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	11 and name	CB and segid	C)	assign (resid	12 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	C)	assign (resid	8 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	C)	assign (resid	10 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	12 and name	CA and segid	C)	assign (resid	13 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	13 and name	CA and segid	C)	assign (resid	11 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	C)	assign (resid	14 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	C)	assign (resid	14 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	13 and name	CD# and segid	C)	assign (resid	14 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	C)	assign (resid	15 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	14 and name	CB and segid	C)	assign (resid	15 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	C)	assign (resid	15 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	14 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	14 and name	CG1 and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	C)	assign (resid	16 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	15 and name	CD2 and segid	C)	assign (resid	14 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	15 and name	CB and segid	C)	assign (resid	14 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	C)	assign (resid	15 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	16 and name	CA and segid	C)	assign (resid	17 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	C)	assign (resid	17 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	16 and name	CB and segid	C)	assign (resid	15 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	C)	assign (resid	15 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	16 and name	CB and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	16 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	C)	assign (resid	14 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	C)	assign (resid	16 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	18 and name	CA and segid	C)	assign (resid	17 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	C)	assign (resid	18 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	C)	assign (resid	17 and name	CB and segid	C)	4.0	3.0	2.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	18 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	21 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	C)	assign (resid	21 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	C)	assign (resid	20 and name	CD# and segid	C)	4.0	3.0	3.5
assign (resid	18 and name	CD2 and segid	C)	assign (resid	16 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	C)	assign (resid	17 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	18 and name	CG and segid	C)	assign (resid	19 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	20 and name	CB and segid	C)	assign (resid	18 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	20 and name	CE# and segid	C)	assign (resid	21 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	C)	assign (resid	23 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	C)	assign (resid	18 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	C)	assign (resid	18 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	C)	assign (resid	19 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	C)	assign (resid	22 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	21 and name	CA and segid	C)	assign (resid	23 and name	CE3 and segid	C)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	C)	assign (resid	23 and name	CE3 and segid	C)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	21 and name	CG and segid	C)	assign (resid	19 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	21 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	21 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	19 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	20 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	23 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	23 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	24 and name	CG2 and segid	C)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	25 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	C)	assign (resid	23 and name	CE3 and segid	C)	5.0	4.0	7.0
assign (resid	22 and name	CA and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	C)	assign (resid	18 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	23 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	23 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	25 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	C)	assign (resid	25 and name	CG1 and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	C)	assign (resid	24 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	19 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	25 and name	C and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	C)	assign (resid	24 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	C)	assign (resid	23 and name	CE2 and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CA and segid	C)	assign (resid	23 and name	CE3 and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	C and segid	C)	4.0	3.0	2.5
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	22 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	22 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	25 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	25 and name	CB and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	25 and name	CG1 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	25 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	25 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	26 and name	C and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	20 and name	CE# and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	C)	assign (resid	23 and name	CE3 and segid	C)	5.0	4.0	7.0
assign (resid	24 and name	CG2 and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	C)	assign (resid	23 and name	CG and segid	C)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	C)	assign (resid	24 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	C)	assign (resid	24 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	C)	assign (resid	27 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	C)	assign (resid	26 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	C)	assign (resid	27 and name	CD2 and segid	C)	5.0	4.0	3.5
assign (resid	27 and name	CB and segid	C)	assign (resid	26 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	28 and name	CA and segid	C)	assign (resid	26 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	28 and name	CA and segid	C)	assign (resid	30 and name	CB and segid	C)	4.0	3.0	3.5
assign (resid	28 and name	CA and segid	C)	assign (resid	30 and name	CG and segid	C)	4.0	3.0	3.5
assign (resid	28 and name	CD# and segid	C)	assign (resid	25 and name	CG2 and segid	C)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	C)	assign (resid	28 and name	CB and segid	C)	4.0	3.0	2.5
assign (resid	29 and name	CB and segid	C)	assign (resid	30 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	C)	assign (resid	30 and name	CG and segid	C)	5.0	4.0	3.5
assign (resid	29 and name	CB and segid	C)	assign (resid	31 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	30 and name	CA and segid	C)	assign (resid	28 and name	CD# and segid	C)	4.0	3.0	3.5
assign (resid	30 and name	CG and segid	C)	assign (resid	28 and name	CD# and segid	C)	5.0	4.0	3.5
assign (resid	30 and name	CG and segid	C)	assign (resid	31 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	31 and name	CB and segid	C)	assign (resid	29 and name	CA and segid	C)	4.0	3.0	2.5
assign (resid	31 and name	CB and segid	C)	assign (resid	32 and name	CA and segid	C)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	C)	assign (resid	31 and name	CA and segid	C)	4.0	3.0	3.5
assign (resid	31 and name	CB and segid	C)	assign (resid	33 and name	CZ and segid	C)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	C)	assign (resid	31 and name	CD1 and segid	C)	5.0	4.0	3.5
assign (resid	33 and name	CB and segid	C)	assign (resid	31 and name	CD1 and segid	C)	5.0	4.0	3.5

!==================Contacts from Helix D to Helix D

assign (resid	4 and name	CD and segid	D)	assign (resid	3 and name	C and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	7 and name	C and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	5 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	4 and name	CD and segid	D)	assign (resid	5 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	5 and name	CD# and segid	D)	5.0	4.0	3.5
assign (resid	4 and name	CD and segid	D)	assign (resid	5 and name	CE# and segid	D)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	D)	assign (resid	6 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	5 and name	CD# and segid	D)	assign (resid	7 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	4 and name	CD and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	6 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	4 and name	CG and segid	D)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	8 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	9 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	7 and name	CA and segid	D)	assign (resid	9 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	7 and name	CB and segid	D)	assign (resid	3 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	7 and name	CB and segid	D)	assign (resid	3 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	8 and name	CA and segid	D)	assign (resid	6 and name	CG and segid	D)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	D)	assign (resid	7 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	8 and name	CA and segid	D)	assign (resid	9 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	8 and name	CD1 and segid	D)	assign (resid	7 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	8 and name	CD1 and segid	D)	assign (resid	9 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	D)	assign (resid	6 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	8 and name	CD2 and segid	D)	assign (resid	9 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	D)	assign (resid	9 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	9 and name	CA and segid	D)	assign (resid	10 and name	CD1 and segid	D)	4.0	3.0	3.5
assign (resid	9 and name	CB and segid	D)	assign (resid	10 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	10 and name	CA and segid	D)	assign (resid	8 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	10 and name	CA and segid	D)	assign (resid	11 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	D)	assign (resid	12 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	11 and name	CA and segid	D)	assign (resid	12 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	12 and name	CA and segid	D)	assign (resid	11 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	11 and name	CB and segid	D)	assign (resid	12 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	D)	assign (resid	8 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	11 and name	CB and segid	D)	assign (resid	10 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	12 and name	CA and segid	D)	assign (resid	13 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	13 and name	CA and segid	D)	assign (resid	11 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	13 and name	CB and segid	D)	assign (resid	14 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	13 and name	CB and segid	D)	assign (resid	14 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	13 and name	CD# and segid	D)	assign (resid	14 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	D)	assign (resid	15 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	14 and name	CB and segid	D)	assign (resid	15 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	D)	assign (resid	15 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CA and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CB and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	14 and name	CD1 and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	14 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	14 and name	CG1 and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CA and segid	D)	assign (resid	16 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	15 and name	CD2 and segid	D)	assign (resid	14 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	15 and name	CB and segid	D)	assign (resid	14 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	16 and name	CA and segid	D)	assign (resid	15 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	16 and name	CA and segid	D)	assign (resid	17 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	16 and name	CA and segid	D)	assign (resid	17 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	16 and name	CB and segid	D)	assign (resid	15 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	16 and name	CB and segid	D)	assign (resid	15 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	16 and name	CB and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	16 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	D)	assign (resid	14 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CA and segid	D)	assign (resid	16 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	18 and name	CA and segid	D)	assign (resid	17 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	17 and name	CA and segid	D)	assign (resid	18 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	D)	assign (resid	17 and name	CB and segid	D)	4.0	3.0	2.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	18 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	21 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	17 and name	CB and segid	D)	assign (resid	21 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CA and segid	D)	assign (resid	20 and name	CD# and segid	D)	4.0	3.0	3.5
assign (resid	18 and name	CD2 and segid	D)	assign (resid	16 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CD2 and segid	D)	assign (resid	17 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	18 and name	CG and segid	D)	assign (resid	19 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	20 and name	CB and segid	D)	assign (resid	18 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	20 and name	CE# and segid	D)	assign (resid	21 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CA and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	D)	assign (resid	23 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	D)	assign (resid	18 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CB and segid	D)	assign (resid	18 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	D)	assign (resid	19 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	21 and name	CG and segid	D)	assign (resid	22 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	21 and name	CA and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	21 and name	CA and segid	D)	assign (resid	23 and name	CE3 and segid	D)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	D)	assign (resid	23 and name	CE3 and segid	D)	5.0	4.0	7.0
assign (resid	21 and name	CB and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	21 and name	CG and segid	D)	assign (resid	19 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	21 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	21 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	19 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	20 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	23 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	23 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	24 and name	CG2 and segid	D)	4.0	3.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	25 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CA and segid	D)	assign (resid	23 and name	CE3 and segid	D)	5.0	4.0	7.0
assign (resid	22 and name	CA and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	22 and name	CB and segid	D)	assign (resid	18 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	23 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	23 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	25 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	22 and name	CB and segid	D)	assign (resid	25 and name	CG1 and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	CA and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	23 and name	CB and segid	D)	assign (resid	24 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	19 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	25 and name	C and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CA and segid	D)	assign (resid	24 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CA and segid	D)	assign (resid	23 and name	CE2 and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CA and segid	D)	assign (resid	23 and name	CE3 and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	C and segid	D)	4.0	3.0	2.5
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	22 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	22 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	25 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	25 and name	CB and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	25 and name	CG1 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	25 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	25 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	26 and name	C and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	20 and name	CE# and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CB and segid	D)	assign (resid	23 and name	CE3 and segid	D)	5.0	4.0	7.0
assign (resid	24 and name	CG2 and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	24 and name	CG2 and segid	D)	assign (resid	23 and name	CG and segid	D)	5.0	4.0	7.0
assign (resid	25 and name	CA and segid	D)	assign (resid	24 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	D)	assign (resid	24 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CB and segid	D)	assign (resid	27 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CD1 and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	25 and name	CG2 and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	27 and name	CA and segid	D)	assign (resid	26 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	26 and name	CA and segid	D)	assign (resid	27 and name	CD2 and segid	D)	5.0	4.0	3.5
assign (resid	27 and name	CB and segid	D)	assign (resid	26 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	28 and name	CA and segid	D)	assign (resid	26 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	28 and name	CA and segid	D)	assign (resid	30 and name	CB and segid	D)	4.0	3.0	3.5
assign (resid	28 and name	CA and segid	D)	assign (resid	30 and name	CG and segid	D)	4.0	3.0	3.5
assign (resid	28 and name	CD# and segid	D)	assign (resid	25 and name	CG2 and segid	D)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	D)	assign (resid	28 and name	CB and segid	D)	4.0	3.0	2.5
assign (resid	29 and name	CB and segid	D)	assign (resid	30 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	29 and name	CA and segid	D)	assign (resid	30 and name	CG and segid	D)	5.0	4.0	3.5
assign (resid	29 and name	CB and segid	D)	assign (resid	31 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	30 and name	CA and segid	D)	assign (resid	28 and name	CD# and segid	D)	4.0	3.0	3.5
assign (resid	30 and name	CG and segid	D)	assign (resid	28 and name	CD# and segid	D)	5.0	4.0	3.5
assign (resid	30 and name	CG and segid	D)	assign (resid	31 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	31 and name	CB and segid	D)	assign (resid	29 and name	CA and segid	D)	4.0	3.0	2.5
assign (resid	31 and name	CB and segid	D)	assign (resid	32 and name	CA and segid	D)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	D)	assign (resid	31 and name	CA and segid	D)	4.0	3.0	3.5
assign (resid	31 and name	CB and segid	D)	assign (resid	33 and name	CZ and segid	D)	5.0	4.0	3.5
assign (resid	33 and name	CA and segid	D)	assign (resid	31 and name	CD1 and segid	D)	5.0	4.0	3.5
assign (resid	33 and name	CB and segid	D)	assign (resid	31 and name	CD1 and segid	D)	5.0	4.0	3.5

# Restraints file 8: rdc_all.tbl
!orientation restraints from uniaxial-rotation averaged NH DIpolar Couplings

!=======================helix A
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid A)
       ( resid 6    and name HN  and segid A)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid A)
       ( resid 7    and name HN  and segid A)  6.3  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid A)
       ( resid 8    and name HN  and segid A)  9.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid A)
       ( resid 9    and name HN  and segid A)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid A)
       ( resid 10   and name HN  and segid A)  5.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid A)
       ( resid 11   and name HN  and segid A) 6.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid A)
       ( resid 12   and name HN  and segid A)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid A)
       ( resid 13   and name HN  and segid A)  7.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid A)
       ( resid 14   and name HN  and segid A)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid A)
       ( resid 15   and name HN  and segid A)  8.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid A)
       ( resid 16   and name HN  and segid A)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid A)
       ( resid 17   and name HN  and segid A)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid A)
       ( resid 18   and name HN  and segid A)  6.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid A)
       ( resid 19   and name HN  and segid A)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid A)
       ( resid 20   and name HN  and segid A)  8.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid A)
       ( resid 21   and name HN  and segid A)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid A)
       ( resid 22   and name HN  and segid A)  7.8  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid A)
       ( resid 23   and name HN  and segid A)  10.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid A)
       ( resid 24   and name HN  and segid A)  6.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid A)
       ( resid 25   and name HN  and segid A)  6.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid A)
       ( resid 26   and name HN  and segid A)  9.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid A)
       ( resid 27   and name HN  and segid A)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid A)
       ( resid 28   and name HN  and segid A)  5.8  0.5  0.5

!=======================helix B
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid B)
       ( resid 6    and name HN  and segid B)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid B)
       ( resid 7    and name HN  and segid B)  6.3  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid B)
       ( resid 8    and name HN  and segid B)  9.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid B)
       ( resid 9    and name HN  and segid B)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid B)
       ( resid 10   and name HN  and segid B)  5.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid B)
       ( resid 11   and name HN  and segid B) 6.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid B)
       ( resid 12   and name HN  and segid B)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid B)
       ( resid 13   and name HN  and segid B)  7.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid B)
       ( resid 14   and name HN  and segid B)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid B)
       ( resid 15   and name HN  and segid B)  8.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid B)
       ( resid 16   and name HN  and segid B)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid B)
       ( resid 17   and name HN  and segid B)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid B)
       ( resid 18   and name HN  and segid B)  6.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid B)
       ( resid 19   and name HN  and segid B)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid B)
       ( resid 20   and name HN  and segid B)  8.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid B)
       ( resid 21   and name HN  and segid B)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid B)
       ( resid 22   and name HN  and segid B)  7.8  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid B)
       ( resid 23   and name HN  and segid B)  10.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid B)
       ( resid 24   and name HN  and segid B)  6.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid B)
       ( resid 25   and name HN  and segid B)  6.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid B)
       ( resid 26   and name HN  and segid B)  9.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid B)
       ( resid 27   and name HN  and segid B)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid B)
       ( resid 28   and name HN  and segid B)  5.8  0.5  0.5

!=======================helix C
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid C)
       ( resid 6    and name HN  and segid C)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid C)
       ( resid 7    and name HN  and segid C)  6.3  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid C)
       ( resid 8    and name HN  and segid C)  9.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid C)
       ( resid 9    and name HN  and segid C)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid C)
       ( resid 10   and name HN  and segid C)  5.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid C)
       ( resid 11   and name HN  and segid C) 6.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid C)
       ( resid 12   and name HN  and segid C)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid C)
       ( resid 13   and name HN  and segid C)  7.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid C)
       ( resid 14   and name HN  and segid C)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid C)
       ( resid 15   and name HN  and segid C)  8.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid C)
       ( resid 16   and name HN  and segid C)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid C)
       ( resid 17   and name HN  and segid C)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid C)
       ( resid 18   and name HN  and segid C)  6.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid C)
       ( resid 19   and name HN  and segid C)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid C)
       ( resid 20   and name HN  and segid C)  8.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid C)
       ( resid 21   and name HN  and segid C)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid C)
       ( resid 22   and name HN  and segid C)  7.8  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid C)
       ( resid 23   and name HN  and segid C)  10.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid C)
       ( resid 24   and name HN  and segid C)  6.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid C)
       ( resid 25   and name HN  and segid C)  6.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid C)
       ( resid 26   and name HN  and segid C)  9.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid C)
       ( resid 27   and name HN  and segid C)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid C)
       ( resid 28   and name HN  and segid C)  5.8  0.5  0.5

!=======================helix D
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 6    and name N   and segid D)
       ( resid 6    and name HN  and segid D)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 7    and name N   and segid D)
       ( resid 7    and name HN  and segid D)  6.3  0.7  0.7

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 8    and name N   and segid D)
       ( resid 8    and name HN  and segid D)  9.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 9    and name N   and segid D)
       ( resid 9    and name HN  and segid D)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 10   and name N   and segid D)
       ( resid 10   and name HN  and segid D)  5.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 11   and name N   and segid D)
       ( resid 11   and name HN  and segid D) 6.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 12   and name N   and segid D)
       ( resid 12   and name HN  and segid D)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 13   and name N   and segid D)
       ( resid 13   and name HN  and segid D)  7.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 14   and name N   and segid D)
       ( resid 14   and name HN  and segid D)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 15   and name N   and segid D)
       ( resid 15   and name HN  and segid D)  8.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 16   and name N   and segid D)
       ( resid 16   and name HN  and segid D)  8.6  1.0  1.0

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 17   and name N   and segid D)
       ( resid 17   and name HN  and segid D)  7.1  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 18   and name N   and segid D)
       ( resid 18   and name HN  and segid D)  6.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 19   and name N   and segid D)
       ( resid 19   and name HN  and segid D)  9.9  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 20   and name N   and segid D)
       ( resid 20   and name HN  and segid D)  8.7  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 21   and name N   and segid D)
       ( resid 21   and name HN  and segid D)  5.4  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 22   and name N   and segid D)
       ( resid 22   and name HN  and segid D)  7.8  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 23   and name N   and segid D)
       ( resid 23   and name HN  and segid D)  10.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 24   and name N   and segid D)
       ( resid 24   and name HN  and segid D)  6.6  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 25   and name N   and segid D)
       ( resid 25   and name HN  and segid D)  6.3  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 26   and name N   and segid D)
       ( resid 26   and name HN  and segid D)  9.2  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 27   and name N   and segid D)
       ( resid 27   and name HN  and segid D)  9.5  0.5  0.5

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 28   and name N   and segid D)
       ( resid 28   and name HN  and segid D)  5.8  0.5  0.5


# Restraints file 9: D_1000243177_mr_P1.xplor-nih.V1
!!  Intermolecular NOEs for BM2

!!  NOE  distances  obtained  from  13C-19F REDOR and 19F-19F CODEX               
!!  numbers  specify:  distance,  lower error,  upper error         

! F20-X contacts
!=====================================================================A-B
assign (resid   20 and name   HZ and segid A)   (resid  16 and name  CB and segid B)   6.2  1.5  2.4   
assign (resid   20 and name   HZ and segid A)   (resid  16 and name  CB and segid B)   6.3  1.5  2.7
assign (resid   20 and name   HZ and segid A)   (resid  18 and name  CD2 and segid B)  7.3  1.2  1.5
assign (resid   20 and name   HZ and segid A)   (resid  18 and (name  CG or name CD1) and segid B)  5.6  1.0  1.2
assign (resid   20 and name   HZ and segid A)   (resid  18 and name  CB and segid B)   5.6  1.0  1.0   
assign (resid   20 and name   HZ and segid A)   (resid  18 and name  CA and segid B)   6.3  1.2  1.8
assign (resid   20 and name   HZ and segid A)   (resid  19 and name  CA and segid B)   7.0  2.4  4.0
assign (resid   20 and name   HZ and segid A)   (resid  19 and name  CD2 and segid B)  5.4  1.5  2.1
assign (resid   20 and name   HZ and segid A)   (resid  21 and name  CA and segid B)   7.5  1.0  1.5
assign (resid   20 and name   HZ and segid A)   (resid  21 and name  CB and segid B)   6.6  2.0  2.0
assign (resid   20 and name   HZ and segid A)   (resid  22 and name  CA and segid B)   6.5  1.5  2.4
assign (resid   20 and name   HZ and segid A)   (resid  22 and name  CB and segid B)   7.6  1.2  1.2
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CG and segid B)   6.1  1.0  1.0  
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CE3 and segid B)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CH2 and segid B)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid A)   (resid  23 and name  CZ3 and segid B)   16.4 8.0 8.0  
!=====================================================================B-C
assign (resid   20 and name   HZ and segid B)   (resid  16 and name  CB and segid C)   6.2  1.5  2.4   
assign (resid   20 and name   HZ and segid B)   (resid  16 and name  CB and segid C)   6.3  1.5  2.7
assign (resid   20 and name   HZ and segid B)   (resid  18 and name  CD2 and segid C)  7.3  1.2  1.5
assign (resid   20 and name   HZ and segid B)   (resid  18 and (name  CG or name CD1) and segid C)  5.6  1.0  1.2
assign (resid   20 and name   HZ and segid B)   (resid  18 and name  CB and segid C)   5.6  1.0  1.0   
assign (resid   20 and name   HZ and segid B)   (resid  18 and name  CA and segid C)   6.3  1.2  1.8
assign (resid   20 and name   HZ and segid B)   (resid  19 and name  CA and segid C)   7.0  2.4  4.0
assign (resid   20 and name   HZ and segid B)   (resid  19 and name  CD2 and segid C)  5.4  1.5  2.1
assign (resid   20 and name   HZ and segid B)   (resid  21 and name  CA and segid C)   7.5  1.0  1.5
assign (resid   20 and name   HZ and segid B)   (resid  21 and name  CB and segid C)   6.6  2.0  2.0
assign (resid   20 and name   HZ and segid B)   (resid  22 and name  CA and segid C)   6.5  1.5  2.4
assign (resid   20 and name   HZ and segid B)   (resid  22 and name  CB and segid C)   7.6  1.2  1.2
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CG and segid C)   6.1  1.0  1.0   
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CE3 and segid C)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CH2 and segid C)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid B)   (resid  23 and name  CZ3 and segid C)   16.4 8.0 8.0 
!=====================================================================C-D
assign (resid   20 and name   HZ and segid C)   (resid  16 and name  CB and segid D)   6.2  1.5  2.4   
assign (resid   20 and name   HZ and segid C)   (resid  16 and name  CB and segid D)   6.3  1.5  2.7
assign (resid   20 and name   HZ and segid C)   (resid  18 and name  CD2 and segid D)  7.3  1.2  1.5
assign (resid   20 and name   HZ and segid C)   (resid  18 and (name  CG or name CD1) and segid D)  5.6  1.0  1.2
assign (resid   20 and name   HZ and segid C)   (resid  18 and name  CB and segid D)   5.6  1.0  1.0   
assign (resid   20 and name   HZ and segid C)   (resid  18 and name  CA and segid D)   6.3  1.2  1.8
assign (resid   20 and name   HZ and segid C)   (resid  19 and name  CA and segid D)   7.0  2.4  4.0
assign (resid   20 and name   HZ and segid C)   (resid  19 and name  CD2 and segid D)  5.4  1.5  2.1
assign (resid   20 and name   HZ and segid C)   (resid  21 and name  CA and segid D)   7.5  1.0  1.5
assign (resid   20 and name   HZ and segid C)   (resid  21 and name  CB and segid D)   6.6  2.0  2.0
assign (resid   20 and name   HZ and segid C)   (resid  22 and name  CA and segid D)   6.5  1.5  2.4
assign (resid   20 and name   HZ and segid C)   (resid  22 and name  CB and segid D)   7.6  1.2  1.2
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CG and segid D)   6.1  1.0  1.0
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CE3 and segid D)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CH2 and segid D)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid C)   (resid  23 and name  CZ3 and segid D)   16.4 8.0 8.0    
!=====================================================================D-A
assign (resid   20 and name   HZ and segid D)   (resid  16 and name  CB and segid A)   6.2  1.5  2.4   
assign (resid   20 and name   HZ and segid D)   (resid  16 and name  CB and segid A)   6.3  1.5  2.7
assign (resid   20 and name   HZ and segid D)   (resid  18 and name  CD2 and segid A)  7.3  1.2  1.5
assign (resid   20 and name   HZ and segid D)   (resid  18 and (name  CG or name CD1) and segid A)  5.6  1.0  1.2
assign (resid   20 and name   HZ and segid D)   (resid  18 and name  CB and segid A)   5.6  1.0  1.0   
assign (resid   20 and name   HZ and segid D)   (resid  18 and name  CA and segid A)   6.3  1.2  1.8
assign (resid   20 and name   HZ and segid D)   (resid  19 and name  CA and segid A)   7.0  2.4  4.0
assign (resid   20 and name   HZ and segid D)   (resid  19 and name  CD2 and segid A)  5.4  1.5  2.1
assign (resid   20 and name   HZ and segid D)   (resid  21 and name  CA and segid A)   7.5  1.0  1.5
assign (resid   20 and name   HZ and segid D)   (resid  21 and name  CB and segid A)   6.6  2.0  2.0
assign (resid   20 and name   HZ and segid D)   (resid  22 and name  CA and segid A)   6.5  1.5  2.4
assign (resid   20 and name   HZ and segid D)   (resid  22 and name  CB and segid A)   7.6  1.2  1.2
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CG and segid A)   6.1  1.0  1.0    
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CE3 and segid A)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CH2 and segid A)   16.4 8.0 8.0
assign (resid   20 and name   HZ and segid D)   (resid  23 and name  CZ3 and segid A)   16.4 8.0 8.0

! F5-X contacts
!=====================================================================A-B
assign (resid   5 and name   HZ and segid A)   (resid  4 and name  CA and  segid B)   16.9 10.0 10.0
assign (resid   5 and name   HZ and segid A)   (resid  4 and name  CD and  segid B)   16.4 10.0 10.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CD1 and segid B)   5.5  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CG2 and segid B)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CG1 and segid B)   5.8  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CB and  segid B)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid A)   (resid  7 and name  CA and  segid B)   5.9  1.5  1.5 
!=====================================================================B-C
assign (resid   5 and name   HZ and segid B)   (resid  4 and name  CA and  segid C)   16.9 10.0 10.0
assign (resid   5 and name   HZ and segid B)   (resid  4 and name  CD and  segid C)   16.4 10.0 10.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CD1 and segid C)   5.5  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CG2 and segid C)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CG1 and segid C)   5.8  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CB and  segid C)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid B)   (resid  7 and name  CA and  segid C)   5.9  1.5  1.5 
!=====================================================================C-D
assign (resid   5 and name   HZ and segid C)   (resid  4 and name  CA and  segid D)   16.9 10.0 10.0
assign (resid   5 and name   HZ and segid C)   (resid  4 and name  CD and  segid D)   16.4 10.0 10.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CD1 and segid D)   5.5  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CG2 and segid D)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CG1 and segid D)   5.8  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CB and  segid D)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid C)   (resid  7 and name  CA and  segid D)   5.9  1.5  1.5 
!=====================================================================D-A
assign (resid   5 and name   HZ and segid D)   (resid  4 and name  CA and  segid A)   16.9 10.0 10.0
assign (resid   5 and name   HZ and segid D)   (resid  4 and name  CD and  segid A)   16.4 10.0 10.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CD1 and segid A)   5.5  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CG2 and segid A)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CG1 and segid A)   5.8  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CB and  segid A)   6.0  1.0  1.0
assign (resid   5 and name   HZ and segid D)   (resid  7 and name  CA and  segid A)   5.9  1.5  1.5 



! CODEX restraints
!=====================================================================W23
assign (resid  23 and name  HZ3 and segid A)   (resid  23 and name  HZ3 and segid B)   10.5  2.0  2.0
assign (resid  23 and name  HZ3 and segid A)   (resid  23 and name  HZ3 and segid C)   14.8  2.0  2.0
assign (resid  23 and name  HZ3 and segid B)   (resid  23 and name  HZ3 and segid C)   10.5  2.0  2.0
assign (resid  23 and name  HZ3 and segid B)   (resid  23 and name  HZ3 and segid D)   14.8  2.0  2.0
assign (resid  23 and name  HZ3 and segid C)   (resid  23 and name  HZ3 and segid D)   10.5  2.0  2.0
assign (resid  23 and name  HZ3 and segid D)   (resid  23 and name  HZ3 and segid A)   10.5  2.0  2.0
!=====================================================================F5
assign (resid   5 and name   HZ and segid A)   (resid   5 and name   HZ and segid B)    9.4  2.0  5.0
assign (resid   5 and name   HZ and segid B)   (resid   5 and name   HZ and segid C)    9.4  2.0  5.0
assign (resid   5 and name   HZ and segid C)   (resid   5 and name   HZ and segid D)    9.4  2.0  5.0
assign (resid   5 and name   HZ and segid D)   (resid   5 and name   HZ and segid A)    9.4  2.0  5.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1  52.175  22.819  13.803
    2    H2   MET   1           HT2      MET   1  51.048  24.006  13.351
    3    H3   MET   1           HT3      MET   1  52.698  24.393  13.452
    4    HA   MET   1           HA       MET   1  53.239  23.134  11.565
    5    HB2  MET   1           HB2      MET   1  50.810  21.730  12.346
    6    HB3  MET   1           HB1      MET   1  50.825  22.081  10.618
    7    HG2  MET   1           HG2      MET   1  52.645  20.737  10.218
    8    HG3  MET   1           HG1      MET   1  53.361  21.058  11.797
    9    HE1  MET   1           HE1      MET   1  53.514  19.079  13.518
   10    HE2  MET   1           HE2      MET   1  51.942  18.710  14.223
   11    HE3  MET   1           HE3      MET   1  52.396  20.386  13.931
   12    H    PHE   2           HN       PHE   2  52.686  23.695   9.322
   13    HA   PHE   2           HA       PHE   2  51.900  26.378   9.049
   14    HB2  PHE   2           HB2      PHE   2  53.326  25.360   7.393
   15    HB3  PHE   2           HB1      PHE   2  52.094  24.160   6.999
   16    HD1  PHE   2           HD1      PHE   2  52.767  27.836   7.012
   17    HD2  PHE   2           HD2      PHE   2  50.431  24.618   5.387
   18    HE1  PHE   2           HE1      PHE   2  51.777  29.391   5.353
   19    HE2  PHE   2           HE2      PHE   2  49.441  26.174   3.728
   20    HZ   PHE   2           HZ       PHE   2  50.115  28.561   3.711
   21    H    GLU   3           HN       GLU   3  50.150  23.381   8.261
   22    HA   GLU   3           HA       GLU   3  47.775  24.786   7.495
   23    HB2  GLU   3           HB2      GLU   3  48.321  21.864   8.047
   24    HB3  GLU   3           HB1      GLU   3  46.756  22.475   7.520
   25    HG2  GLU   3           HG2      GLU   3  47.764  21.905   5.491
   26    HG3  GLU   3           HG1      GLU   3  48.115  23.627   5.618
   27    HA   PRO   4           HA       PRO   4  45.576  25.400  11.257
   28    HB2  PRO   4           HB2      PRO   4  43.399  23.651  10.196
   29    HB3  PRO   4           HB1      PRO   4  43.313  25.313  10.808
   30    HG2  PRO   4           HG2      PRO   4  43.178  24.778   8.203
   31    HG3  PRO   4           HG1      PRO   4  43.994  26.226   8.817
   32    HD2  PRO   4           HD2      PRO   4  45.169  23.734   7.705
   33    HD3  PRO   4           HD1      PRO   4  45.789  25.394   7.653
   34    H    PHE   5           HN       PHE   5  45.542  22.075  10.021
   35    HA   PHE   5           HA       PHE   5  46.417  21.025  12.556
   36    HB2  PHE   5           HB2      PHE   5  43.609  21.155  12.067
   37    HB3  PHE   5           HB1      PHE   5  44.098  19.463  11.972
   38    HD1  PHE   5           HD1      PHE   5  43.957  22.455  14.125
   39    HD2  PHE   5           HD2      PHE   5  45.027  18.302  13.893
   40    HE1  PHE   5           HE1      PHE   5  44.134  22.362  16.597
   41    HE2  PHE   5           HE2      PHE   5  45.205  18.209  16.364
   42    HZ   PHE   5           HZ       PHE   5  44.758  20.239  17.717
   43    H    GLN   6           HN       GLN   6  44.501  19.635   9.880
   44    HA   GLN   6           HA       GLN   6  46.823  18.422   8.674
   45    HB2  GLN   6           HB2      GLN   6  46.160  16.984  10.742
   46    HB3  GLN   6           HB1      GLN   6  44.790  16.483   9.748
   47    HG2  GLN   6           HG2      GLN   6  46.276  15.691   8.000
   48    HG3  GLN   6           HG1      GLN   6  47.682  16.321   8.858
   49   HE21  GLN   6          HE21      GLN   6  48.454  15.131  10.720
   50   HE22  GLN   6          HE22      GLN   6  47.878  13.579  11.091
   51    H    ILE   7           HN       ILE   7  46.234  17.177   6.742
   52    HA   ILE   7           HA       ILE   7  44.269  18.473   5.193
   53    HB   ILE   7           HB       ILE   7  45.729  15.853   4.791
   54   HG12  ILE   7          HG12      ILE   7  46.074  18.544   3.439
   55   HG13  ILE   7          HG11      ILE   7  47.016  18.040   4.843
   56   HG21  ILE   7          HG21      ILE   7  43.698  15.736   3.487
   57   HG22  ILE   7          HG22      ILE   7  45.009  16.158   2.385
   58   HG23  ILE   7          HG23      ILE   7  43.892  17.403   2.944
   59   HD11  ILE   7          HD11      ILE   7  48.327  17.493   2.905
   60   HD12  ILE   7          HD12      ILE   7  46.945  16.738   2.110
   61   HD13  ILE   7          HD13      ILE   7  47.676  15.973   3.521
   62    H    LEU   8           HN       LEU   8  44.257  15.380   6.884
   63    HA   LEU   8           HA       LEU   8  41.687  14.531   5.965
   64    HB2  LEU   8           HB2      LEU   8  43.393  13.690   8.311
   65    HB3  LEU   8           HB1      LEU   8  41.830  12.954   7.954
   66    HG   LEU   8           HG       LEU   8  44.014  13.158   5.874
   67   HD11  LEU   8          HD11      LEU   8  43.432  10.840   7.746
   68   HD12  LEU   8          HD12      LEU   8  44.849  11.886   7.843
   69   HD13  LEU   8          HD13      LEU   8  44.615  10.846   6.437
   70   HD21  LEU   8          HD21      LEU   8  41.830  12.710   4.954
   71   HD22  LEU   8          HD22      LEU   8  41.481  11.525   6.212
   72   HD23  LEU   8          HD23      LEU   8  42.692  11.173   4.980
   73    H    SER   9           HN       SER   9  42.804  16.415   8.673
   74    HA   SER   9           HA       SER   9  40.314  16.433  10.104
   75    HB2  SER   9           HB2      SER   9  42.407  16.876  11.270
   76    HB3  SER   9           HB1      SER   9  42.688  18.303  10.276
   77    HG   SER   9           HG       SER   9  40.824  19.218  11.158
   78    H    ILE  10           HN       ILE  10  41.893  18.672   7.850
   79    HA   ILE  10           HA       ILE  10  39.938  20.717   8.004
   80    HB   ILE  10           HB       ILE  10  41.911  19.994   5.831
   81   HG12  ILE  10          HG12      ILE  10  41.987  22.290   7.794
   82   HG13  ILE  10          HG11      ILE  10  42.704  20.725   8.169
   83   HG21  ILE  10          HG21      ILE  10  40.108  22.404   6.187
   84   HG22  ILE  10          HG22      ILE  10  40.137  21.289   4.822
   85   HG23  ILE  10          HG23      ILE  10  41.495  22.378   5.099
   86   HD11  ILE  10          HD11      ILE  10  43.528  22.740   6.097
   87   HD12  ILE  10          HD12      ILE  10  43.882  21.033   5.818
   88   HD13  ILE  10          HD13      ILE  10  44.525  21.844   7.243
   89    H    CYS  11           HN       CYS  11  40.392  17.994   5.752
   90    HA   CYS  11           HA       CYS  11  38.257  18.602   4.027
   91    HB2  CYS  11           HB2      CYS  11  39.547  15.974   4.768
   92    HB3  CYS  11           HB1      CYS  11  38.324  16.130   3.506
   93    HG   CYS  11           HG       CYS  11  40.159  16.840   2.011
   94    H    SER  12           HN       SER  12  38.360  16.370   6.833
   95    HA   SER  12           HA       SER  12  35.664  15.618   6.739
   96    HB2  SER  12           HB2      SER  12  37.554  15.847   9.083
   97    HB3  SER  12           HB1      SER  12  35.976  15.070   9.162
   98    HG   SER  12           HG       SER  12  36.687  13.632   7.549
   99    H    PHE  13           HN       PHE  13  37.243  18.379   8.262
  100    HA   PHE  13           HA       PHE  13  35.076  19.328   9.789
  101    HB2  PHE  13           HB2      PHE  13  37.300  20.222  10.110
  102    HB3  PHE  13           HB1      PHE  13  37.339  20.825   8.453
  103    HD1  PHE  13           HD1      PHE  13  35.738  21.226  11.773
  104    HD2  PHE  13           HD2      PHE  13  36.201  22.847   7.822
  105    HE1  PHE  13           HE1      PHE  13  34.642  23.327  12.506
  106    HE2  PHE  13           HE2      PHE  13  35.107  24.948   8.556
  107    HZ   PHE  13           HZ       PHE  13  34.328  25.188  10.897
  108    H    ILE  14           HN       ILE  14  36.096  20.208   6.478
  109    HA   ILE  14           HA       ILE  14  33.922  21.984   6.019
  110    HB   ILE  14           HB       ILE  14  35.766  20.525   4.122
  111   HG12  ILE  14          HG12      ILE  14  35.636  23.452   4.899
  112   HG13  ILE  14          HG11      ILE  14  36.684  22.287   5.709
  113   HG21  ILE  14          HG21      ILE  14  33.728  21.022   2.913
  114   HG22  ILE  14          HG22      ILE  14  34.930  22.232   2.462
  115   HG23  ILE  14          HG23      ILE  14  33.657  22.641   3.612
  116   HD11  ILE  14          HD11      ILE  14  36.751  23.109   2.797
  117   HD12  ILE  14          HD12      ILE  14  37.631  21.715   3.424
  118   HD13  ILE  14          HD13      ILE  14  38.014  23.335   4.007
  119    H    LEU  15           HN       LEU  15  34.455  18.578   5.276
  120    HA   LEU  15           HA       LEU  15  32.110  18.149   3.758
  121    HB2  LEU  15           HB2      LEU  15  33.798  16.250   5.408
  122    HB3  LEU  15           HB1      LEU  15  32.499  15.738   4.332
  123    HG   LEU  15           HG       LEU  15  34.740  17.494   3.336
  124   HD11  LEU  15          HD11      LEU  15  35.768  15.476   4.318
  125   HD12  LEU  15          HD12      LEU  15  35.867  15.434   2.558
  126   HD13  LEU  15          HD13      LEU  15  34.660  14.459   3.396
  127   HD21  LEU  15          HD21      LEU  15  32.652  17.209   1.982
  128   HD22  LEU  15          HD22      LEU  15  32.937  15.470   1.968
  129   HD23  LEU  15          HD23      LEU  15  34.077  16.556   1.176
  130    H    SER  16           HN       SER  16  32.678  18.415   7.167
  131    HA   SER  16           HA       SER  16  30.188  17.123   7.916
  132    HB2  SER  16           HB2      SER  16  30.818  17.614  10.173
  133    HB3  SER  16           HB1      SER  16  32.272  17.087   9.331
  134    HG   SER  16           HG       SER  16  31.522  19.631  10.228
  135    H    ALA  17           HN       ALA  17  31.484  20.424   7.703
  136    HA   ALA  17           HA       ALA  17  29.272  21.765   8.807
  137    HB1  ALA  17           HB1      ALA  17  30.259  23.728   8.005
  138    HB2  ALA  17           HB2      ALA  17  30.875  22.939   6.552
  139    HB3  ALA  17           HB3      ALA  17  31.644  22.639   8.111
  140    H    LEU  18           HN       LEU  18  30.050  20.967   5.414
  141    HA   LEU  18           HA       LEU  18  27.637  22.069   4.379
  142    HB2  LEU  18           HB2      LEU  18  29.869  20.424   3.336
  143    HB3  LEU  18           HB1      LEU  18  28.341  20.333   2.461
  144    HG   LEU  18           HG       LEU  18  29.946  22.151   1.687
  145   HD11  LEU  18          HD11      LEU  18  27.310  23.247   2.686
  146   HD12  LEU  18          HD12      LEU  18  27.406  22.098   1.350
  147   HD13  LEU  18          HD13      LEU  18  28.180  23.677   1.215
  148   HD21  LEU  18          HD21      LEU  18  30.284  24.087   3.022
  149   HD22  LEU  18          HD22      LEU  18  30.530  22.745   4.139
  150   HD23  LEU  18          HD23      LEU  18  29.008  23.637   4.152
  151    H    HIS  19           HN       HIS  19  28.650  18.815   5.324
  152    HA   HIS  19           HA       HIS  19  26.480  17.372   4.427
  153    HB2  HIS  19           HB2      HIS  19  28.339  16.224   5.390
  154    HB3  HIS  19           HB1      HIS  19  28.126  17.051   6.932
  155    HD2  HIS  19           HD2      HIS  19  24.992  15.491   5.147
  156    HE1  HIS  19           HE1      HIS  19  25.840  13.177   8.576
  157    HE2  HIS  19           HE2      HIS  19  24.172  13.557   6.699
  158    H    PHE  20           HN       PHE  20  26.775  19.207   7.450
  159    HA   PHE  20           HA       PHE  20  24.123  18.461   8.318
  160    HB2  PHE  20           HB2      PHE  20  26.427  19.684   9.453
  161    HB3  PHE  20           HB1      PHE  20  25.065  20.783   9.662
  162    HD1  PHE  20           HD1      PHE  20  25.994  17.167  10.026
  163    HD2  PHE  20           HD2      PHE  20  23.523  20.411  11.380
  164    HE1  PHE  20           HE1      PHE  20  25.102  15.733  11.843
  165    HE2  PHE  20           HE2      PHE  20  22.634  18.976  13.196
  166    HZ   PHE  20           HZ       PHE  20  23.415  16.635  13.421
  167    H    MET  21           HN       MET  21  25.533  21.016   6.402
  168    HA   MET  21           HA       MET  21  23.392  22.888   6.728
  169    HB2  MET  21           HB2      MET  21  25.644  22.555   4.776
  170    HB3  MET  21           HB1      MET  21  24.407  23.788   4.536
  171    HG2  MET  21           HG2      MET  21  24.907  24.831   6.630
  172    HG3  MET  21           HG1      MET  21  25.932  23.492   7.135
  173    HE1  MET  21           HE1      MET  21  28.156  25.377   7.579
  174    HE2  MET  21           HE2      MET  21  26.613  26.219   7.474
  175    HE3  MET  21           HE3      MET  21  27.999  26.817   6.565
  176    H    ALA  22           HN       ALA  22  24.301  20.862   3.938
  177    HA   ALA  22           HA       ALA  22  21.910  21.326   2.499
  178    HB1  ALA  22           HB1      ALA  22  24.146  20.415   1.636
  179    HB2  ALA  22           HB2      ALA  22  22.677  19.693   0.981
  180    HB3  ALA  22           HB3      ALA  22  23.597  18.847   2.226
  181    H    TRP  23           HN       TRP  23  22.896  18.711   4.695
  182    HA   TRP  23           HA       TRP  23  20.615  17.084   4.326
  183    HB2  TRP  23           HB2      TRP  23  22.733  16.364   5.429
  184    HB3  TRP  23           HB1      TRP  23  22.290  17.338   6.830
  185    HD1  TRP  23           HD1      TRP  23  20.730  14.533   4.678
  186    HE1  TRP  23           HE1      TRP  23  19.363  13.003   6.237
  187    HE3  TRP  23           HE3      TRP  23  21.356  16.998   9.110
  188    HZ2  TRP  23           HZ2      TRP  23  18.635  12.841   8.999
  189    HZ3  TRP  23           HZ3      TRP  23  20.316  16.132  11.187
  190    HH2  TRP  23           HH2      TRP  23  18.957  14.059  11.137
  191    H    THR  24           HN       THR  24  21.248  19.807   6.487
  192    HA   THR  24           HA       THR  24  18.880  19.523   8.051
  193    HB   THR  24           HB       THR  24  20.775  21.809   7.546
  194    HG1  THR  24           HG1      THR  24  21.536  21.228   9.455
  195   HG21  THR  24          HG21      THR  24  18.214  21.762   9.148
  196   HG22  THR  24          HG22      THR  24  18.697  22.912   7.900
  197   HG23  THR  24          HG23      THR  24  19.512  22.914   9.464
  198    H    ILE  25           HN       ILE  25  19.672  21.431   5.155
  199    HA   ILE  25           HA       ILE  25  17.229  22.827   4.996
  200    HB   ILE  25           HB       ILE  25  19.201  22.012   2.851
  201   HG12  ILE  25          HG12      ILE  25  18.708  24.709   4.147
  202   HG13  ILE  25          HG11      ILE  25  19.927  23.575   4.727
  203   HG21  ILE  25          HG21      ILE  25  18.057  23.930   1.592
  204   HG22  ILE  25          HG22      ILE  25  16.750  23.789   2.768
  205   HG23  ILE  25          HG23      ILE  25  17.140  22.429   1.714
  206   HD11  ILE  25          HD11      ILE  25  19.800  24.963   2.044
  207   HD12  ILE  25          HD12      ILE  25  20.823  23.551   2.317
  208   HD13  ILE  25          HD13      ILE  25  21.093  25.028   3.243
  209    H    GLY  26           HN       GLY  26  18.278  19.731   3.630
  210    HA2  GLY  26           HA2      GLY  26  15.964  19.189   2.105
  211    HA3  GLY  26           HA1      GLY  26  17.102  17.982   2.699
  212    H    HIS  27           HN       HIS  27  16.807  18.509   5.465
  213    HA   HIS  27           HA       HIS  27  14.495  16.933   6.048
  214    HB2  HIS  27           HB2      HIS  27  16.306  16.635   7.517
  215    HB3  HIS  27           HB1      HIS  27  16.516  18.370   7.754
  216    HD2  HIS  27           HD2      HIS  27  15.018  19.437   9.840
  217    HE1  HIS  27           HE1      HIS  27  12.668  16.023  10.645
  218    HE2  HIS  27           HE2      HIS  27  13.250  18.367  11.433
  219    H    LEU  28           HN       LEU  28  15.267  20.369   6.342
  220    HA   LEU  28           HA       LEU  28  12.932  21.117   7.774
  221    HB2  LEU  28           HB2      LEU  28  15.193  22.409   7.227
  222    HB3  LEU  28           HB1      LEU  28  14.225  23.029   5.888
  223    HG   LEU  28           HG       LEU  28  12.486  23.197   8.034
  224   HD11  LEU  28          HD11      LEU  28  14.360  22.669   9.573
  225   HD12  LEU  28          HD12      LEU  28  13.752  24.305   9.823
  226   HD13  LEU  28          HD13      LEU  28  15.255  24.048   8.935
  227   HD21  LEU  28          HD21      LEU  28  13.013  24.853   6.180
  228   HD22  LEU  28          HD22      LEU  28  14.386  25.386   7.151
  229   HD23  LEU  28          HD23      LEU  28  12.744  25.575   7.766
  230    H    ASN  29           HN       ASN  29  10.959  21.842   7.088
  231    HA   ASN  29           HA       ASN  29  10.428  21.877   4.191
  232    HB2  ASN  29           HB2      ASN  29   8.762  20.414   6.253
  233    HB3  ASN  29           HB1      ASN  29   8.330  20.627   4.557
  234   HD21  ASN  29          HD21      ASN  29   9.128  18.139   6.252
  235   HD22  ASN  29          HD22      ASN  29  10.322  17.392   5.304
  236    H    GLN  30           HN       GLN  30   9.092  23.486   3.550
  237    HA   GLN  30           HA       GLN  30   8.069  25.281   5.646
  238    HB2  GLN  30           HB2      GLN  30   8.515  25.716   2.683
  239    HB3  GLN  30           HB1      GLN  30   7.869  26.926   3.791
  240    HG2  GLN  30           HG2      GLN  30  10.520  25.554   4.261
  241    HG3  GLN  30           HG1      GLN  30  10.382  27.051   3.342
  242   HE21  GLN  30          HE21      GLN  30   9.599  28.987   4.513
  243   HE22  GLN  30          HE22      GLN  30   9.693  29.057   6.206
  244    H    ILE  31           HN       ILE  31   5.959  25.424   6.053
  245    HA   ILE  31           HA       ILE  31   4.037  24.613   3.973
  246    HB   ILE  31           HB       ILE  31   2.719  23.392   5.675
  247   HG12  ILE  31          HG12      ILE  31   5.171  23.746   7.428
  248   HG13  ILE  31          HG11      ILE  31   3.677  24.662   7.628
  249   HG21  ILE  31          HG21      ILE  31   4.217  21.435   5.827
  250   HG22  ILE  31          HG22      ILE  31   5.592  22.455   5.399
  251   HG23  ILE  31          HG23      ILE  31   4.304  22.174   4.228
  252   HD11  ILE  31          HD11      ILE  31   2.421  22.594   8.000
  253   HD12  ILE  31          HD12      ILE  31   3.767  22.687   9.136
  254   HD13  ILE  31          HD13      ILE  31   3.877  21.637   7.724
  255    H    LYS  32           HN       LYS  32   2.038  25.648   4.073
  256    HA   LYS  32           HA       LYS  32   1.799  27.802   6.084
  257    HB2  LYS  32           HB2      LYS  32   1.630  27.934   3.106
  258    HB3  LYS  32           HB1      LYS  32   0.545  28.961   4.046
  259    HG2  LYS  32           HG2      LYS  32   3.488  28.844   4.684
  260    HG3  LYS  32           HG1      LYS  32   2.881  29.909   3.415
  261    HD2  LYS  32           HD2      LYS  32   1.366  30.991   5.007
  262    HD3  LYS  32           HD1      LYS  32   1.894  29.894   6.283
  263    HE2  LYS  32           HE2      LYS  32   4.210  30.759   6.043
  264    HE3  LYS  32           HE1      LYS  32   3.641  31.893   4.817
  265    HZ1  LYS  32           HZ1      LYS  32   3.729  32.980   6.940
  266    HZ2  LYS  32           HZ2      LYS  32   2.768  31.773   7.653
  267    HZ3  LYS  32           HZ3      LYS  32   2.106  32.810   6.480
  268    H    ARG  33           HN       ARG  33   0.250  26.908   7.363
  269    HA   ARG  33           HA       ARG  33  -2.092  25.640   6.174
  270    HB2  ARG  33           HB2      ARG  33  -0.717  25.300   8.570
  271    HB3  ARG  33           HB1      ARG  33  -2.215  26.102   9.046
  272    HG2  ARG  33           HG2      ARG  33  -2.817  23.830   9.064
  273    HG3  ARG  33           HG1      ARG  33  -3.364  24.365   7.474
  274    HD2  ARG  33           HD2      ARG  33  -1.402  23.465   6.413
  275    HD3  ARG  33           HD1      ARG  33  -0.645  23.136   7.968
  276    HE   ARG  33           HE       ARG  33  -3.121  21.755   7.777
  277   HH11  ARG  33          HH11      ARG  33   0.154  21.750   6.565
  278   HH12  ARG  33          HH12      ARG  33   0.172  20.042   6.283
  279   HH21  ARG  33          HH21      ARG  33  -3.065  19.522   7.397
  280   HH22  ARG  33          HH22      ARG  33  -1.634  18.790   6.749
  281    H1   MET   1           HT1      MET   1  47.402  15.430  28.853
  282    H2   MET   1           HT2      MET   1  45.899  15.512  29.640
  283    H3   MET   1           HT3      MET   1  47.306  16.037  30.435
  284    HA   MET   1           HA       MET   1  47.529  17.916  29.071
  285    HB2  MET   1           HB2      MET   1  46.002  16.232  27.248
  286    HB3  MET   1           HB1      MET   1  45.345  17.867  27.322
  287    HG2  MET   1           HG2      MET   1  47.233  18.818  26.423
  288    HG3  MET   1           HG1      MET   1  48.307  17.625  27.151
  289    HE1  MET   1           HE1      MET   1  49.577  15.963  25.567
  290    HE2  MET   1           HE2      MET   1  48.503  14.721  24.928
  291    HE3  MET   1           HE3      MET   1  48.331  15.248  26.600
  292    H    PHE   2           HN       PHE   2  46.129  19.836  29.126
  293    HA   PHE   2           HA       PHE   2  44.565  19.959  31.456
  294    HB2  PHE   2           HB2      PHE   2  45.594  21.957  30.583
  295    HB3  PHE   2           HB1      PHE   2  44.699  21.815  29.070
  296    HD1  PHE   2           HD1      PHE   2  44.256  22.251  32.754
  297    HD2  PHE   2           HD2      PHE   2  42.540  22.743  28.847
  298    HE1  PHE   2           HE1      PHE   2  42.374  23.529  33.741
  299    HE2  PHE   2           HE2      PHE   2  40.657  24.020  29.835
  300    HZ   PHE   2           HZ       PHE   2  40.574  24.413  32.282
  301    H    GLU   3           HN       GLU   3  43.589  19.896  28.035
  302    HA   GLU   3           HA       GLU   3  40.796  19.837  28.671
  303    HB2  GLU   3           HB2      GLU   3  42.308  19.351  26.098
  304    HB3  GLU   3           HB1      GLU   3  40.551  19.315  26.212
  305    HG2  GLU   3           HG2      GLU   3  40.955  21.534  25.602
  306    HG3  GLU   3           HG1      GLU   3  40.815  21.641  27.356
  307    HA   PRO   4           HA       PRO   4  39.879  15.577  29.291
  308    HB2  PRO   4           HB2      PRO   4  38.076  15.689  26.911
  309    HB3  PRO   4           HB1      PRO   4  37.720  15.178  28.573
  310    HG2  PRO   4           HG2      PRO   4  36.896  17.527  27.630
  311    HG3  PRO   4           HG1      PRO   4  37.416  17.328  29.313
  312    HD2  PRO   4           HD2      PRO   4  38.823  18.648  27.054
  313    HD3  PRO   4           HD1      PRO   4  38.888  19.010  28.788
  314    H    PHE   5           HN       PHE   5  40.392  16.526  25.912
  315    HA   PHE   5           HA       PHE   5  42.318  14.422  25.516
  316    HB2  PHE   5           HB2      PHE   5  39.594  13.875  24.867
  317    HB3  PHE   5           HB1      PHE   5  40.488  14.044  23.356
  318    HD1  PHE   5           HD1      PHE   5  40.212  12.158  26.514
  319    HD2  PHE   5           HD2      PHE   5  42.289  12.520  22.773
  320    HE1  PHE   5           HE1      PHE   5  41.210   9.913  26.851
  321    HE2  PHE   5           HE2      PHE   5  43.287  10.275  23.109
  322    HZ   PHE   5           HZ       PHE   5  42.746   8.970  25.148
  323    H    GLN   6           HN       GLN   6  40.113  16.147  23.298
  324    HA   GLN   6           HA       GLN   6  42.154  18.034  22.529
  325    HB2  GLN   6           HB2      GLN   6  42.649  15.788  21.307
  326    HB3  GLN   6           HB1      GLN   6  41.232  16.194  20.334
  327    HG2  GLN   6           HG2      GLN   6  42.222  18.311  19.677
  328    HG3  GLN   6           HG1      GLN   6  43.586  18.053  20.762
  329   HE21  GLN   6          HE21      GLN   6  45.235  16.521  20.110
  330   HE22  GLN   6          HE22      GLN   6  45.288  15.882  18.538
  331    H    ILE   7           HN       ILE   7  41.346  19.552  20.895
  332    HA   ILE   7           HA       ILE   7  38.698  20.365  21.410
  333    HB   ILE   7           HB       ILE   7  40.627  21.114  19.204
  334   HG12  ILE   7          HG12      ILE   7  39.723  22.653  21.653
  335   HG13  ILE   7          HG11      ILE   7  41.176  21.653  21.623
  336   HG21  ILE   7          HG21      ILE   7  38.402  21.593  18.389
  337   HG22  ILE   7          HG22      ILE   7  39.103  23.114  18.944
  338   HG23  ILE   7          HG23      ILE   7  37.925  22.269  19.946
  339   HD11  ILE   7          HD11      ILE   7  41.873  23.899  21.126
  340   HD12  ILE   7          HD12      ILE   7  40.589  24.096  19.933
  341   HD13  ILE   7          HD13      ILE   7  41.933  22.999  19.610
  342    H    LEU   8           HN       LEU   8  40.127  18.611  18.696
  343    HA   LEU   8           HA       LEU   8  37.753  18.500  17.116
  344    HB2  LEU   8           HB2      LEU   8  40.298  16.872  17.098
  345    HB3  LEU   8           HB1      LEU   8  38.985  16.605  15.950
  346    HG   LEU   8           HG       LEU   8  40.211  19.337  16.369
  347   HD11  LEU   8          HD11      LEU   8  40.966  17.254  14.295
  348   HD12  LEU   8          HD12      LEU   8  41.973  17.728  15.663
  349   HD13  LEU   8          HD13      LEU   8  41.601  18.896  14.394
  350   HD21  LEU   8          HD21      LEU   8  38.072  19.389  15.255
  351   HD22  LEU   8          HD22      LEU   8  38.510  18.024  14.229
  352   HD23  LEU   8          HD23      LEU   8  39.299  19.585  14.005
  353    H    SER   9           HN       SER   9  39.119  16.465  19.606
  354    HA   SER   9           HA       SER   9  37.336  14.255  19.229
  355    HB2  SER   9           HB2      SER   9  39.475  13.944  20.355
  356    HB3  SER   9           HB1      SER   9  38.990  15.054  21.634
  357    HG   SER   9           HG       SER   9  37.348  13.616  22.190
  358    H    ILE  10           HN       ILE  10  37.378  17.040  21.423
  359    HA   ILE  10           HA       ILE  10  35.082  16.318  22.912
  360    HB   ILE  10           HB       ILE  10  36.353  19.008  22.374
  361   HG12  ILE  10          HG12      ILE  10  36.403  17.337  24.893
  362   HG13  ILE  10          HG11      ILE  10  37.623  17.158  23.634
  363   HG21  ILE  10          HG21      ILE  10  34.149  18.172  24.281
  364   HG22  ILE  10          HG22      ILE  10  34.056  19.393  23.013
  365   HG23  ILE  10          HG23      ILE  10  35.053  19.678  24.439
  366   HD11  ILE  10          HD11      ILE  10  37.102  19.496  25.447
  367   HD12  ILE  10          HD12      ILE  10  37.818  19.789  23.862
  368   HD13  ILE  10          HD13      ILE  10  38.632  18.738  25.015
  369    H    CYS  11           HN       CYS  11  35.529  18.426  20.071
  370    HA   CYS  11           HA       CYS  11  32.866  19.301  19.863
  371    HB2  CYS  11           HB2      CYS  11  35.022  18.923  17.782
  372    HB3  CYS  11           HB1      CYS  11  33.462  19.670  17.434
  373    HG   CYS  11           HG       CYS  11  34.416  21.760  18.342
  374    H    SER  12           HN       SER  12  34.519  16.599  18.177
  375    HA   SER  12           HA       SER  12  32.280  15.676  16.782
  376    HB2  SER  12           HB2      SER  12  34.680  14.176  17.834
  377    HB3  SER  12           HB1      SER  12  33.510  13.500  16.704
  378    HG   SER  12           HG       SER  12  34.048  15.169  15.261
  379    H    PHE  13           HN       PHE  13  33.415  14.966  20.051
  380    HA   PHE  13           HA       PHE  13  31.689  12.832  20.650
  381    HB2  PHE  13           HB2      PHE  13  33.539  13.381  22.108
  382    HB3  PHE  13           HB1      PHE  13  32.855  14.973  22.438
  383    HD1  PHE  13           HD1      PHE  13  32.390  11.328  22.935
  384    HD2  PHE  13           HD2      PHE  13  31.048  15.268  23.995
  385    HE1  PHE  13           HE1      PHE  13  31.042  10.372  24.785
  386    HE2  PHE  13           HE2      PHE  13  29.702  14.313  25.845
  387    HZ   PHE  13           HZ       PHE  13  29.699  11.864  26.241
  388    H    ILE  14           HN       ILE  14  31.272  16.328  21.245
  389    HA   ILE  14           HA       ILE  14  28.653  16.082  22.326
  390    HB   ILE  14           HB       ILE  14  30.104  18.426  21.093
  391   HG12  ILE  14          HG12      ILE  14  29.407  17.825  23.980
  392   HG13  ILE  14          HG11      ILE  14  30.949  17.379  23.250
  393   HG21  ILE  14          HG21      ILE  14  27.732  18.849  20.877
  394   HG22  ILE  14          HG22      ILE  14  28.316  19.769  22.263
  395   HG23  ILE  14          HG23      ILE  14  27.432  18.265  22.515
  396   HD11  ILE  14          HD11      ILE  14  29.815  20.163  23.599
  397   HD12  ILE  14          HD12      ILE  14  31.214  19.815  22.584
  398   HD13  ILE  14          HD13      ILE  14  31.284  19.504  24.319
  399    H    LEU  15           HN       LEU  15  29.861  16.777  19.083
  400    HA   LEU  15           HA       LEU  15  27.375  17.323  17.860
  401    HB2  LEU  15           HB2      LEU  15  29.980  16.282  16.718
  402    HB3  LEU  15           HB1      LEU  15  28.605  16.786  15.738
  403    HG   LEU  15           HG       LEU  15  29.789  18.623  17.819
  404   HD11  LEU  15          HD11      LEU  15  31.616  17.960  16.297
  405   HD12  LEU  15          HD12      LEU  15  31.137  19.633  16.007
  406   HD13  LEU  15          HD13      LEU  15  30.608  18.360  14.907
  407   HD21  LEU  15          HD21      LEU  15  27.546  19.114  16.815
  408   HD22  LEU  15          HD22      LEU  15  28.300  19.133  15.221
  409   HD23  LEU  15          HD23      LEU  15  28.749  20.341  16.424
  410    H    SER  16           HN       SER  16  28.942  14.363  18.767
  411    HA   SER  16           HA       SER  16  27.311  12.700  17.040
  412    HB2  SER  16           HB2      SER  16  28.479  10.852  18.013
  413    HB3  SER  16           HB1      SER  16  29.663  12.127  17.747
  414    HG   SER  16           HG       SER  16  28.539  11.166  20.127
  415    H    ALA  17           HN       ALA  17  27.466  13.535  20.490
  416    HA   ALA  17           HA       ALA  17  25.449  11.800  21.388
  417    HB1  ALA  17           HB1      ALA  17  25.508  13.013  23.387
  418    HB2  ALA  17           HB2      ALA  17  25.811  14.543  22.563
  419    HB3  ALA  17           HB3      ALA  17  27.100  13.349  22.708
  420    H    LEU  18           HN       LEU  18  25.262  15.193  20.307
  421    HA   LEU  18           HA       LEU  18  22.432  15.361  20.593
  422    HB2  LEU  18           HB2      LEU  18  24.571  17.037  19.413
  423    HB3  LEU  18           HB1      LEU  18  22.934  17.299  18.812
  424    HG   LEU  18           HG       LEU  18  23.605  18.700  20.828
  425   HD11  LEU  18          HD11      LEU  18  21.246  16.887  21.375
  426   HD12  LEU  18          HD12      LEU  18  21.223  18.101  20.096
  427   HD13  LEU  18          HD13      LEU  18  21.424  18.595  21.777
  428   HD21  LEU  18          HD21      LEU  18  23.788  17.691  22.971
  429   HD22  LEU  18          HD22      LEU  18  24.765  16.663  21.923
  430   HD23  LEU  18          HD23      LEU  18  23.144  16.152  22.397
  431    H    HIS  19           HN       HIS  19  24.587  14.656  17.882
  432    HA   HIS  19           HA       HIS  19  22.754  14.636  15.821
  433    HB2  HIS  19           HB2      HIS  19  25.072  14.336  15.333
  434    HB3  HIS  19           HB1      HIS  19  25.150  12.871  16.310
  435    HD2  HIS  19           HD2      HIS  19  22.189  13.323  13.763
  436    HE1  HIS  19           HE1      HIS  19  24.742  10.297  12.291
  437    HE2  HIS  19           HE2      HIS  19  22.516  11.470  11.951
  438    H    PHE  20           HN       PHE  20  23.495  12.018  18.101
  439    HA   PHE  20           HA       PHE  20  21.602  10.222  16.871
  440    HB2  PHE  20           HB2      PHE  20  23.693  10.063  18.793
  441    HB3  PHE  20           HB1      PHE  20  22.219   9.442  19.536
  442    HD1  PHE  20           HD1      PHE  20  24.211   9.229  16.364
  443    HD2  PHE  20           HD2      PHE  20  21.512   7.264  19.067
  444    HE1  PHE  20           HE1      PHE  20  24.421   7.132  15.052
  445    HE2  PHE  20           HE2      PHE  20  21.722   5.170  17.757
  446    HZ   PHE  20           HZ       PHE  20  23.166   5.104  15.744
  447    H    MET  21           HN       MET  21  21.508  12.651  19.379
  448    HA   MET  21           HA       MET  21  19.148  11.693  20.679
  449    HB2  MET  21           HB2      MET  21  20.629  14.302  20.617
  450    HB3  MET  21           HB1      MET  21  19.084  14.152  21.453
  451    HG2  MET  21           HG2      MET  21  19.926  12.437  22.896
  452    HG3  MET  21           HG1      MET  21  21.400  12.263  21.949
  453    HE1  MET  21           HE1      MET  21  23.006  12.759  24.381
  454    HE2  MET  21           HE2      MET  21  21.341  12.339  24.775
  455    HE3  MET  21           HE3      MET  21  22.103  13.719  25.562
  456    H    ALA  22           HN       ALA  22  19.634  14.500  18.546
  457    HA   ALA  22           HA       ALA  22  16.879  15.019  18.166
  458    HB1  ALA  22           HB1      ALA  22  18.871  16.570  17.718
  459    HB2  ALA  22           HB2      ALA  22  17.541  16.613  16.562
  460    HB3  ALA  22           HB3      ALA  22  19.018  15.733  16.173
  461    H    TRP  23           HN       TRP  23  19.232  13.169  16.255
  462    HA   TRP  23           HA       TRP  23  17.527  12.608  14.071
  463    HB2  TRP  23           HB2      TRP  23  20.001  12.292  14.081
  464    HB3  TRP  23           HB1      TRP  23  19.780  10.885  15.120
  465    HD1  TRP  23           HD1      TRP  23  18.475  12.172  11.719
  466    HE1  TRP  23           HE1      TRP  23  18.196  10.143  10.155
  467    HE3  TRP  23           HE3      TRP  23  19.790   8.408  14.913
  468    HZ2  TRP  23           HZ2      TRP  23  18.495   7.299  10.246
  469    HZ3  TRP  23           HZ3      TRP  23  19.786   6.052  14.146
  470    HH2  TRP  23           HH2      TRP  23  19.141   5.494  11.820
  471    H    THR  24           HN       THR  24  18.038  10.960  17.159
  472    HA   THR  24           HA       THR  24  16.490   8.651  16.546
  473    HB   THR  24           HB       THR  24  17.367   9.932  19.125
  474    HG1  THR  24           HG1      THR  24  18.853   8.403  19.055
  475   HG21  THR  24          HG21      THR  24  15.607   7.517  18.686
  476   HG22  THR  24          HG22      THR  24  15.299   8.916  19.715
  477   HG23  THR  24          HG23      THR  24  16.545   7.752  20.161
  478    H    ILE  25           HN       ILE  25  15.710  11.727  18.136
  479    HA   ILE  25           HA       ILE  25  13.054  11.095  18.831
  480    HB   ILE  25           HB       ILE  25  14.361  13.752  18.210
  481   HG12  ILE  25          HG12      ILE  25  13.565  12.522  20.866
  482   HG13  ILE  25          HG11      ILE  25  15.180  12.356  20.175
  483   HG21  ILE  25          HG21      ILE  25  12.368  14.630  19.559
  484   HG22  ILE  25          HG22      ILE  25  11.618  13.057  19.287
  485   HG23  ILE  25          HG23      ILE  25  12.012  14.094  17.917
  486   HD11  ILE  25          HD11      ILE  25  13.783  14.887  21.056
  487   HD12  ILE  25          HD12      ILE  25  15.199  14.920  20.005
  488   HD13  ILE  25          HD13      ILE  25  15.321  14.238  21.627
  489    H    GLY  26           HN       GLY  26  14.438  12.560  15.919
  490    HA2  GLY  26           HA2      GLY  26  12.008  13.128  14.592
  491    HA3  GLY  26           HA1      GLY  26  13.572  12.910  13.810
  492    H    HIS  27           HN       HIS  27  14.072  10.258  14.651
  493    HA   HIS  27           HA       HIS  27  12.627   8.797  12.672
  494    HB2  HIS  27           HB2      HIS  27  14.825   8.059  13.064
  495    HB3  HIS  27           HB1      HIS  27  14.592   8.013  14.813
  496    HD2  HIS  27           HD2      HIS  27  13.620   5.596  15.782
  497    HE1  HIS  27           HE1      HIS  27  12.753   3.805  12.058
  498    HE2  HIS  27           HE2      HIS  27  12.859   3.415  14.566
  499    H    LEU  28           HN       LEU  28  12.447   8.974  16.198
  500    HA   LEU  28           HA       LEU  28  10.593   6.860  16.551
  501    HB2  LEU  28           HB2      LEU  28  12.077   8.251  18.265
  502    HB3  LEU  28           HB1      LEU  28  10.591   9.190  18.411
  503    HG   LEU  28           HG       LEU  28   9.677   6.578  18.470
  504   HD11  LEU  28          HD11      LEU  28  12.020   5.782  18.671
  505   HD12  LEU  28          HD12      LEU  28  11.083   5.426  20.122
  506   HD13  LEU  28          HD13      LEU  28  12.219   6.776  20.114
  507   HD21  LEU  28          HD21      LEU  28   9.065   8.588  19.896
  508   HD22  LEU  28          HD22      LEU  28  10.468   8.211  20.896
  509   HD23  LEU  28          HD23      LEU  28   9.141   7.057  20.768
  510    H    ASN  29           HN       ASN  29   8.383   6.835  16.655
  511    HA   ASN  29           HA       ASN  29   6.944   9.346  16.108
  512    HB2  ASN  29           HB2      ASN  29   6.538   6.744  14.614
  513    HB3  ASN  29           HB1      ASN  29   5.534   8.183  14.449
  514   HD21  ASN  29          HD21      ASN  29   7.528   6.740  12.536
  515   HD22  ASN  29          HD22      ASN  29   8.504   8.008  11.968
  516    H    GLN  30           HN       GLN  30   5.068   9.557  17.213
  517    HA   GLN  30           HA       GLN  30   4.323   7.340  19.002
  518    HB2  GLN  30           HB2      GLN  30   3.628  10.286  19.069
  519    HB3  GLN  30           HB1      GLN  30   3.059   9.093  20.237
  520    HG2  GLN  30           HG2      GLN  30   5.994   9.524  19.660
  521    HG3  GLN  30           HG1      GLN  30   5.137  10.414  20.917
  522   HE21  GLN  30          HE21      GLN  30   4.267   9.152  22.754
  523   HE22  GLN  30          HE22      GLN  30   4.884   7.609  23.101
  524    H    ILE  31           HN       ILE  31   2.517   6.212  18.676
  525    HA   ILE  31           HA       ILE  31   0.336   7.414  17.104
  526    HB   ILE  31           HB       ILE  31   0.059   5.285  15.872
  527   HG12  ILE  31          HG12      ILE  31   2.741   4.553  17.088
  528   HG13  ILE  31          HG11      ILE  31   1.201   3.881  17.625
  529   HG21  ILE  31          HG21      ILE  31   2.018   5.568  14.396
  530   HG22  ILE  31          HG22      ILE  31   2.822   6.520  15.644
  531   HG23  ILE  31          HG23      ILE  31   1.357   7.131  14.875
  532   HD11  ILE  31          HD11      ILE  31   0.784   2.969  15.390
  533   HD12  ILE  31          HD12      ILE  31   2.340   2.396  15.991
  534   HD13  ILE  31          HD13      ILE  31   2.280   3.691  14.797
  535    H    LYS  32           HN       LYS  32  -1.727   6.654  17.608
  536    HA   LYS  32           HA       LYS  32  -1.897   4.822  19.921
  537    HB2  LYS  32           HB2      LYS  32  -3.064   7.544  19.548
  538    HB3  LYS  32           HB1      LYS  32  -4.027   6.339  20.405
  539    HG2  LYS  32           HG2      LYS  32  -1.135   6.790  21.123
  540    HG3  LYS  32           HG1      LYS  32  -2.404   7.815  21.797
  541    HD2  LYS  32           HD2      LYS  32  -3.554   5.847  22.695
  542    HD3  LYS  32           HD1      LYS  32  -2.342   4.787  21.976
  543    HE2  LYS  32           HE2      LYS  32  -0.590   5.891  23.347
  544    HE3  LYS  32           HE1      LYS  32  -1.831   6.895  24.096
  545    HZ1  LYS  32           HZ1      LYS  32  -1.369   5.011  25.488
  546    HZ2  LYS  32           HZ2      LYS  32  -1.653   3.933  24.205
  547    HZ3  LYS  32           HZ3      LYS  32  -2.931   4.850  24.848
  548    H    ARG  33           HN       ARG  33  -2.616   3.024  18.881
  549    HA   ARG  33           HA       ARG  33  -4.752   3.221  16.905
  550    HB2  ARG  33           HB2      ARG  33  -2.629   1.461  17.288
  551    HB3  ARG  33           HB1      ARG  33  -4.052   0.527  17.755
  552    HG2  ARG  33           HG2      ARG  33  -3.938   0.166  15.436
  553    HG3  ARG  33           HG1      ARG  33  -5.102   1.487  15.567
  554    HD2  ARG  33           HD2      ARG  33  -3.421   3.121  15.032
  555    HD3  ARG  33           HD1      ARG  33  -2.139   1.920  15.144
  556    HE   ARG  33           HE       ARG  33  -4.034   1.137  13.178
  557   HH11  ARG  33          HH11      ARG  33  -1.486   3.443  13.800
  558   HH12  ARG  33          HH12      ARG  33  -1.075   3.618  12.129
  559   HH21  ARG  33          HH21      ARG  33  -3.470   1.389  10.998
  560   HH22  ARG  33          HH22      ARG  33  -2.189   2.466  10.554
  561    H1   MET   1           HT1      MET   1  50.325  -1.198  21.786
  562    H2   MET   1           HT2      MET   1  49.224  -2.453  21.467
  563    H3   MET   1           HT3      MET   1  50.621  -2.758  22.386
  564    HA   MET   1           HA       MET   1  49.840  -1.539  24.214
  565    HB2  MET   1           HB2      MET   1  48.299  -0.222  22.121
  566    HB3  MET   1           HB1      MET   1  47.289  -0.631  23.509
  567    HG2  MET   1           HG2      MET   1  48.421   0.780  24.925
  568    HG3  MET   1           HG1      MET   1  49.960   0.546  24.098
  569    HE1  MET   1           HE1      MET   1  51.005   2.587  22.817
  570    HE2  MET   1           HE2      MET   1  50.157   2.908  21.306
  571    HE3  MET   1           HE3      MET   1  50.439   1.245  21.814
  572    H    PHE   2           HN       PHE   2  48.074  -2.197  25.665
  573    HA   PHE   2           HA       PHE   2  47.437  -4.923  25.410
  574    HB2  PHE   2           HB2      PHE   2  47.515  -3.895  27.591
  575    HB3  PHE   2           HB1      PHE   2  46.228  -2.769  27.159
  576    HD1  PHE   2           HD1      PHE   2  46.984  -6.407  27.558
  577    HD2  PHE   2           HD2      PHE   2  43.959  -3.359  27.440
  578    HE1  PHE   2           HE1      PHE   2  45.285  -8.063  28.284
  579    HE2  PHE   2           HE2      PHE   2  42.262  -5.015  28.167
  580    HZ   PHE   2           HZ       PHE   2  42.925  -7.367  28.588
  581    H    GLU   3           HN       GLU   3  45.398  -2.038  24.979
  582    HA   GLU   3           HA       GLU   3  43.128  -3.575  24.154
  583    HB2  GLU   3           HB2      GLU   3  43.730  -0.615  24.041
  584    HB3  GLU   3           HB1      GLU   3  42.203  -1.313  23.513
  585    HG2  GLU   3           HG2      GLU   3  41.744  -0.764  25.738
  586    HG3  GLU   3           HG1      GLU   3  42.194  -2.464  25.851
  587    HA   PRO   4           HA       PRO   4  43.685  -4.165  19.828
  588    HB2  PRO   4           HB2      PRO   4  41.216  -2.551  19.358
  589    HB3  PRO   4           HB1      PRO   4  41.610  -4.195  18.818
  590    HG2  PRO   4           HG2      PRO   4  39.901  -3.755  20.811
  591    HG3  PRO   4           HG1      PRO   4  41.001  -5.143  20.816
  592    HD2  PRO   4           HD2      PRO   4  41.123  -2.639  22.410
  593    HD3  PRO   4           HD1      PRO   4  41.678  -4.271  22.828
  594    H    PHE   5           HN       PHE   5  42.728  -0.887  20.790
  595    HA   PHE   5           HA       PHE   5  44.894   0.283  19.298
  596    HB2  PHE   5           HB2      PHE   5  42.374   0.006  17.991
  597    HB3  PHE   5           HB1      PHE   5  42.607   1.715  18.359
  598    HD1  PHE   5           HD1      PHE   5  43.963  -1.206  16.561
  599    HD2  PHE   5           HD2      PHE   5  44.442   2.981  17.388
  600    HE1  PHE   5           HE1      PHE   5  45.590  -1.025  14.698
  601    HE2  PHE   5           HE2      PHE   5  46.069   3.164  15.526
  602    HZ   PHE   5           HZ       PHE   5  46.643   1.161  14.180
  603    H    GLN   6           HN       GLN   6  41.677   1.483  20.275
  604    HA   GLN   6           HA       GLN   6  42.726   2.771  22.632
  605    HB2  GLN   6           HB2      GLN   6  43.365   4.243  20.584
  606    HB3  GLN   6           HB1      GLN   6  41.646   4.646  20.540
  607    HG2  GLN   6           HG2      GLN   6  41.721   5.451  22.830
  608    HG3  GLN   6           HG1      GLN   6  43.391   4.916  23.004
  609   HE21  GLN   6          HE21      GLN   6  45.067   6.194  21.978
  610   HE22  GLN   6          HE22      GLN   6  44.747   7.730  21.332
  611    H    ILE   7           HN       ILE   7  41.016   3.928  23.814
  612    HA   ILE   7           HA       ILE   7  38.595   2.487  23.861
  613    HB   ILE   7           HB       ILE   7  39.362   5.158  25.056
  614   HG12  ILE   7          HG12      ILE   7  38.974   2.446  26.352
  615   HG13  ILE   7          HG11      ILE   7  40.542   3.037  25.800
  616   HG21  ILE   7          HG21      ILE   7  36.953   5.134  24.866
  617   HG22  ILE   7          HG22      ILE   7  37.357   4.747  26.538
  618   HG23  ILE   7          HG23      ILE   7  36.877   3.465  25.427
  619   HD11  ILE   7          HD11      ILE   7  40.381   3.582  28.135
  620   HD12  ILE   7          HD12      ILE   7  38.762   4.250  27.929
  621   HD13  ILE   7          HD13      ILE   7  40.155   5.089  27.246
  622    H    LEU   8           HN       LEU   8  39.419   5.651  22.507
  623    HA   LEU   8           HA       LEU   8  36.776   6.328  21.684
  624    HB2  LEU   8           HB2      LEU   8  39.500   7.324  20.837
  625    HB3  LEU   8           HB1      LEU   8  37.998   7.974  20.178
  626    HG   LEU   8           HG       LEU   8  38.494   7.805  23.155
  627   HD11  LEU   8          HD11      LEU   8  39.033  10.153  21.308
  628   HD12  LEU   8          HD12      LEU   8  40.275   9.176  22.090
  629   HD13  LEU   8          HD13      LEU   8  39.184  10.159  23.065
  630   HD21  LEU   8          HD21      LEU   8  36.176   8.121  22.563
  631   HD22  LEU   8          HD22      LEU   8  36.595   9.336  21.355
  632   HD23  LEU   8          HD23      LEU   8  36.793   9.694  23.071
  633    H    SER   9           HN       SER   9  39.421   4.606  20.185
  634    HA   SER   9           HA       SER   9  38.296   4.508  17.555
  635    HB2  SER   9           HB2      SER   9  40.690   4.199  17.894
  636    HB3  SER   9           HB1      SER   9  40.389   2.754  18.857
  637    HG   SER   9           HG       SER   9  39.507   1.779  17.031
  638    H    ILE  10           HN       ILE  10  38.328   2.268  20.302
  639    HA   ILE  10           HA       ILE  10  36.979   0.142  19.007
  640    HB   ILE  10           HB       ILE  10  37.199   0.887  21.929
  641   HG12  ILE  10          HG12      ILE  10  38.567  -1.342  20.412
  642   HG13  ILE  10          HG11      ILE  10  39.278   0.265  20.546
  643   HG21  ILE  10          HG21      ILE  10  36.105  -1.587  20.562
  644   HG22  ILE  10          HG22      ILE  10  35.251  -0.516  21.674
  645   HG23  ILE  10          HG23      ILE  10  36.561  -1.540  22.264
  646   HD11  ILE  10          HD11      ILE  10  38.802  -1.782  22.692
  647   HD12  ILE  10          HD12      ILE  10  38.808  -0.073  23.135
  648   HD13  ILE  10          HD13      ILE  10  40.230  -0.796  22.387
  649    H    CYS  11           HN       CYS  11  35.817   2.815  21.070
  650    HA   CYS  11           HA       CYS  11  33.119   2.038  21.152
  651    HB2  CYS  11           HB2      CYS  11  34.437   4.749  21.338
  652    HB3  CYS  11           HB1      CYS  11  32.712   4.493  21.603
  653    HG   CYS  11           HG       CYS  11  33.303   3.810  23.902
  654    H    SER  12           HN       SER  12  34.758   4.380  18.980
  655    HA   SER  12           HA       SER  12  32.520   4.992  17.424
  656    HB2  SER  12           HB2      SER  12  35.449   4.924  16.690
  657    HB3  SER  12           HB1      SER  12  34.194   5.636  15.680
  658    HG   SER  12           HG       SER  12  33.722   7.053  17.390
  659    H    PHE  13           HN       PHE  13  34.863   2.361  17.154
  660    HA   PHE  13           HA       PHE  13  34.105   1.365  14.639
  661    HB2  PHE  13           HB2      PHE  13  36.119   0.585  15.731
  662    HB3  PHE  13           HB1      PHE  13  35.181  -0.070  17.075
  663    HD1  PHE  13           HD1      PHE  13  35.932  -0.434  13.461
  664    HD2  PHE  13           HD2      PHE  13  34.017  -2.164  16.894
  665    HE1  PHE  13           HE1      PHE  13  35.623  -2.558  12.219
  666    HE2  PHE  13           HE2      PHE  13  33.709  -4.289  15.652
  667    HZ   PHE  13           HZ       PHE  13  34.513  -4.485  13.315
  668    H    ILE  14           HN       ILE  14  32.976   0.417  17.894
  669    HA   ILE  14           HA       ILE  14  31.068  -1.468  16.951
  670    HB   ILE  14           HB       ILE  14  31.301   0.014  19.572
  671   HG12  ILE  14          HG12      ILE  14  31.839  -2.888  18.882
  672   HG13  ILE  14          HG11      ILE  14  33.093  -1.647  18.870
  673   HG21  ILE  14          HG21      ILE  14  28.981  -0.622  19.301
  674   HG22  ILE  14          HG22      ILE  14  29.732  -1.784  20.391
  675   HG23  ILE  14          HG23      ILE  14  29.440  -2.218  18.708
  676   HD11  ILE  14          HD11      ILE  14  31.429  -2.557  21.230
  677   HD12  ILE  14          HD12      ILE  14  32.434  -1.108  21.260
  678   HD13  ILE  14          HD13      ILE  14  33.177  -2.691  21.034
  679    H    LEU  15           HN       LEU  15  30.838   1.935  17.871
  680    HA   LEU  15           HA       LEU  15  28.037   2.197  17.655
  681    HB2  LEU  15           HB2      LEU  15  30.266   4.227  17.355
  682    HB3  LEU  15           HB1      LEU  15  28.555   4.644  17.424
  683    HG   LEU  15           HG       LEU  15  29.834   2.964  19.579
  684   HD11  LEU  15          HD11      LEU  15  31.133   5.056  19.414
  685   HD12  LEU  15          HD12      LEU  15  30.143   5.049  20.874
  686   HD13  LEU  15          HD13      LEU  15  29.638   5.992  19.472
  687   HD21  LEU  15          HD21      LEU  15  27.339   3.110  19.391
  688   HD22  LEU  15          HD22      LEU  15  27.462   4.860  19.573
  689   HD23  LEU  15          HD23      LEU  15  27.949   3.799  20.894
  690    H    SER  16           HN       SER  16  30.571   2.101  15.284
  691    HA   SER  16           HA       SER  16  28.967   3.281  13.178
  692    HB2  SER  16           HB2      SER  16  30.856   2.893  11.763
  693    HB3  SER  16           HB1      SER  16  31.479   3.451  13.313
  694    HG   SER  16           HG       SER  16  31.555   0.910  12.139
  695    H    ALA  17           HN       ALA  17  30.066   0.035  14.120
  696    HA   ALA  17           HA       ALA  17  29.037  -1.366  11.916
  697    HB1  ALA  17           HB1      ALA  17  29.448  -3.308  13.152
  698    HB2  ALA  17           HB2      ALA  17  29.015  -2.542  14.681
  699    HB3  ALA  17           HB3      ALA  17  30.551  -2.155  13.906
  700    H    LEU  18           HN       LEU  18  27.566  -0.659  15.090
  701    HA   LEU  18           HA       LEU  18  25.081  -1.898  14.460
  702    HB2  LEU  18           HB2      LEU  18  26.135  -0.185  16.635
  703    HB3  LEU  18           HB1      LEU  18  24.385  -0.194  16.409
  704    HG   LEU  18           HG       LEU  18  25.301  -1.958  18.001
  705   HD11  LEU  18          HD11      LEU  18  23.866  -3.141  15.615
  706   HD12  LEU  18          HD12      LEU  18  23.073  -2.035  16.737
  707   HD13  LEU  18          HD13      LEU  18  23.698  -3.579  17.314
  708   HD21  LEU  18          HD21      LEU  18  26.481  -3.835  17.144
  709   HD22  LEU  18          HD22      LEU  18  27.278  -2.447  16.401
  710   HD23  LEU  18          HD23      LEU  18  26.124  -3.406  15.472
  711    H    HIS  19           HN       HIS  19  26.271   1.426  14.315
  712    HA   HIS  19           HA       HIS  19  23.923   2.741  13.721
  713    HB2  HIS  19           HB2      HIS  19  25.917   4.004  14.070
  714    HB3  HIS  19           HB1      HIS  19  26.724   3.218  12.713
  715    HD2  HIS  19           HD2      HIS  19  23.063   4.570  12.241
  716    HE1  HIS  19           HE1      HIS  19  25.673   7.035  10.017
  717    HE2  HIS  19           HE2      HIS  19  23.236   6.515  10.506
  718    H    PHE  20           HN       PHE  20  26.092   1.049  11.479
  719    HA   PHE  20           HA       PHE  20  24.457   1.682   9.190
  720    HB2  PHE  20           HB2      PHE  20  27.040   0.597   9.681
  721    HB3  PHE  20           HB1      PHE  20  26.142  -0.554   8.692
  722    HD1  PHE  20           HD1      PHE  20  26.900   3.110   8.960
  723    HD2  PHE  20           HD2      PHE  20  25.940  -0.196   6.391
  724    HE1  PHE  20           HE1      PHE  20  27.216   4.560   6.974
  725    HE2  PHE  20           HE2      PHE  20  26.257   1.255   4.406
  726    HZ   PHE  20           HZ       PHE  20  26.890   3.632   4.699
  727    H    MET  21           HN       MET  21  24.573  -0.873  11.568
  728    HA   MET  21           HA       MET  21  23.166  -2.827  10.023
  729    HB2  MET  21           HB2      MET  21  23.762  -2.448  12.939
  730    HB3  MET  21           HB1      MET  21  22.701  -3.745  12.389
  731    HG2  MET  21           HG2      MET  21  24.420  -4.696  11.019
  732    HG3  MET  21           HG1      MET  21  25.468  -3.298  11.241
  733    HE1  MET  21           HE1      MET  21  27.612  -5.078  12.245
  734    HE2  MET  21           HE2      MET  21  26.367  -5.970  11.374
  735    HE3  MET  21           HE3      MET  21  26.935  -6.559  12.934
  736    H    ALA  22           HN       ALA  22  22.095  -0.861  12.791
  737    HA   ALA  22           HA       ALA  22  19.350  -1.477  12.501
  738    HB1  ALA  22           HB1      ALA  22  20.558  -0.490  14.538
  739    HB2  ALA  22           HB2      ALA  22  18.952   0.141  14.170
  740    HB3  ALA  22           HB3      ALA  22  20.386   1.069  13.731
  741    H    TRP  23           HN       TRP  23  21.310   1.246  11.333
  742    HA   TRP  23           HA       TRP  23  19.180   2.759  10.254
  743    HB2  TRP  23           HB2      TRP  23  21.492   3.608  10.645
  744    HB3  TRP  23           HB1      TRP  23  22.035   2.656   9.263
  745    HD1  TRP  23           HD1      TRP  23  19.336   5.309  10.028
  746    HE1  TRP  23           HE1      TRP  23  19.104   6.832   7.963
  747    HE3  TRP  23           HE3      TRP  23  22.652   3.034   6.883
  748    HZ2  TRP  23           HZ2      TRP  23  20.183   7.055   5.325
  749    HZ3  TRP  23           HZ3      TRP  23  23.029   3.922   4.600
  750    HH2  TRP  23           HH2      TRP  23  21.800   5.928   3.817
  751    H    THR  24           HN       THR  24  21.158   0.155   8.903
  752    HA   THR  24           HA       THR  24  20.185   0.366   6.237
  753    HB   THR  24           HB       THR  24  21.509  -1.848   7.787
  754    HG1  THR  24           HG1      THR  24  23.238  -1.170   6.740
  755   HG21  THR  24          HG21      THR  24  20.440  -1.858   4.962
  756   HG22  THR  24          HG22      THR  24  20.132  -3.027   6.247
  757   HG23  THR  24          HG23      THR  24  21.725  -2.944   5.496
  758    H    ILE  25           HN       ILE  25  19.193  -1.613   9.013
  759    HA   ILE  25           HA       ILE  25  17.220  -3.117   7.680
  760    HB   ILE  25           HB       ILE  25  17.454  -2.281  10.576
  761   HG12  ILE  25          HG12      ILE  25  17.987  -4.956   9.253
  762   HG13  ILE  25          HG11      ILE  25  19.246  -3.751   9.523
  763   HG21  ILE  25          HG21      ILE  25  15.888  -4.284  10.899
  764   HG22  ILE  25          HG22      ILE  25  15.549  -4.169   9.172
  765   HG23  ILE  25          HG23      ILE  25  15.151  -2.824  10.240
  766   HD11  ILE  25          HD11      ILE  25  17.609  -5.229  11.588
  767   HD12  ILE  25          HD12      ILE  25  18.503  -3.763  11.985
  768   HD13  ILE  25          HD13      ILE  25  19.363  -5.192  11.413
  769    H    GLY  26           HN       GLY  26  17.055  -0.020   9.394
  770    HA2  GLY  26           HA2      GLY  26  14.262   0.357   9.213
  771    HA3  GLY  26           HA1      GLY  26  15.453   1.638   9.419
  772    H    HIS  27           HN       HIS  27  16.922   1.220   7.045
  773    HA   HIS  27           HA       HIS  27  15.342   2.684   5.180
  774    HB2  HIS  27           HB2      HIS  27  17.653   3.110   5.100
  775    HB3  HIS  27           HB1      HIS  27  18.058   1.393   5.042
  776    HD2  HIS  27           HD2      HIS  27  18.186   0.328   2.479
  777    HE1  HIS  27           HE1      HIS  27  16.606   3.651   0.408
  778    HE2  HIS  27           HE2      HIS  27  17.677   1.364   0.137
  779    H    LEU  28           HN       LEU  28  16.349  -0.698   5.396
  780    HA   LEU  28           HA       LEU  28  15.382  -1.507   2.859
  781    HB2  LEU  28           HB2      LEU  28  16.922  -2.712   4.663
  782    HB3  LEU  28           HB1      LEU  28  15.379  -3.417   5.148
  783    HG   LEU  28           HG       LEU  28  15.297  -3.597   2.387
  784   HD11  LEU  28          HD11      LEU  28  17.688  -2.936   2.292
  785   HD12  LEU  28          HD12      LEU  28  17.444  -4.589   1.727
  786   HD13  LEU  28          HD13      LEU  28  18.091  -4.295   3.341
  787   HD21  LEU  28          HD21      LEU  28  14.689  -5.286   4.186
  788   HD22  LEU  28          HD22      LEU  28  16.397  -5.722   4.247
  789   HD23  LEU  28          HD23      LEU  28  15.476  -5.969   2.763
  790    H    ASN  29           HN       ASN  29  13.442  -2.357   2.219
  791    HA   ASN  29           HA       ASN  29  11.273  -2.504   4.204
  792    HB2  ASN  29           HB2      ASN  29  11.110  -1.052   1.552
  793    HB3  ASN  29           HB1      ASN  29   9.754  -1.345   2.639
  794   HD21  ASN  29          HD21      ASN  29  11.274   1.234   1.771
  795   HD22  ASN  29          HD22      ASN  29  11.601   2.004   3.248
  796    H    GLN  30           HN       GLN  30   9.911  -4.191   3.909
  797    HA   GLN  30           HA       GLN  30  10.466  -5.964   1.626
  798    HB2  GLN  30           HB2      GLN  30   9.056  -6.473   4.257
  799    HB3  GLN  30           HB1      GLN  30   9.279  -7.676   2.986
  800    HG2  GLN  30           HG2      GLN  30  11.594  -6.168   4.212
  801    HG3  GLN  30           HG1      GLN  30  11.014  -7.701   4.862
  802   HE21  GLN  30          HE21      GLN  30  11.205  -9.629   3.457
  803   HE22  GLN  30          HE22      GLN  30  12.307  -9.639   2.166
  804    H    ILE  31           HN       ILE  31   9.041  -6.189   0.026
  805    HA   ILE  31           HA       ILE  31   6.211  -5.537   0.521
  806    HB   ILE  31           HB       ILE  31   6.119  -4.321  -1.631
  807   HG12  ILE  31          HG12      ILE  31   9.148  -4.506  -1.553
  808   HG13  ILE  31          HG11      ILE  31   8.130  -5.482  -2.612
  809   HG21  ILE  31          HG21      ILE  31   7.299  -2.295  -0.852
  810   HG22  ILE  31          HG22      ILE  31   8.189  -3.266   0.321
  811   HG23  ILE  31          HG23      ILE  31   6.442  -3.079   0.475
  812   HD11  ILE  31          HD11      ILE  31   7.236  -3.460  -3.665
  813   HD12  ILE  31          HD12      ILE  31   8.997  -3.457  -3.764
  814   HD13  ILE  31          HD13      ILE  31   8.178  -2.449  -2.570
  815    H    LYS  32           HN       LYS  32   4.741  -6.661  -0.764
  816    HA   LYS  32           HA       LYS  32   5.887  -8.753  -2.509
  817    HB2  LYS  32           HB2      LYS  32   3.963  -8.995  -0.239
  818    HB3  LYS  32           HB1      LYS  32   3.725 -10.037  -1.642
  819    HG2  LYS  32           HG2      LYS  32   6.445  -9.765  -0.372
  820    HG3  LYS  32           HG1      LYS  32   5.257 -10.898   0.273
  821    HD2  LYS  32           HD2      LYS  32   5.075 -11.995  -1.909
  822    HD3  LYS  32           HD1      LYS  32   6.202 -10.831  -2.609
  823    HE2  LYS  32           HE2      LYS  32   7.949 -11.596  -1.020
  824    HE3  LYS  32           HE1      LYS  32   6.823 -12.795  -0.382
  825    HZ1  LYS  32           HZ1      LYS  32   8.234 -13.806  -2.020
  826    HZ2  LYS  32           HZ2      LYS  32   7.829 -12.623  -3.171
  827    HZ3  LYS  32           HZ3      LYS  32   6.655 -13.727  -2.633
  828    H    ARG  33           HN       ARG  33   5.377  -7.893  -4.466
  829    HA   ARG  33           HA       ARG  33   2.726  -6.772  -4.935
  830    HB2  ARG  33           HB2      ARG  33   5.245  -6.292  -6.015
  831    HB3  ARG  33           HB1      ARG  33   4.386  -7.145  -7.297
  832    HG2  ARG  33           HG2      ARG  33   3.791  -4.903  -7.678
  833    HG3  ARG  33           HG1      ARG  33   2.426  -5.515  -6.743
  834    HD2  ARG  33           HD2      ARG  33   3.295  -4.563  -4.713
  835    HD3  ARG  33           HD1      ARG  33   4.816  -4.146  -5.495
  836    HE   ARG  33           HE       ARG  33   2.652  -2.889  -6.840
  837   HH11  ARG  33          HH11      ARG  33   4.526  -2.772  -3.895
  838   HH12  ARG  33          HH12      ARG  33   4.272  -1.077  -3.661
  839   HH21  ARG  33          HH21      ARG  33   2.338  -0.669  -6.503
  840   HH22  ARG  33          HH22      ARG  33   3.044   0.105  -5.125
  841    H1   MET   1           HT1      MET   1  55.254   7.033   6.252
  842    H2   MET   1           HT2      MET   1  54.515   6.837   4.734
  843    H3   MET   1           HT3      MET   1  56.157   6.453   4.939
  844    HA   MET   1           HA       MET   1  55.690   4.570   6.230
  845    HB2  MET   1           HB2      MET   1  53.256   6.080   6.763
  846    HB3  MET   1           HB1      MET   1  52.899   4.398   6.372
  847    HG2  MET   1           HG2      MET   1  53.977   3.591   8.234
  848    HG3  MET   1           HG1      MET   1  55.173   4.888   8.233
  849    HE1  MET   1           HE1      MET   1  55.133   6.613  10.217
  850    HE2  MET   1           HE2      MET   1  53.795   7.749  10.056
  851    HE3  MET   1           HE3      MET   1  54.686   7.239   8.624
  852    H    PHE   2           HN       PHE   2  54.738   2.540   5.433
  853    HA   PHE   2           HA       PHE   2  54.852   2.333   2.634
  854    HB2  PHE   2           HB2      PHE   2  55.323   0.409   4.011
  855    HB3  PHE   2           HB1      PHE   2  53.702   0.451   4.706
  856    HD1  PHE   2           HD1      PHE   2  55.541   0.051   1.477
  857    HD2  PHE   2           HD2      PHE   2  51.905  -0.659   3.652
  858    HE1  PHE   2           HE1      PHE   2  54.703  -1.358  -0.383
  859    HE2  PHE   2           HE2      PHE   2  51.068  -2.068   1.790
  860    HZ   PHE   2           HZ       PHE   2  52.466  -2.417  -0.227
  861    H    GLU   3           HN       GLU   3  52.053   2.250   4.831
  862    HA   GLU   3           HA       GLU   3  50.172   2.096   2.677
  863    HB2  GLU   3           HB2      GLU   3  49.842   2.650   5.630
  864    HB3  GLU   3           HB1      GLU   3  48.490   2.550   4.505
  865    HG2  GLU   3           HG2      GLU   3  48.626   0.357   5.303
  866    HG3  GLU   3           HG1      GLU   3  49.552   0.275   3.807
  867    HA   PRO   4           HA       PRO   4  49.475   6.279   1.500
  868    HB2  PRO   4           HB2      PRO   4  46.631   5.983   2.365
  869    HB3  PRO   4           HB1      PRO   4  47.286   6.488   0.796
  870    HG2  PRO   4           HG2      PRO   4  46.242   4.066   1.155
  871    HG3  PRO   4           HG1      PRO   4  47.635   4.334   0.094
  872    HD2  PRO   4           HD2      PRO   4  47.538   3.094   2.792
  873    HD3  PRO   4           HD1      PRO   4  48.637   2.767   1.440
  874    H    PHE   5           HN       PHE   5  47.985   5.308   4.569
  875    HA   PHE   5           HA       PHE   5  49.137   7.558   5.947
  876    HB2  PHE   5           HB2      PHE   5  46.522   7.867   4.852
  877    HB3  PHE   5           HB1      PHE   5  46.363   7.743   6.604
  878    HD1  PHE   5           HD1      PHE   5  47.849   9.664   3.828
  879    HD2  PHE   5           HD2      PHE   5  47.357   9.395   8.086
  880    HE1  PHE   5           HE1      PHE   5  48.679  11.988   4.071
  881    HE2  PHE   5           HE2      PHE   5  48.186  11.719   8.330
  882    HZ   PHE   5           HZ       PHE   5  48.847  13.016   6.322
  883    H    GLN   6           HN       GLN   6  46.194   5.610   6.492
  884    HA   GLN   6           HA       GLN   6  47.525   3.883   8.381
  885    HB2  GLN   6           HB2      GLN   6  47.038   6.137   9.586
  886    HB3  GLN   6           HB1      GLN   6  45.354   5.607   9.552
  887    HG2  GLN   6           HG2      GLN   6  45.918   3.561  10.733
  888    HG3  GLN   6           HG1      GLN   6  47.636   3.945  10.655
  889   HE21  GLN   6          HE21      GLN   6  48.462   5.591  12.103
  890   HE22  GLN   6          HE22      GLN   6  47.529   6.204  13.382
  891    H    ILE   7           HN       ILE   7  46.023   2.274   9.280
  892    HA   ILE   7           HA       ILE   7  44.255   1.263   7.332
  893    HB   ILE   7           HB       ILE   7  44.570   0.631  10.275
  894   HG12  ILE   7          HG12      ILE   7  45.401  -0.927   7.811
  895   HG13  ILE   7          HG11      ILE   7  46.476   0.184   8.661
  896   HG21  ILE   7          HG21      ILE   7  42.337  -0.039   9.644
  897   HG22  ILE   7          HG22      ILE   7  43.341  -1.489   9.653
  898   HG23  ILE   7          HG23      ILE   7  42.917  -0.719   8.124
  899   HD11  ILE   7          HD11      ILE   7  46.917  -2.006   9.544
  900   HD12  ILE   7          HD12      ILE   7  45.196  -2.334   9.751
  901   HD13  ILE   7          HD13      ILE   7  45.995  -1.141  10.775
  902    H    LEU   8           HN       LEU   8  43.680   3.073  10.312
  903    HA   LEU   8           HA       LEU   8  40.831   2.967  10.194
  904    HB2  LEU   8           HB2      LEU   8  42.748   4.791  11.651
  905    HB3  LEU   8           HB1      LEU   8  40.996   4.931  11.800
  906    HG   LEU   8           HG       LEU   8  42.434   2.314  12.270
  907   HD11  LEU   8          HD11      LEU   8  41.667   4.414  14.324
  908   HD12  LEU   8          HD12      LEU   8  43.318   4.047  13.823
  909   HD13  LEU   8          HD13      LEU   8  42.362   2.830  14.669
  910   HD21  LEU   8          HD21      LEU   8  40.058   2.078  11.916
  911   HD22  LEU   8          HD22      LEU   8  39.709   3.450  12.967
  912   HD23  LEU   8          HD23      LEU   8  40.329   1.948  13.652
  913    H    SER   9           HN       SER   9  43.238   5.142   8.912
  914    HA   SER   9           HA       SER   9  41.415   7.201   8.102
  915    HB2  SER   9           HB2      SER   9  43.775   7.703   8.441
  916    HB3  SER   9           HB1      SER   9  44.221   6.585   7.155
  917    HG   SER   9           HG       SER   9  43.111   7.899   5.698
  918    H    ILE  10           HN       ILE  10  42.944   4.463   6.447
  919    HA   ILE  10           HA       ILE  10  41.919   5.033   3.868
  920    HB   ILE  10           HB       ILE  10  42.831   2.442   5.133
  921   HG12  ILE  10          HG12      ILE  10  44.226   4.160   3.073
  922   HG13  ILE  10          HG11      ILE  10  44.452   4.415   4.802
  923   HG21  ILE  10          HG21      ILE  10  42.118   3.138   2.270
  924   HG22  ILE  10          HG22      ILE  10  41.385   1.889   3.277
  925   HG23  ILE  10          HG23      ILE  10  43.050   1.711   2.721
  926   HD11  ILE  10          HD11      ILE  10  45.282   2.079   3.106
  927   HD12  ILE  10          HD12      ILE  10  44.944   1.811   4.817
  928   HD13  ILE  10          HD13      ILE  10  46.199   2.948   4.335
  929    H    CYS  11           HN       CYS  11  40.764   2.917   6.500
  930    HA   CYS  11           HA       CYS  11  38.565   1.828   5.129
  931    HB2  CYS  11           HB2      CYS  11  39.052   2.336   8.066
  932    HB3  CYS  11           HB1      CYS  11  37.646   1.462   7.456
  933    HG   CYS  11           HG       CYS  11  39.101  -0.530   7.343
  934    H    SER  12           HN       SER  12  38.701   4.621   7.380
  935    HA   SER  12           HA       SER  12  36.007   5.334   7.164
  936    HB2  SER  12           HB2      SER  12  38.447   7.035   7.679
  937    HB3  SER  12           HB1      SER  12  36.792   7.602   7.877
  938    HG   SER  12           HG       SER  12  36.488   5.944   9.407
  939    H    PHE  13           HN       PHE  13  38.786   6.185   5.163
  940    HA   PHE  13           HA       PHE  13  37.589   8.191   3.595
  941    HB2  PHE  13           HB2      PHE  13  39.977   7.821   3.522
  942    HB3  PHE  13           HB1      PHE  13  39.743   6.185   2.904
  943    HD1  PHE  13           HD1      PHE  13  39.382   9.789   2.112
  944    HD2  PHE  13           HD2      PHE  13  39.224   5.776   0.592
  945    HE1  PHE  13           HE1      PHE  13  39.311  10.670  -0.205
  946    HE2  PHE  13           HE2      PHE  13  39.155   6.655  -1.725
  947    HZ   PHE  13           HZ       PHE  13  39.199   9.102  -2.125
  948    H    ILE  14           HN       ILE  14  37.861   4.680   2.985
  949    HA   ILE  14           HA       ILE  14  36.374   4.742   0.562
  950    HB   ILE  14           HB       ILE  14  36.997   2.496   2.484
  951   HG12  ILE  14          HG12      ILE  14  38.087   3.098  -0.279
  952   HG13  ILE  14          HG11      ILE  14  38.867   3.650   1.203
  953   HG21  ILE  14          HG21      ILE  14  34.991   1.882   1.275
  954   HG22  ILE  14          HG22      ILE  14  36.347   1.035   0.534
  955   HG23  ILE  14          HG23      ILE  14  35.673   2.467  -0.242
  956   HD11  ILE  14          HD11      ILE  14  38.370   0.791   0.339
  957   HD12  ILE  14          HD12      ILE  14  38.875   1.230   1.971
  958   HD13  ILE  14          HD13      ILE  14  39.927   1.580   0.598
  959    H    LEU  15           HN       LEU  15  35.493   4.083   3.918
  960    HA   LEU  15           HA       LEU  15  32.816   3.318   3.461
  961    HB2  LEU  15           HB2      LEU  15  34.162   4.543   5.883
  962    HB3  LEU  15           HB1      LEU  15  32.517   3.907   5.883
  963    HG   LEU  15           HG       LEU  15  34.838   2.217   4.955
  964   HD11  LEU  15          HD11      LEU  15  35.363   2.995   7.238
  965   HD12  LEU  15          HD12      LEU  15  34.934   1.283   7.245
  966   HD13  LEU  15          HD13      LEU  15  33.763   2.488   7.783
  967   HD21  LEU  15          HD21      LEU  15  32.481   1.523   4.462
  968   HD22  LEU  15          HD22      LEU  15  32.151   1.535   6.194
  969   HD23  LEU  15          HD23      LEU  15  33.315   0.391   5.526
  970    H    SER  16           HN       SER  16  34.385   6.410   3.554
  971    HA   SER  16           HA       SER  16  31.929   7.904   3.944
  972    HB2  SER  16           HB2      SER  16  33.302   9.857   3.780
  973    HB3  SER  16           HB1      SER  16  34.192   8.677   4.737
  974    HG   SER  16           HG       SER  16  34.627   9.594   2.128
  975    H    ALA  17           HN       ALA  17  34.141   7.139   1.270
  976    HA   ALA  17           HA       ALA  17  32.913   8.729  -0.697
  977    HB1  ALA  17           HB1      ALA  17  34.228   7.566  -2.239
  978    HB2  ALA  17           HB2      ALA  17  34.104   6.050  -1.347
  979    HB3  ALA  17           HB3      ALA  17  35.138   7.344  -0.743
  980    H    LEU  18           HN       LEU  18  32.381   5.308   0.183
  981    HA   LEU  18           HA       LEU  18  30.288   4.925  -1.711
  982    HB2  LEU  18           HB2      LEU  18  31.446   3.403   0.553
  983    HB3  LEU  18           HB1      LEU  18  29.793   2.998   0.088
  984    HG   LEU  18           HG       LEU  18  31.625   1.696  -1.107
  985   HD11  LEU  18          HD11      LEU  18  29.908   3.323  -2.992
  986   HD12  LEU  18          HD12      LEU  18  29.228   2.089  -1.931
  987   HD13  LEU  18          HD13      LEU  18  30.415   1.643  -3.157
  988   HD21  LEU  18          HD21      LEU  18  32.957   2.760  -2.762
  989   HD22  LEU  18          HD22      LEU  18  33.044   3.846  -1.376
  990   HD23  LEU  18          HD23      LEU  18  31.980   4.227  -2.730
  991    H    HIS  19           HN       HIS  19  30.376   5.744   1.728
  992    HA   HIS  19           HA       HIS  19  27.689   5.582   2.317
  993    HB2  HIS  19           HB2      HIS  19  29.248   6.057   4.062
  994    HB3  HIS  19           HB1      HIS  19  29.771   7.544   3.271
  995    HD2  HIS  19           HD2      HIS  19  25.924   6.806   3.605
  996    HE1  HIS  19           HE1      HIS  19  26.883   9.992   6.205
  997    HE2  HIS  19           HE2      HIS  19  24.980   8.640   5.208
  998    H    PHE  20           HN       PHE  20  29.425   8.292   0.821
  999    HA   PHE  20           HA       PHE  20  27.041   9.907   0.649
 1000    HB2  PHE  20           HB2      PHE  20  29.843  10.271   0.320
 1001    HB3  PHE  20           HB1      PHE  20  29.046  10.787  -1.166
 1002    HD1  PHE  20           HD1      PHE  20  28.778  11.096   2.562
 1003    HD2  PHE  20           HD2      PHE  20  28.026  12.888  -1.270
 1004    HE1  PHE  20           HE1      PHE  20  28.013  13.171   3.681
 1005    HE2  PHE  20           HE2      PHE  20  27.261  14.963  -0.148
 1006    HZ   PHE  20           HZ       PHE  20  27.243  15.094   2.328
 1007    H    MET  21           HN       MET  21  28.620   7.520  -1.350
 1008    HA   MET  21           HA       MET  21  27.418   8.314  -3.823
 1009    HB2  MET  21           HB2      MET  21  28.774   5.835  -2.817
 1010    HB3  MET  21           HB1      MET  21  28.006   5.870  -4.404
 1011    HG2  MET  21           HG2      MET  21  29.398   7.674  -5.141
 1012    HG3  MET  21           HG1      MET  21  30.018   7.953  -3.517
 1013    HE1  MET  21           HE1      MET  21  32.775   7.634  -4.525
 1014    HE2  MET  21           HE2      MET  21  31.635   7.922  -5.836
 1015    HE3  MET  21           HE3      MET  21  32.818   6.624  -5.976
 1016    H    ALA  22           HN       ALA  22  26.761   5.511  -1.721
 1017    HA   ALA  22           HA       ALA  22  24.360   4.775  -3.023
 1018    HB1  ALA  22           HB1      ALA  22  25.817   3.375  -1.443
 1019    HB2  ALA  22           HB2      ALA  22  24.069   3.205  -1.288
 1020    HB3  ALA  22           HB3      ALA  22  24.965   4.191  -0.132
 1021    H    TRP  23           HN       TRP  23  24.992   6.764  -0.148
 1022    HA   TRP  23           HA       TRP  23  22.293   7.147   0.600
 1023    HB2  TRP  23           HB2      TRP  23  24.268   7.661   2.034
 1024    HB3  TRP  23           HB1      TRP  23  24.593   9.064   1.018
 1025    HD1  TRP  23           HD1      TRP  23  21.643   7.612   3.044
 1026    HE1  TRP  23           HE1      TRP  23  20.344   9.581   4.083
 1027    HE3  TRP  23           HE3      TRP  23  24.289  11.531   1.114
 1028    HZ2  TRP  23           HZ2      TRP  23  20.421  12.440   4.098
 1029    HZ3  TRP  23           HZ3      TRP  23  23.656  13.865   1.659
 1030    HH2  TRP  23           HH2      TRP  23  21.727  14.324   3.147
 1031    H    THR  24           HN       THR  24  24.393   8.882  -1.655
 1032    HA   THR  24           HA       THR  24  22.612  11.052  -2.138
 1033    HB   THR  24           HB       THR  24  24.935   9.896  -3.665
 1034    HG1  THR  24           HG1      THR  24  25.969  11.545  -2.787
 1035   HG21  THR  24          HG21      THR  24  23.076  12.153  -4.425
 1036   HG22  THR  24          HG22      THR  24  23.536  10.751  -5.391
 1037   HG23  THR  24          HG23      THR  24  24.717  12.019  -5.058
 1038    H    ILE  25           HN       ILE  25  23.146   7.947  -3.780
 1039    HA   ILE  25           HA       ILE  25  21.372   8.386  -5.924
 1040    HB   ILE  25           HB       ILE  25  22.261   5.831  -4.572
 1041   HG12  ILE  25          HG12      ILE  25  23.086   7.040  -7.227
 1042   HG13  ILE  25          HG11      ILE  25  23.967   7.329  -5.727
 1043   HG21  ILE  25          HG21      ILE  25  21.518   4.824  -6.810
 1044   HG22  ILE  25          HG22      ILE  25  20.627   6.324  -7.072
 1045   HG23  ILE  25          HG23      ILE  25  20.226   5.289  -5.702
 1046   HD11  ILE  25          HD11      ILE  25  23.563   4.707  -7.174
 1047   HD12  ILE  25          HD12      ILE  25  24.080   4.770  -5.489
 1048   HD13  ILE  25          HD13      ILE  25  25.083   5.492  -6.748
 1049    H    GLY  26           HN       GLY  26  20.885   6.973  -2.709
 1050    HA2  GLY  26           HA2      GLY  26  18.193   6.195  -3.048
 1051    HA3  GLY  26           HA1      GLY  26  18.975   6.520  -1.503
 1052    H    HIS  27           HN       HIS  27  19.674   9.219  -1.974
 1053    HA   HIS  27           HA       HIS  27  17.236  10.522  -1.265
 1054    HB2  HIS  27           HB2      HIS  27  19.182  11.441  -0.317
 1055    HB3  HIS  27           HB1      HIS  27  20.017  11.501  -1.868
 1056    HD2  HIS  27           HD2      HIS  27  19.626  13.852  -3.296
 1057    HE1  HIS  27           HE1      HIS  27  16.595  15.494  -0.857
 1058    HE2  HIS  27           HE2      HIS  27  18.130  15.942  -2.831
 1059    H    LEU  28           HN       LEU  28  19.169  10.386  -4.221
 1060    HA   LEU  28           HA       LEU  28  17.725  12.358  -5.660
 1061    HB2  LEU  28           HB2      LEU  28  20.032  11.118  -6.132
 1062    HB3  LEU  28           HB1      LEU  28  18.988  10.070  -7.094
 1063    HG   LEU  28           HG       LEU  28  18.094  12.603  -7.759
 1064   HD11  LEU  28          HD11      LEU  28  20.039  13.582  -6.566
 1065   HD12  LEU  28          HD12      LEU  28  20.110  13.894  -8.300
 1066   HD13  LEU  28          HD13      LEU  28  21.123  12.638  -7.588
 1067   HD21  LEU  28          HD21      LEU  28  18.597  10.575  -9.208
 1068   HD22  LEU  28          HD22      LEU  28  20.284  11.089  -9.206
 1069   HD23  LEU  28          HD23      LEU  28  19.047  12.126  -9.916
 1070    H    ASN  29           HN       ASN  29  16.004  12.207  -7.042
 1071    HA   ASN  29           HA       ASN  29  14.711   9.581  -7.362
 1072    HB2  ASN  29           HB2      ASN  29  13.313  12.114  -6.469
 1073    HB3  ASN  29           HB1      ASN  29  12.513  10.599  -6.885
 1074   HD21  ASN  29          HD21      ASN  29  12.872  12.142  -4.207
 1075   HD22  ASN  29          HD22      ASN  29  13.424  10.944  -3.139
 1076    H    GLN  30           HN       GLN  30  13.869   9.242  -9.352
 1077    HA   GLN  30           HA       GLN  30  14.148  11.426 -11.305
 1078    HB2  GLN  30           HB2      GLN  30  13.847   8.436 -11.679
 1079    HB3  GLN  30           HB1      GLN  30  13.991   9.605 -12.992
 1080    HG2  GLN  30           HG2      GLN  30  16.044   9.394 -10.783
 1081    HG3  GLN  30           HG1      GLN  30  16.161   8.457 -12.272
 1082   HE21  GLN  30          HE21      GLN  30  16.435   9.680 -14.315
 1083   HE22  GLN  30          HE22      GLN  30  17.032  11.268 -14.283
 1084    H    ILE  31           HN       ILE  31  12.415  12.399 -12.138
 1085    HA   ILE  31           HA       ILE  31   9.826  10.997 -12.106
 1086    HB   ILE  31           HB       ILE  31   8.717  13.068 -11.334
 1087   HG12  ILE  31          HG12      ILE  31  11.535  14.043 -10.774
 1088   HG13  ILE  31          HG11      ILE  31  10.556  14.596 -12.132
 1089   HG21  ILE  31          HG21      ILE  31   9.455  12.916  -8.984
 1090   HG22  ILE  31          HG22      ILE  31  10.910  12.059  -9.496
 1091   HG23  ILE  31          HG23      ILE  31   9.326  11.314  -9.710
 1092   HD11  ILE  31          HD11      ILE  31   8.840  15.428 -10.595
 1093   HD12  ILE  31          HD12      ILE  31  10.403  16.136 -10.186
 1094   HD13  ILE  31          HD13      ILE  31   9.753  14.816  -9.215
 1095    H    LYS  32           HN       LYS  32   8.420  11.564 -13.761
 1096    HA   LYS  32           HA       LYS  32   9.487  13.438 -15.783
 1097    HB2  LYS  32           HB2      LYS  32   8.528  10.629 -16.082
 1098    HB3  LYS  32           HB1      LYS  32   8.167  11.773 -17.376
 1099    HG2  LYS  32           HG2      LYS  32  10.953  11.565 -16.245
 1100    HG3  LYS  32           HG1      LYS  32  10.405  10.453 -17.501
 1101    HD2  LYS  32           HD2      LYS  32   9.862  12.334 -18.971
 1102    HD3  LYS  32           HD1      LYS  32  10.326  13.478 -17.711
 1103    HE2  LYS  32           HE2      LYS  32  12.630  12.549 -17.745
 1104    HE3  LYS  32           HE1      LYS  32  12.155  11.464 -19.051
 1105    HZ1  LYS  32           HZ1      LYS  32  13.201  13.407 -19.960
 1106    HZ2  LYS  32           HZ2      LYS  32  12.136  14.433 -19.123
 1107    HZ3  LYS  32           HZ3      LYS  32  11.555  13.432 -20.367
 1108    H    ARG  33           HN       ARG  33   8.164  15.162 -15.419
 1109    HA   ARG  33           HA       ARG  33   5.298  14.756 -15.060
 1110    HB2  ARG  33           HB2      ARG  33   7.097  16.686 -14.182
 1111    HB3  ARG  33           HB1      ARG  33   6.158  17.513 -15.424
 1112    HG2  ARG  33           HG2      ARG  33   4.861  17.839 -13.491
 1113    HG3  ARG  33           HG1      ARG  33   4.095  16.438 -14.244
 1114    HD2  ARG  33           HD2      ARG  33   5.250  14.924 -12.776
 1115    HD3  ARG  33           HD1      ARG  33   6.263  16.219 -12.147
 1116    HE   ARG  33           HE       ARG  33   3.520  16.816 -11.697
 1117   HH11  ARG  33          HH11      ARG  33   6.119  14.743 -10.626
 1118   HH12  ARG  33          HH12      ARG  33   5.482  14.574  -9.026
 1119   HH21  ARG  33          HH21      ARG  33   2.714  16.574  -9.593
 1120   HH22  ARG  33          HH22      ARG  33   3.572  15.602  -8.444
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1  49.206  32.091   9.738
    2    H2   MET   1           HT2      MET   1  49.943  31.761  11.233
    3    H3   MET   1           HT3      MET   1  48.637  30.816  10.700
    4    HA   MET   1           HA       MET   1  50.250  30.418   8.665
    5    HB2  MET   1           HB2      MET   1  51.969  31.905   9.749
    6    HB3  MET   1           HB1      MET   1  52.098  30.719  11.048
    7    HG2  MET   1           HG2      MET   1  52.317  29.650   8.287
    8    HG3  MET   1           HG1      MET   1  53.659  30.655   8.836
    9    HE1  MET   1           HE1      MET   1  54.991  27.042   9.227
   10    HE2  MET   1           HE2      MET   1  55.461  28.687   8.809
   11    HE3  MET   1           HE3      MET   1  54.128  27.915   7.955
   12    H    PHE   2           HN       PHE   2  49.424  29.705  11.962
   13    HA   PHE   2           HA       PHE   2  50.056  26.858  11.605
   14    HB2  PHE   2           HB2      PHE   2  49.161  28.412  14.044
   15    HB3  PHE   2           HB1      PHE   2  49.539  26.690  14.022
   16    HD1  PHE   2           HD1      PHE   2  50.891  30.071  14.053
   17    HD2  PHE   2           HD2      PHE   2  51.862  25.926  13.482
   18    HE1  PHE   2           HE1      PHE   2  53.297  30.595  14.344
   19    HE2  PHE   2           HE2      PHE   2  54.268  26.450  13.774
   20    HZ   PHE   2           HZ       PHE   2  54.986  28.784  14.203
   21    H    GLU   3           HN       GLU   3  48.520  25.551  10.881
   22    HA   GLU   3           HA       GLU   3  45.798  26.405  10.668
   23    HB2  GLU   3           HB2      GLU   3  47.169  23.777  10.095
   24    HB3  GLU   3           HB1      GLU   3  45.444  24.035   9.837
   25    HG2  GLU   3           HG2      GLU   3  45.969  25.947   8.351
   26    HG3  GLU   3           HG1      GLU   3  47.689  25.632   8.576
   27    HA   PRO   4           HA       PRO   4  43.883  25.012  14.381
   28    HB2  PRO   4           HB2      PRO   4  42.164  23.224  12.712
   29    HB3  PRO   4           HB1      PRO   4  41.692  24.444  13.910
   30    HG2  PRO   4           HG2      PRO   4  41.456  24.901  11.302
   31    HG3  PRO   4           HG1      PRO   4  41.920  26.183  12.432
   32    HD2  PRO   4           HD2      PRO   4  43.592  24.719  10.456
   33    HD3  PRO   4           HD1      PRO   4  43.749  26.380  11.067
   34    H    PHE   5           HN       PHE   5  44.430  22.406  12.012
   35    HA   PHE   5           HA       PHE   5  45.863  20.836  13.978
   36    HB2  PHE   5           HB2      PHE   5  43.117  20.088  13.041
   37    HB3  PHE   5           HB1      PHE   5  44.299  18.818  13.356
   38    HD1  PHE   5           HD1      PHE   5  41.950  21.105  14.821
   39    HD2  PHE   5           HD2      PHE   5  45.516  18.850  15.628
   40    HE1  PHE   5           HE1      PHE   5  41.535  21.319  17.257
   41    HE2  PHE   5           HE2      PHE   5  45.100  19.063  18.063
   42    HZ   PHE   5           HZ       PHE   5  43.110  20.298  18.878
   43    H    GLN   6           HN       GLN   6  44.150  20.447  10.864
   44    HA   GLN   6           HA       GLN   6  46.535  20.233   9.341
   45    HB2  GLN   6           HB2      GLN   6  46.549  17.876   8.833
   46    HB3  GLN   6           HB1      GLN   6  46.624  18.056  10.587
   47    HG2  GLN   6           HG2      GLN   6  44.020  17.902  10.463
   48    HG3  GLN   6           HG1      GLN   6  44.307  17.192   8.875
   49   HE21  GLN   6          HE21      GLN   6  44.929  14.997   8.815
   50   HE22  GLN   6          HE22      GLN   6  45.304  14.082  10.194
   51    H    ILE   7           HN       ILE   7  46.026  19.377   7.093
   52    HA   ILE   7           HA       ILE   7  43.862  20.799   6.007
   53    HB   ILE   7           HB       ILE   7  45.536  18.537   4.906
   54   HG12  ILE   7          HG12      ILE   7  46.011  20.799   3.432
   55   HG13  ILE   7          HG11      ILE   7  45.691  21.483   5.026
   56   HG21  ILE   7          HG21      ILE   7  43.474  18.413   3.694
   57   HG22  ILE   7          HG22      ILE   7  44.586  19.326   2.675
   58   HG23  ILE   7          HG23      ILE   7  43.346  20.169   3.602
   59   HD11  ILE   7          HD11      ILE   7  47.586  19.157   4.660
   60   HD12  ILE   7          HD12      ILE   7  47.455  20.259   6.032
   61   HD13  ILE   7          HD13      ILE   7  48.129  20.828   4.506
   62    H    LEU   8           HN       LEU   8  44.188  17.401   6.918
   63    HA   LEU   8           HA       LEU   8  41.740  16.478   5.845
   64    HB2  LEU   8           HB2      LEU   8  43.725  15.116   6.781
   65    HB3  LEU   8           HB1      LEU   8  42.979  15.371   8.360
   66    HG   LEU   8           HG       LEU   8  41.039  14.536   6.341
   67   HD11  LEU   8          HD11      LEU   8  43.432  12.783   6.947
   68   HD12  LEU   8          HD12      LEU   8  42.819  13.261   5.363
   69   HD13  LEU   8          HD13      LEU   8  41.897  12.138   6.364
   70   HD21  LEU   8          HD21      LEU   8  40.610  12.814   8.161
   71   HD22  LEU   8          HD22      LEU   8  40.493  14.493   8.686
   72   HD23  LEU   8          HD23      LEU   8  41.934  13.550   9.064
   73    H    SER   9           HN       SER   9  42.559  18.117   8.821
   74    HA   SER   9           HA       SER   9  40.023  17.669  10.106
   75    HB2  SER   9           HB2      SER   9  42.285  19.581  10.692
   76    HB3  SER   9           HB1      SER   9  40.832  19.455  11.680
   77    HG   SER   9           HG       SER   9  42.773  18.105  12.224
   78    H    ILE  10           HN       ILE  10  41.468  20.256   8.188
   79    HA   ILE  10           HA       ILE  10  39.430  22.177   8.578
   80    HB   ILE  10           HB       ILE  10  41.411  21.763   6.332
   81   HG12  ILE  10          HG12      ILE  10  41.295  23.894   8.484
   82   HG13  ILE  10          HG11      ILE  10  42.187  22.384   8.684
   83   HG21  ILE  10          HG21      ILE  10  40.801  24.202   5.818
   84   HG22  ILE  10          HG22      ILE  10  39.356  23.936   6.795
   85   HG23  ILE  10          HG23      ILE  10  39.621  22.983   5.335
   86   HD11  ILE  10          HD11      ILE  10  43.385  22.940   6.510
   87   HD12  ILE  10          HD12      ILE  10  43.764  23.999   7.868
   88   HD13  ILE  10          HD13      ILE  10  42.652  24.541   6.611
   89    H    CYS  11           HN       CYS  11  39.930  19.738   6.030
   90    HA   CYS  11           HA       CYS  11  37.656  20.397   4.492
   91    HB2  CYS  11           HB2      CYS  11  39.196  17.819   4.819
   92    HB3  CYS  11           HB1      CYS  11  37.876  18.010   3.664
   93    HG   CYS  11           HG       CYS  11  39.355  20.095   2.688
   94    H    SER  12           HN       SER  12  38.123  17.854   6.975
   95    HA   SER  12           HA       SER  12  35.533  16.853   6.987
   96    HB2  SER  12           HB2      SER  12  37.329  15.780   8.226
   97    HB3  SER  12           HB1      SER  12  37.469  17.176   9.290
   98    HG   SER  12           HG       SER  12  35.503  15.191   9.155
   99    H    PHE  13           HN       PHE  13  36.868  19.648   8.700
  100    HA   PHE  13           HA       PHE  13  34.643  20.243  10.306
  101    HB2  PHE  13           HB2      PHE  13  36.871  21.291  10.574
  102    HB3  PHE  13           HB1      PHE  13  36.620  22.175   9.068
  103    HD1  PHE  13           HD1      PHE  13  35.406  21.728  12.542
  104    HD2  PHE  13           HD2      PHE  13  35.172  24.093   8.965
  105    HE1  PHE  13           HE1      PHE  13  34.156  23.475  13.780
  106    HE2  PHE  13           HE2      PHE  13  33.920  25.840  10.203
  107    HZ   PHE  13           HZ       PHE  13  33.412  25.532  12.610
  108    H    ILE  14           HN       ILE  14  35.507  21.409   7.047
  109    HA   ILE  14           HA       ILE  14  33.233  23.065   6.708
  110    HB   ILE  14           HB       ILE  14  35.025  21.701   4.683
  111   HG12  ILE  14          HG12      ILE  14  34.894  24.602   5.560
  112   HG13  ILE  14          HG11      ILE  14  35.996  23.430   6.282
  113   HG21  ILE  14          HG21      ILE  14  32.827  23.762   4.371
  114   HG22  ILE  14          HG22      ILE  14  32.954  22.196   3.568
  115   HG23  ILE  14          HG23      ILE  14  34.072  23.496   3.150
  116   HD11  ILE  14          HD11      ILE  14  35.933  24.420   3.428
  117   HD12  ILE  14          HD12      ILE  14  36.781  22.939   3.877
  118   HD13  ILE  14          HD13      ILE  14  37.271  24.483   4.576
  119    H    LEU  15           HN       LEU  15  33.884  19.700   5.828
  120    HA   LEU  15           HA       LEU  15  31.468  19.205   4.462
  121    HB2  LEU  15           HB2      LEU  15  33.421  17.392   5.883
  122    HB3  LEU  15           HB1      LEU  15  31.985  16.774   5.068
  123    HG   LEU  15           HG       LEU  15  33.989  18.574   3.687
  124   HD11  LEU  15          HD11      LEU  15  33.906  15.557   3.935
  125   HD12  LEU  15          HD12      LEU  15  35.260  16.636   4.266
  126   HD13  LEU  15          HD13      LEU  15  34.732  16.369   2.605
  127   HD21  LEU  15          HD21      LEU  15  32.917  17.372   1.677
  128   HD22  LEU  15          HD22      LEU  15  31.895  18.529   2.530
  129   HD23  LEU  15          HD23      LEU  15  31.693  16.799   2.811
  130    H    SER  16           HN       SER  16  32.286  19.329   7.833
  131    HA   SER  16           HA       SER  16  29.957  17.942   8.772
  132    HB2  SER  16           HB2      SER  16  31.908  19.791  10.149
  133    HB3  SER  16           HB1      SER  16  30.602  18.945  10.974
  134    HG   SER  16           HG       SER  16  32.561  17.769  11.045
  135    H    ALA  17           HN       ALA  17  30.883  21.369   8.474
  136    HA   ALA  17           HA       ALA  17  28.593  22.505   9.601
  137    HB1  ALA  17           HB1      ALA  17  30.171  23.602   7.259
  138    HB2  ALA  17           HB2      ALA  17  30.684  23.735   8.941
  139    HB3  ALA  17           HB3      ALA  17  29.201  24.529   8.404
  140    H    LEU  18           HN       LEU  18  29.278  21.800   6.153
  141    HA   LEU  18           HA       LEU  18  26.700  22.547   5.237
  142    HB2  LEU  18           HB2      LEU  18  28.652  20.614   3.979
  143    HB3  LEU  18           HB1      LEU  18  27.329  21.454   3.169
  144    HG   LEU  18           HG       LEU  18  29.675  22.808   4.527
  145   HD11  LEU  18          HD11      LEU  18  30.451  21.753   2.513
  146   HD12  LEU  18          HD12      LEU  18  30.220  23.461   2.140
  147   HD13  LEU  18          HD13      LEU  18  29.023  22.274   1.619
  148   HD21  LEU  18          HD21      LEU  18  27.292  23.846   2.971
  149   HD22  LEU  18          HD22      LEU  18  28.734  24.813   3.276
  150   HD23  LEU  18          HD23      LEU  18  27.753  24.247   4.626
  151    H    HIS  19           HN       HIS  19  28.128  19.487   6.252
  152    HA   HIS  19           HA       HIS  19  26.193  17.692   5.492
  153    HB2  HIS  19           HB2      HIS  19  27.916  16.592   6.497
  154    HB3  HIS  19           HB1      HIS  19  28.119  17.824   7.742
  155    HD2  HIS  19           HD2      HIS  19  26.615  17.409  10.085
  156    HE1  HIS  19           HE1      HIS  19  24.753  13.826   8.854
  157    HE2  HIS  19           HE2      HIS  19  25.126  15.392  10.817
  158    H    PHE  20           HN       PHE  20  26.258  19.483   8.574
  159    HA   PHE  20           HA       PHE  20  23.657  18.527   9.342
  160    HB2  PHE  20           HB2      PHE  20  25.819  19.992  10.536
  161    HB3  PHE  20           HB1      PHE  20  24.302  20.853  10.803
  162    HD1  PHE  20           HD1      PHE  20  26.372  18.181  11.917
  163    HD2  PHE  20           HD2      PHE  20  22.263  19.386  11.555
  164    HE1  PHE  20           HE1      PHE  20  25.730  16.529  13.655
  165    HE2  PHE  20           HE2      PHE  20  21.626  17.736  13.289
  166    HZ   PHE  20           HZ       PHE  20  23.350  16.306  14.327
  167    H    MET  21           HN       MET  21  24.842  21.170   7.437
  168    HA   MET  21           HA       MET  21  22.596  22.907   7.803
  169    HB2  MET  21           HB2      MET  21  25.051  22.858   6.318
  170    HB3  MET  21           HB1      MET  21  23.730  23.384   5.276
  171    HG2  MET  21           HG2      MET  21  23.098  25.101   6.885
  172    HG3  MET  21           HG1      MET  21  24.311  24.523   8.025
  173    HE1  MET  21           HE1      MET  21  23.670  26.960   4.983
  174    HE2  MET  21           HE2      MET  21  23.778  25.300   4.400
  175    HE3  MET  21           HE3      MET  21  25.014  26.469   3.943
  176    H    ALA  22           HN       ALA  22  23.559  20.967   4.975
  177    HA   ALA  22           HA       ALA  22  21.075  21.230   3.645
  178    HB1  ALA  22           HB1      ALA  22  23.296  20.592   2.602
  179    HB2  ALA  22           HB2      ALA  22  21.906  19.638   2.083
  180    HB3  ALA  22           HB3      ALA  22  23.041  18.976   3.259
  181    H    TRP  23           HN       TRP  23  22.398  18.692   5.772
  182    HA   TRP  23           HA       TRP  23  20.327  16.822   5.429
  183    HB2  TRP  23           HB2      TRP  23  22.542  16.400   6.522
  184    HB3  TRP  23           HB1      TRP  23  21.958  17.283   7.932
  185    HD1  TRP  23           HD1      TRP  23  21.630  14.009   6.082
  186    HE1  TRP  23           HE1      TRP  23  20.187  12.387   7.471
  187    HE3  TRP  23           HE3      TRP  23  19.953  17.199   9.699
  188    HZ2  TRP  23           HZ2      TRP  23  18.534  12.438   9.806
  189    HZ3  TRP  23           HZ3      TRP  23  18.444  16.388  11.490
  190    HH2  TRP  23           HH2      TRP  23  17.733  14.013  11.548
  191    H    THR  24           HN       THR  24  20.719  19.504   7.731
  192    HA   THR  24           HA       THR  24  18.388  18.958   9.245
  193    HB   THR  24           HB       THR  24  19.971  21.487   8.786
  194    HG1  THR  24           HG1      THR  24  20.972  20.875  10.543
  195   HG21  THR  24          HG21      THR  24  17.858  22.349   9.335
  196   HG22  THR  24          HG22      THR  24  18.662  22.221  10.899
  197   HG23  THR  24          HG23      THR  24  17.480  21.005  10.414
  198    H    ILE  25           HN       ILE  25  18.962  21.030   6.418
  199    HA   ILE  25           HA       ILE  25  16.391  22.167   6.278
  200    HB   ILE  25           HB       ILE  25  18.424  21.585   4.118
  201   HG12  ILE  25          HG12      ILE  25  17.669  24.218   5.407
  202   HG13  ILE  25          HG11      ILE  25  18.959  23.195   6.041
  203   HG21  ILE  25          HG21      ILE  25  15.829  23.144   4.070
  204   HG22  ILE  25          HG22      ILE  25  16.301  21.809   3.017
  205   HG23  ILE  25          HG23      ILE  25  17.104  23.373   2.874
  206   HD11  ILE  25          HD11      ILE  25  20.105  23.280   3.857
  207   HD12  ILE  25          HD12      ILE  25  19.866  24.903   4.508
  208   HD13  ILE  25          HD13      ILE  25  18.819  24.304   3.222
  209    H    GLY  26           HN       GLY  26  17.748  19.246   4.749
  210    HA2  GLY  26           HA2      GLY  26  15.479  18.515   3.263
  211    HA3  GLY  26           HA1      GLY  26  16.729  17.405   3.822
  212    H    HIS  27           HN       HIS  27  16.459  17.682   6.586
  213    HA   HIS  27           HA       HIS  27  14.427  15.876   7.195
  214    HB2  HIS  27           HB2      HIS  27  15.848  15.901   8.959
  215    HB3  HIS  27           HB1      HIS  27  16.289  17.589   8.704
  216    HD2  HIS  27           HD2      HIS  27  13.068  15.724  10.157
  217    HE1  HIS  27           HE1      HIS  27  13.593  19.397  12.169
  218    HE2  HIS  27           HE2      HIS  27  12.171  17.298  12.037
  219    H    LEU  28           HN       LEU  28  14.475  19.418   7.414
  220    HA   LEU  28           HA       LEU  28  11.724  19.483   8.351
  221    HB2  LEU  28           HB2      LEU  28  13.375  21.133   9.170
  222    HB3  LEU  28           HB1      LEU  28  13.556  21.749   7.528
  223    HG   LEU  28           HG       LEU  28  11.105  22.262   7.498
  224   HD11  LEU  28          HD11      LEU  28  11.345  21.272  10.346
  225   HD12  LEU  28          HD12      LEU  28  10.208  20.752   9.103
  226   HD13  LEU  28          HD13      LEU  28  10.040  22.346   9.839
  227   HD21  LEU  28          HD21      LEU  28  12.730  23.502   9.739
  228   HD22  LEU  28          HD22      LEU  28  11.262  24.200   9.058
  229   HD23  LEU  28          HD23      LEU  28  12.702  24.025   8.055
  230    H    ASN  29           HN       ASN  29   9.937  20.005   7.159
  231    HA   ASN  29           HA       ASN  29  10.154  19.773   4.284
  232    HB2  ASN  29           HB2      ASN  29   7.813  20.209   6.147
  233    HB3  ASN  29           HB1      ASN  29   7.650  20.076   4.397
  234   HD21  ASN  29          HD21      ASN  29   6.520  18.167   6.303
  235   HD22  ASN  29          HD22      ASN  29   7.279  16.675   6.021
  236    H    GLN  30           HN       GLN  30  10.600  21.436   2.997
  237    HA   GLN  30           HA       GLN  30   9.796  24.147   3.869
  238    HB2  GLN  30           HB2      GLN  30  12.250  23.790   3.684
  239    HB3  GLN  30           HB1      GLN  30  12.034  23.374   1.983
  240    HG2  GLN  30           HG2      GLN  30  11.036  25.598   1.571
  241    HG3  GLN  30           HG1      GLN  30  11.282  26.015   3.266
  242   HE21  GLN  30          HE21      GLN  30  13.114  27.288   3.521
  243   HE22  GLN  30          HE22      GLN  30  14.540  27.137   2.614
  244    H    ILE  31           HN       ILE  31   8.188  25.016   2.740
  245    HA   ILE  31           HA       ILE  31   7.793  24.132  -0.057
  246    HB   ILE  31           HB       ILE  31   5.695  25.028   1.939
  247   HG12  ILE  31          HG12      ILE  31   6.105  22.285   0.716
  248   HG13  ILE  31          HG11      ILE  31   6.758  22.732   2.292
  249   HG21  ILE  31          HG21      ILE  31   4.099  24.403   0.194
  250   HG22  ILE  31          HG22      ILE  31   5.413  23.888  -0.862
  251   HG23  ILE  31          HG23      ILE  31   5.224  25.594  -0.459
  252   HD11  ILE  31          HD11      ILE  31   4.562  23.141   3.177
  253   HD12  ILE  31          HD12      ILE  31   4.504  21.577   2.365
  254   HD13  ILE  31          HD13      ILE  31   3.829  23.003   1.578
  255    H    LYS  32           HN       LYS  32   8.106  25.682  -1.514
  256    HA   LYS  32           HA       LYS  32   7.980  28.496  -0.638
  257    HB2  LYS  32           HB2      LYS  32   9.415  27.135  -2.919
  258    HB3  LYS  32           HB1      LYS  32   9.255  28.888  -2.805
  259    HG2  LYS  32           HG2      LYS  32  10.280  28.765  -0.512
  260    HG3  LYS  32           HG1      LYS  32  10.578  27.050  -0.793
  261    HD2  LYS  32           HD2      LYS  32  11.568  29.213  -2.659
  262    HD3  LYS  32           HD1      LYS  32  12.532  28.591  -1.320
  263    HE2  LYS  32           HE2      LYS  32  12.235  26.283  -2.266
  264    HE3  LYS  32           HE1      LYS  32  11.445  27.009  -3.666
  265    HZ1  LYS  32           HZ1      LYS  32  13.498  27.145  -4.496
  266    HZ2  LYS  32           HZ2      LYS  32  14.239  26.896  -2.988
  267    HZ3  LYS  32           HZ3      LYS  32  13.727  28.453  -3.439
  268    H    ARG  33           HN       ARG  33   6.246  29.600  -1.189
  269    HA   ARG  33           HA       ARG  33   4.610  28.678  -3.465
  270    HB2  ARG  33           HB2      ARG  33   2.885  30.259  -2.429
  271    HB3  ARG  33           HB1      ARG  33   3.273  28.805  -1.509
  272    HG2  ARG  33           HG2      ARG  33   4.405  29.968   0.121
  273    HG3  ARG  33           HG1      ARG  33   4.922  31.237  -0.989
  274    HD2  ARG  33           HD2      ARG  33   2.560  32.055  -1.072
  275    HD3  ARG  33           HD1      ARG  33   2.140  30.853   0.147
  276    HE   ARG  33           HE       ARG  33   3.561  33.329   0.589
  277   HH11  ARG  33          HH11      ARG  33   3.002  30.074   1.717
  278   HH12  ARG  33          HH12      ARG  33   3.430  30.442   3.355
  279   HH21  ARG  33          HH21      ARG  33   4.117  33.779   2.740
  280   HH22  ARG  33          HH22      ARG  33   4.056  32.522   3.929
  281    H1   MET   1           HT1      MET   1  40.852  17.415  36.642
  282    H2   MET   1           HT2      MET   1  42.116  16.280  36.616
  283    H3   MET   1           HT3      MET   1  41.017  16.361  35.323
  284    HA   MET   1           HA       MET   1  41.880  18.841  35.244
  285    HB2  MET   1           HB2      MET   1  43.390  18.365  37.204
  286    HB3  MET   1           HB1      MET   1  44.275  17.235  36.179
  287    HG2  MET   1           HG2      MET   1  43.819  19.937  35.036
  288    HG3  MET   1           HG1      MET   1  44.936  19.853  36.399
  289    HE1  MET   1           HE1      MET   1  47.259  20.076  33.308
  290    HE2  MET   1           HE2      MET   1  47.086  20.576  34.989
  291    HE3  MET   1           HE3      MET   1  45.805  20.936  33.834
  292    H    PHE   2           HN       PHE   2  42.463  15.489  34.547
  293    HA   PHE   2           HA       PHE   2  43.689  16.139  31.958
  294    HB2  PHE   2           HB2      PHE   2  43.291  13.491  33.369
  295    HB3  PHE   2           HB1      PHE   2  44.095  13.701  31.813
  296    HD1  PHE   2           HD1      PHE   2  44.394  14.025  35.428
  297    HD2  PHE   2           HD2      PHE   2  46.208  15.036  31.669
  298    HE1  PHE   2           HE1      PHE   2  46.513  14.568  36.596
  299    HE2  PHE   2           HE2      PHE   2  48.327  15.577  32.837
  300    HZ   PHE   2           HZ       PHE   2  48.480  15.344  35.301
  301    H    GLU   3           HN       GLU   3  42.415  16.338  30.247
  302    HA   GLU   3           HA       GLU   3  39.663  15.565  30.317
  303    HB2  GLU   3           HB2      GLU   3  41.426  16.668  28.127
  304    HB3  GLU   3           HB1      GLU   3  39.717  16.299  27.890
  305    HG2  GLU   3           HG2      GLU   3  39.146  17.810  29.767
  306    HG3  GLU   3           HG1      GLU   3  40.854  18.207  29.950
  307    HA   PRO   4           HA       PRO   4  39.594  11.468  28.702
  308    HB2  PRO   4           HB2      PRO   4  37.973  12.502  26.414
  309    HB3  PRO   4           HB1      PRO   4  37.623  11.172  27.532
  310    HG2  PRO   4           HG2      PRO   4  36.393  13.522  27.742
  311    HG3  PRO   4           HG1      PRO   4  36.839  12.574  29.171
  312    HD2  PRO   4           HD2      PRO   4  38.072  15.059  28.103
  313    HD3  PRO   4           HD1      PRO   4  37.967  14.474  29.776
  314    H    PHE   5           HN       PHE   5  39.993  13.967  26.195
  315    HA   PHE   5           HA       PHE   5  42.384  12.673  25.197
  316    HB2  PHE   5           HB2      PHE   5  39.800  12.628  23.681
  317    HB3  PHE   5           HB1      PHE   5  41.317  12.786  22.797
  318    HD1  PHE   5           HD1      PHE   5  39.080  10.520  24.451
  319    HD2  PHE   5           HD2      PHE   5  43.181  11.078  23.306
  320    HE1  PHE   5           HE1      PHE   5  39.480   8.085  24.698
  321    HE2  PHE   5           HE2      PHE   5  43.582   8.644  23.552
  322    HZ   PHE   5           HZ       PHE   5  41.732   7.146  24.248
  323    H    GLN   6           HN       GLN   6  39.887  15.014  24.158
  324    HA   GLN   6           HA       GLN   6  41.570  17.275  24.500
  325    HB2  GLN   6           HB2      GLN   6  42.059  17.836  22.207
  326    HB3  GLN   6           HB1      GLN   6  42.675  16.212  22.513
  327    HG2  GLN   6           HG2      GLN   6  40.336  15.432  21.652
  328    HG3  GLN   6           HG1      GLN   6  40.246  17.044  20.947
  329   HE21  GLN   6          HE21      GLN   6  41.387  17.398  19.005
  330   HE22  GLN   6          HE22      GLN   6  42.448  16.268  18.312
  331    H    ILE   7           HN       ILE   7  40.580  19.236  23.399
  332    HA   ILE   7           HA       ILE   7  37.875  19.458  24.111
  333    HB   ILE   7           HB       ILE   7  39.624  21.145  22.318
  334   HG12  ILE   7          HG12      ILE   7  38.928  22.614  24.523
  335   HG13  ILE   7          HG11      ILE   7  38.997  20.987  25.198
  336   HG21  ILE   7          HG21      ILE   7  37.391  21.573  21.567
  337   HG22  ILE   7          HG22      ILE   7  37.793  22.883  22.677
  338   HG23  ILE   7          HG23      ILE   7  36.762  21.557  23.214
  339   HD11  ILE   7          HD11      ILE   7  41.214  22.066  23.449
  340   HD12  ILE   7          HD12      ILE   7  41.261  20.695  24.558
  341   HD13  ILE   7          HD13      ILE   7  41.190  22.338  25.192
  342    H    LEU   8           HN       LEU   8  39.411  18.834  20.998
  343    HA   LEU   8           HA       LEU   8  37.100  19.026  19.376
  344    HB2  LEU   8           HB2      LEU   8  39.579  18.880  18.663
  345    HB3  LEU   8           HB1      LEU   8  39.375  17.134  18.807
  346    HG   LEU   8           HG       LEU   8  37.174  18.390  17.353
  347   HD11  LEU   8          HD11      LEU   8  40.014  18.703  16.352
  348   HD12  LEU   8          HD12      LEU   8  38.795  19.963  16.546
  349   HD13  LEU   8          HD13      LEU   8  38.611  18.746  15.283
  350   HD21  LEU   8          HD21      LEU   8  37.879  16.593  15.699
  351   HD22  LEU   8          HD22      LEU   8  37.490  16.002  17.315
  352   HD23  LEU   8          HD23      LEU   8  39.175  16.177  16.821
  353    H    SER   9           HN       SER   9  38.395  16.465  21.367
  354    HA   SER   9           HA       SER   9  36.679  14.397  20.331
  355    HB2  SER   9           HB2      SER   9  38.389  14.560  22.812
  356    HB3  SER   9           HB1      SER   9  37.455  13.136  22.362
  357    HG   SER   9           HG       SER   9  39.754  13.345  21.619
  358    H    ILE  10           HN       ILE  10  36.614  16.606  23.083
  359    HA   ILE  10           HA       ILE  10  34.387  15.469  24.406
  360    HB   ILE  10           HB       ILE  10  35.515  18.275  24.399
  361   HG12  ILE  10          HG12      ILE  10  35.565  16.142  26.551
  362   HG13  ILE  10          HG11      ILE  10  36.848  16.317  25.352
  363   HG21  ILE  10          HG21      ILE  10  34.124  18.460  26.547
  364   HG22  ILE  10          HG22      ILE  10  33.233  17.053  25.966
  365   HG23  ILE  10          HG23      ILE  10  33.232  18.546  25.028
  366   HD11  ILE  10          HD11      ILE  10  37.027  18.751  26.071
  367   HD12  ILE  10          HD12      ILE  10  37.547  17.570  27.274
  368   HD13  ILE  10          HD13      ILE  10  35.968  18.343  27.421
  369    H    CYS  11           HN       CYS  11  34.639  18.113  22.035
  370    HA   CYS  11           HA       CYS  11  31.889  18.748  21.955
  371    HB2  CYS  11           HB2      CYS  11  34.094  19.063  19.917
  372    HB3  CYS  11           HB1      CYS  11  32.460  19.682  19.669
  373    HG   CYS  11           HG       CYS  11  32.877  21.042  22.003
  374    H    SER  12           HN       SER  12  33.856  16.668  19.799
  375    HA   SER  12           HA       SER  12  31.807  15.798  18.137
  376    HB2  SER  12           HB2      SER  12  34.142  15.297  17.673
  377    HB3  SER  12           HB1      SER  12  34.243  14.294  19.117
  378    HG   SER  12           HG       SER  12  32.993  13.816  16.663
  379    H    PHE  13           HN       PHE  13  32.822  14.560  21.294
  380    HA   PHE  13           HA       PHE  13  31.211  12.260  21.368
  381    HB2  PHE  13           HB2      PHE  13  33.016  12.743  22.993
  382    HB3  PHE  13           HB1      PHE  13  32.034  14.039  23.677
  383    HD1  PHE  13           HD1      PHE  13  32.255  10.377  23.149
  384    HD2  PHE  13           HD2      PHE  13  30.166  13.570  25.120
  385    HE1  PHE  13           HE1      PHE  13  31.073   8.725  24.570
  386    HE2  PHE  13           HE2      PHE  13  28.983  11.918  26.542
  387    HZ   PHE  13           HZ       PHE  13  29.436   9.496  26.267
  388    H    ILE  14           HN       ILE  14  30.551  15.575  22.510
  389    HA   ILE  14           HA       ILE  14  27.937  15.049  23.468
  390    HB   ILE  14           HB       ILE  14  29.232  17.614  22.513
  391   HG12  ILE  14          HG12      ILE  14  28.612  16.649  25.319
  392   HG13  ILE  14          HG11      ILE  14  30.172  16.389  24.538
  393   HG21  ILE  14          HG21      ILE  14  26.583  17.078  23.879
  394   HG22  ILE  14          HG22      ILE  14  26.854  17.925  22.356
  395   HG23  ILE  14          HG23      ILE  14  27.359  18.662  23.876
  396   HD11  ILE  14          HD11      ILE  14  28.874  19.010  25.291
  397   HD12  ILE  14          HD12      ILE  14  30.192  18.934  24.121
  398   HD13  ILE  14          HD13      ILE  14  30.451  18.394  25.780
  399    H    LEU  15           HN       LEU  15  29.147  16.215  20.356
  400    HA   LEU  15           HA       LEU  15  26.645  16.678  19.140
  401    HB2  LEU  15           HB2      LEU  15  29.384  16.086  18.016
  402    HB3  LEU  15           HB1      LEU  15  27.984  16.373  16.982
  403    HG   LEU  15           HG       LEU  15  28.815  18.301  19.163
  404   HD11  LEU  15          HD11      LEU  15  29.655  18.146  16.258
  405   HD12  LEU  15          HD12      LEU  15  30.690  18.263  17.681
  406   HD13  LEU  15          HD13      LEU  15  29.722  19.649  17.180
  407   HD21  LEU  15          HD21      LEU  15  27.496  19.853  17.587
  408   HD22  LEU  15          HD22      LEU  15  26.552  18.662  18.480
  409   HD23  LEU  15          HD23      LEU  15  26.940  18.385  16.783
  410    H    SER  16           HN       SER  16  28.495  13.798  19.704
  411    HA   SER  16           HA       SER  16  27.109  12.157  17.799
  412    HB2  SER  16           HB2      SER  16  28.823  11.477  20.192
  413    HB3  SER  16           HB1      SER  16  28.165  10.280  19.080
  414    HG   SER  16           HG       SER  16  30.270  10.930  18.477
  415    H    ALA  17           HN       ALA  17  26.891  12.643  21.321
  416    HA   ALA  17           HA       ALA  17  24.905  10.754  21.867
  417    HB1  ALA  17           HB1      ALA  17  25.219  13.458  23.195
  418    HB2  ALA  17           HB2      ALA  17  26.220  12.056  23.570
  419    HB3  ALA  17           HB3      ALA  17  24.487  12.016  23.897
  420    H    LEU  18           HN       LEU  18  24.538  14.250  21.153
  421    HA   LEU  18           HA       LEU  18  21.703  14.188  21.117
  422    HB2  LEU  18           HB2      LEU  18  23.558  16.113  19.706
  423    HB3  LEU  18           HB1      LEU  18  21.860  16.384  20.106
  424    HG   LEU  18           HG       LEU  18  24.063  15.872  22.126
  425   HD11  LEU  18          HD11      LEU  18  24.368  18.065  21.198
  426   HD12  LEU  18          HD12      LEU  18  23.556  18.278  22.748
  427   HD13  LEU  18          HD13      LEU  18  22.636  18.395  21.248
  428   HD21  LEU  18          HD21      LEU  18  21.104  16.479  22.383
  429   HD22  LEU  18          HD22      LEU  18  22.241  16.650  23.721
  430   HD23  LEU  18          HD23      LEU  18  21.970  15.068  22.994
  431    H    HIS  19           HN       HIS  19  24.174  13.837  18.629
  432    HA   HIS  19           HA       HIS  19  22.673  13.940  16.333
  433    HB2  HIS  19           HB2      HIS  19  24.868  13.632  15.808
  434    HB3  HIS  19           HB1      HIS  19  25.134  12.491  17.126
  435    HD2  HIS  19           HD2      HIS  19  24.696   9.789  16.469
  436    HE1  HIS  19           HE1      HIS  19  23.591  10.426  12.444
  437    HE2  HIS  19           HE2      HIS  19  24.165   8.658  14.176
  438    H    PHE  20           HN       PHE  20  23.285  11.013  18.271
  439    HA   PHE  20           HA       PHE  20  21.476   9.428  16.696
  440    HB2  PHE  20           HB2      PHE  20  23.421   9.003  18.766
  441    HB3  PHE  20           HB1      PHE  20  21.911   8.198  19.197
  442    HD1  PHE  20           HD1      PHE  20  24.889   7.969  17.256
  443    HD2  PHE  20           HD2      PHE  20  20.745   6.835  17.289
  444    HE1  PHE  20           HE1      PHE  20  25.363   6.177  15.606
  445    HE2  PHE  20           HE2      PHE  20  21.220   5.047  15.640
  446    HZ   PHE  20           HZ       PHE  20  23.520   4.724  14.790
  447    H    MET  21           HN       MET  21  21.163  11.536  19.431
  448    HA   MET  21           HA       MET  21  18.791  10.355  20.519
  449    HB2  MET  21           HB2      MET  21  20.503  12.602  21.036
  450    HB3  MET  21           HB1      MET  21  18.814  13.101  21.123
  451    HG2  MET  21           HG2      MET  21  18.331  11.317  22.709
  452    HG3  MET  21           HG1      MET  21  19.968  10.685  22.545
  453    HE1  MET  21           HE1      MET  21  17.696  13.226  24.530
  454    HE2  MET  21           HE2      MET  21  18.042  13.875  22.930
  455    HE3  MET  21           HE3      MET  21  18.682  14.685  24.358
  456    H    ALA  22           HN       ALA  22  19.223  13.409  18.736
  457    HA   ALA  22           HA       ALA  22  16.465  13.787  18.232
  458    HB1  ALA  22           HB1      ALA  22  18.283  15.554  18.147
  459    HB2  ALA  22           HB2      ALA  22  17.117  15.593  16.824
  460    HB3  ALA  22           HB3      ALA  22  18.720  14.904  16.567
  461    H    TRP  23           HN       TRP  23  19.078  12.339  16.290
  462    HA   TRP  23           HA       TRP  23  17.617  12.003  13.911
  463    HB2  TRP  23           HB2      TRP  23  20.097  11.762  14.176
  464    HB3  TRP  23           HB1      TRP  23  19.810  10.205  14.956
  465    HD1  TRP  23           HD1      TRP  23  19.788  11.941  11.603
  466    HE1  TRP  23           HE1      TRP  23  19.411  10.195   9.744
  467    HE3  TRP  23           HE3      TRP  23  18.633   7.858  14.448
  468    HZ2  TRP  23           HZ2      TRP  23  18.707   7.432   9.496
  469    HZ3  TRP  23           HZ3      TRP  23  18.110   5.686  13.374
  470    HH2  TRP  23           HH2      TRP  23  18.146   5.468  10.905
  471    H    THR  24           HN       THR  24  18.013   9.891  16.745
  472    HA   THR  24           HA       THR  24  16.588   7.681  15.686
  473    HB   THR  24           HB       THR  24  17.165   8.572  18.512
  474    HG1  THR  24           HG1      THR  24  18.833   7.295  18.298
  475   HG21  THR  24          HG21      THR  24  15.215   7.298  18.810
  476   HG22  THR  24          HG22      THR  24  16.505   6.113  19.001
  477   HG23  THR  24          HG23      THR  24  15.607   6.202  17.485
  478    H    ILE  25           HN       ILE  25  15.570  10.465  17.645
  479    HA   ILE  25           HA       ILE  25  12.900   9.665  18.040
  480    HB   ILE  25           HB       ILE  25  14.153  12.413  17.891
  481   HG12  ILE  25          HG12      ILE  25  13.183  10.852  20.298
  482   HG13  ILE  25          HG11      ILE  25  14.841  10.737  19.707
  483   HG21  ILE  25          HG21      ILE  25  11.371  11.513  18.685
  484   HG22  ILE  25          HG22      ILE  25  11.806  12.702  17.458
  485   HG23  ILE  25          HG23      ILE  25  12.050  13.068  19.166
  486   HD11  ILE  25          HD11      ILE  25  15.105  13.177  19.959
  487   HD12  ILE  25          HD12      ILE  25  14.661  12.430  21.494
  488   HD13  ILE  25          HD13      ILE  25  13.448  13.296  20.552
  489    H    GLY  26           HN       GLY  26  14.398  11.669  15.501
  490    HA2  GLY  26           HA2      GLY  26  12.052  12.304  14.092
  491    HA3  GLY  26           HA1      GLY  26  13.671  12.251  13.397
  492    H    HIS  27           HN       HIS  27  14.294   9.557  13.773
  493    HA   HIS  27           HA       HIS  27  13.175   8.343  11.524
  494    HB2  HIS  27           HB2      HIS  27  15.048   7.182  12.045
  495    HB3  HIS  27           HB1      HIS  27  14.892   7.514  13.770
  496    HD2  HIS  27           HD2      HIS  27  13.001   5.105  11.202
  497    HE1  HIS  27           HE1      HIS  27  13.157   3.268  15.000
  498    HE2  HIS  27           HE2      HIS  27  12.405   2.976  12.592
  499    H    LEU  28           HN       LEU  28  12.314   8.040  14.955
  500    HA   LEU  28           HA       LEU  28  10.145   6.204  14.334
  501    HB2  LEU  28           HB2      LEU  28  11.457   5.946  16.416
  502    HB3  LEU  28           HB1      LEU  28  10.890   7.528  16.954
  503    HG   LEU  28           HG       LEU  28   8.535   6.690  16.781
  504   HD11  LEU  28          HD11      LEU  28   9.999   4.135  16.084
  505   HD12  LEU  28          HD12      LEU  28   8.699   4.925  15.192
  506   HD13  LEU  28          HD13      LEU  28   8.356   4.124  16.726
  507   HD21  LEU  28          HD21      LEU  28  10.424   5.113  18.557
  508   HD22  LEU  28          HD22      LEU  28   8.678   5.215  18.788
  509   HD23  LEU  28          HD23      LEU  28   9.673   6.663  18.943
  510    H    ASN  29           HN       ASN  29   7.993   6.687  14.273
  511    HA   ASN  29           HA       ASN  29   7.265   9.464  13.927
  512    HB2  ASN  29           HB2      ASN  29   5.678   6.892  13.838
  513    HB3  ASN  29           HB1      ASN  29   4.970   8.481  13.551
  514   HD21  ASN  29          HD21      ASN  29   5.129   6.367  11.537
  515   HD22  ASN  29          HD22      ASN  29   6.126   6.943  10.290
  516    H    GLN  30           HN       GLN  30   6.777  10.766  15.567
  517    HA   GLN  30           HA       GLN  30   5.605   9.578  18.011
  518    HB2  GLN  30           HB2      GLN  30   7.845  10.614  18.316
  519    HB3  GLN  30           HB1      GLN  30   7.185  12.148  17.748
  520    HG2  GLN  30           HG2      GLN  30   5.537  12.116  19.589
  521    HG3  GLN  30           HG1      GLN  30   6.218  10.596  20.165
  522   HE21  GLN  30          HE21      GLN  30   7.590  10.948  21.906
  523   HE22  GLN  30          HE22      GLN  30   8.612  12.291  22.087
  524    H    ILE  31           HN       ILE  31   3.536  10.055  18.346
  525    HA   ILE  31           HA       ILE  31   2.468  12.569  17.207
  526    HB   ILE  31           HB       ILE  31   1.019   9.941  17.630
  527   HG12  ILE  31          HG12      ILE  31   1.726  11.324  15.027
  528   HG13  ILE  31          HG11      ILE  31   2.728  10.058  15.733
  529   HG21  ILE  31          HG21      ILE  31  -0.840  11.044  16.489
  530   HG22  ILE  31          HG22      ILE  31   0.122  12.506  16.273
  531   HG23  ILE  31          HG23      ILE  31  -0.377  12.010  17.890
  532   HD11  ILE  31          HD11      ILE  31   0.947   8.453  15.588
  533   HD12  ILE  31          HD12      ILE  31   1.046   9.250  14.018
  534   HD13  ILE  31          HD13      ILE  31  -0.222   9.701  15.159
  535    H    LYS  32           HN       LYS  32   1.826  13.990  18.687
  536    HA   LYS  32           HA       LYS  32   1.237  13.029  21.412
  537    HB2  LYS  32           HB2      LYS  32   2.120  15.711  20.348
  538    HB3  LYS  32           HB1      LYS  32   1.538  15.484  21.998
  539    HG2  LYS  32           HG2      LYS  32   3.278  13.692  22.292
  540    HG3  LYS  32           HG1      LYS  32   3.918  14.124  20.706
  541    HD2  LYS  32           HD2      LYS  32   3.577  16.136  22.939
  542    HD3  LYS  32           HD1      LYS  32   5.072  15.236  22.684
  543    HE2  LYS  32           HE2      LYS  32   5.116  16.105  20.326
  544    HE3  LYS  32           HE1      LYS  32   3.729  17.119  20.724
  545    HZ1  LYS  32           HZ1      LYS  32   5.261  18.597  21.350
  546    HZ2  LYS  32           HZ2      LYS  32   6.504  17.443  21.422
  547    HZ3  LYS  32           HZ3      LYS  32   5.453  17.646  22.742
  548    H    ARG  33           HN       ARG  33  -0.812  12.910  21.974
  549    HA   ARG  33           HA       ARG  33  -2.807  14.513  20.502
  550    HB2  ARG  33           HB2      ARG  33  -4.439  12.890  21.624
  551    HB3  ARG  33           HB1      ARG  33  -3.381  12.215  20.384
  552    HG2  ARG  33           HG2      ARG  33  -2.126  11.027  21.901
  553    HG3  ARG  33           HG1      ARG  33  -2.377  12.202  23.192
  554    HD2  ARG  33           HD2      ARG  33  -4.758  11.444  23.344
  555    HD3  ARG  33           HD1      ARG  33  -4.394  10.193  22.157
  556    HE   ARG  33           HE       ARG  33  -3.639  10.191  24.945
  557   HH11  ARG  33          HH11      ARG  33  -2.871   9.044  21.738
  558   HH12  ARG  33          HH12      ARG  33  -2.030   7.641  22.314
  559   HH21  ARG  33          HH21      ARG  33  -2.531   8.349  25.666
  560   HH22  ARG  33          HH22      ARG  33  -1.837   7.253  24.517
  561    H1   MET   1           HT1      MET   1  46.138 -10.225  23.357
  562    H2   MET   1           HT2      MET   1  47.596  -9.816  22.586
  563    H3   MET   1           HT3      MET   1  46.168  -8.978  22.208
  564    HA   MET   1           HA       MET   1  46.218  -8.498  24.790
  565    HB2  MET   1           HB2      MET   1  48.341  -9.839  24.989
  566    HB3  MET   1           HB1      MET   1  49.138  -8.625  23.986
  567    HG2  MET   1           HG2      MET   1  47.596  -7.585  26.299
  568    HG3  MET   1           HG1      MET   1  49.059  -8.487  26.692
  569    HE1  MET   1           HE1      MET   1  50.126  -4.783  27.064
  570    HE2  MET   1           HE2      MET   1  50.356  -6.397  27.732
  571    HE3  MET   1           HE3      MET   1  48.731  -5.733  27.593
  572    H    PHE   2           HN       PHE   2  47.481  -7.793  21.633
  573    HA   PHE   2           HA       PHE   2  47.581  -4.914  22.211
  574    HB2  PHE   2           HB2      PHE   2  48.422  -6.489  19.766
  575    HB3  PHE   2           HB1      PHE   2  48.598  -4.744  19.960
  576    HD1  PHE   2           HD1      PHE   2  49.916  -8.023  20.844
  577    HD2  PHE   2           HD2      PHE   2  50.088  -3.828  21.749
  578    HE1  PHE   2           HE1      PHE   2  52.048  -8.374  22.061
  579    HE2  PHE   2           HE2      PHE   2  52.222  -4.178  22.964
  580    HZ   PHE   2           HZ       PHE   2  53.202  -6.451  23.121
  581    H    GLU   3           HN       GLU   3  45.837  -3.728  21.836
  582    HA   GLU   3           HA       GLU   3  43.587  -4.773  20.410
  583    HB2  GLU   3           HB2      GLU   3  44.174  -2.064  21.609
  584    HB3  GLU   3           HB1      GLU   3  42.657  -2.444  20.792
  585    HG2  GLU   3           HG2      GLU   3  42.308  -4.334  22.354
  586    HG3  GLU   3           HG1      GLU   3  43.798  -3.901  23.190
  587    HA   PRO   4           HA       PRO   4  44.183  -3.463  16.246
  588    HB2  PRO   4           HB2      PRO   4  41.700  -1.821  16.508
  589    HB3  PRO   4           HB1      PRO   4  42.115  -3.054  15.301
  590    HG2  PRO   4           HG2      PRO   4  40.397  -3.559  17.271
  591    HG3  PRO   4           HG1      PRO   4  41.518  -4.793  16.673
  592    HD2  PRO   4           HD2      PRO   4  41.592  -3.258  19.218
  593    HD3  PRO   4           HD1      PRO   4  42.191  -4.891  18.860
  594    H    PHE   5           HN       PHE   5  43.040  -0.860  18.394
  595    HA   PHE   5           HA       PHE   5  45.258   0.834  17.623
  596    HB2  PHE   5           HB2      PHE   5  42.454   1.373  16.716
  597    HB3  PHE   5           HB1      PHE   5  43.504   2.728  17.129
  598    HD1  PHE   5           HD1      PHE   5  42.648   0.307  14.622
  599    HD2  PHE   5           HD2      PHE   5  45.837   2.811  16.035
  600    HE1  PHE   5           HE1      PHE   5  43.782   0.101  12.425
  601    HE2  PHE   5           HE2      PHE   5  46.973   2.607  13.839
  602    HZ   PHE   5           HZ       PHE   5  45.945   1.250  12.030
  603    H    GLN   6           HN       GLN   6  42.005   1.059  19.089
  604    HA   GLN   6           HA       GLN   6  42.991   1.415  21.726
  605    HB2  GLN   6           HB2      GLN   6  42.541   3.761  22.071
  606    HB3  GLN   6           HB1      GLN   6  43.667   3.612  20.720
  607    HG2  GLN   6           HG2      GLN   6  41.511   3.583  19.248
  608    HG3  GLN   6           HG1      GLN   6  40.736   4.285  20.668
  609   HE21  GLN   6          HE21      GLN   6  41.053   6.515  21.033
  610   HE22  GLN   6          HE22      GLN   6  42.120   7.478  20.128
  611    H    ILE   7           HN       ILE   7  41.188   2.205  23.200
  612    HA   ILE   7           HA       ILE   7  38.902   0.620  22.827
  613    HB   ILE   7           HB       ILE   7  39.435   2.979  24.639
  614   HG12  ILE   7          HG12      ILE   7  39.090   0.738  26.176
  615   HG13  ILE   7          HG11      ILE   7  39.826   0.053  24.726
  616   HG21  ILE   7          HG21      ILE   7  37.053   2.931  24.376
  617   HG22  ILE   7          HG22      ILE   7  37.399   2.094  25.889
  618   HG23  ILE   7          HG23      ILE   7  37.016   1.169  24.437
  619   HD11  ILE   7          HD11      ILE   7  40.976   2.504  26.069
  620   HD12  ILE   7          HD12      ILE   7  41.757   1.413  24.925
  621   HD13  ILE   7          HD13      ILE   7  41.427   0.874  26.571
  622    H    LEU   8           HN       LEU   8  39.487   4.042  22.186
  623    HA   LEU   8           HA       LEU   8  36.829   4.781  21.562
  624    HB2  LEU   8           HB2      LEU   8  38.887   6.291  21.952
  625    HB3  LEU   8           HB1      LEU   8  39.248   6.006  20.249
  626    HG   LEU   8           HG       LEU   8  36.438   6.675  20.685
  627   HD11  LEU   8          HD11      LEU   8  38.601   8.597  21.575
  628   HD12  LEU   8          HD12      LEU   8  37.193   8.060  22.491
  629   HD13  LEU   8          HD13      LEU   8  36.987   9.128  21.102
  630   HD21  LEU   8          HD21      LEU   8  37.070   8.386  18.916
  631   HD22  LEU   8          HD22      LEU   8  37.400   6.711  18.478
  632   HD23  LEU   8          HD23      LEU   8  38.716   7.760  19.006
  633    H    SER   9           HN       SER   9  39.360   3.239  19.711
  634    HA   SER   9           HA       SER   9  38.066   3.530  17.154
  635    HB2  SER   9           HB2      SER   9  40.351   1.792  18.088
  636    HB3  SER   9           HB1      SER   9  39.767   1.827  16.427
  637    HG   SER   9           HG       SER   9  41.556   3.321  17.099
  638    H    ILE  10           HN       ILE  10  38.247   1.024  19.635
  639    HA   ILE  10           HA       ILE  10  36.972  -1.029  18.166
  640    HB   ILE  10           HB       ILE  10  37.193  -0.511  21.136
  641   HG12  ILE  10          HG12      ILE  10  38.525  -2.610  19.404
  642   HG13  ILE  10          HG11      ILE  10  39.256  -1.038  19.727
  643   HG21  ILE  10          HG21      ILE  10  36.562  -2.998  21.254
  644   HG22  ILE  10          HG22      ILE  10  35.967  -2.815  19.603
  645   HG23  ILE  10          HG23      ILE  10  35.250  -1.871  20.910
  646   HD11  ILE  10          HD11      ILE  10  38.957  -1.539  22.203
  647   HD12  ILE  10          HD12      ILE  10  40.143  -2.544  21.370
  648   HD13  ILE  10          HD13      ILE  10  38.541  -3.186  21.734
  649    H    CYS  11           HN       CYS  11  35.699   1.407  20.432
  650    HA   CYS  11           HA       CYS  11  33.004   0.569  20.334
  651    HB2  CYS  11           HB2      CYS  11  34.268   3.250  20.910
  652    HB3  CYS  11           HB1      CYS  11  32.535   2.955  21.056
  653    HG   CYS  11           HG       CYS  11  33.269   0.964  22.785
  654    H    SER  12           HN       SER  12  34.697   3.172  18.543
  655    HA   SER  12           HA       SER  12  32.568   3.992  16.959
  656    HB2  SER  12           HB2      SER  12  34.676   5.203  17.005
  657    HB3  SER  12           HB1      SER  12  35.510   3.836  16.274
  658    HG   SER  12           HG       SER  12  33.752   5.693  15.154
  659    H    PHE  13           HN       PHE  13  34.838   1.320  16.466
  660    HA   PHE  13           HA       PHE  13  34.058   0.594  13.868
  661    HB2  PHE  13           HB2      PHE  13  36.065  -0.293  15.014
  662    HB3  PHE  13           HB1      PHE  13  35.021  -1.212  16.100
  663    HD1  PHE  13           HD1      PHE  13  36.097  -0.806  12.576
  664    HD2  PHE  13           HD2      PHE  13  33.924  -3.228  15.379
  665    HE1  PHE  13           HE1      PHE  13  35.948  -2.619  10.892
  666    HE2  PHE  13           HE2      PHE  13  33.774  -5.042  13.694
  667    HZ   PHE  13           HZ       PHE  13  34.787  -4.738  11.451
  668    H    ILE  14           HN       ILE  14  32.875  -0.554  17.031
  669    HA   ILE  14           HA       ILE  14  30.961  -2.369  15.996
  670    HB   ILE  14           HB       ILE  14  31.096  -0.914  18.648
  671   HG12  ILE  14          HG12      ILE  14  31.704  -3.802  17.955
  672   HG13  ILE  14          HG11      ILE  14  32.940  -2.545  17.995
  673   HG21  ILE  14          HG21      ILE  14  29.290  -3.132  17.649
  674   HG22  ILE  14          HG22      ILE  14  28.807  -1.574  18.318
  675   HG23  ILE  14          HG23      ILE  14  29.537  -2.793  19.363
  676   HD11  ILE  14          HD11      ILE  14  31.258  -3.583  20.279
  677   HD12  ILE  14          HD12      ILE  14  32.096  -2.034  20.378
  678   HD13  ILE  14          HD13      ILE  14  33.015  -3.523  20.157
  679    H    LEU  15           HN       LEU  15  30.741   1.021  16.990
  680    HA   LEU  15           HA       LEU  15  27.960   1.326  16.630
  681    HB2  LEU  15           HB2      LEU  15  30.254   3.291  16.603
  682    HB3  LEU  15           HB1      LEU  15  28.579   3.796  16.380
  683    HG   LEU  15           HG       LEU  15  29.468   2.116  18.736
  684   HD11  LEU  15          HD11      LEU  15  29.356   5.124  18.406
  685   HD12  LEU  15          HD12      LEU  15  30.710   4.145  18.970
  686   HD13  LEU  15          HD13      LEU  15  29.283   4.345  19.986
  687   HD21  LEU  15          HD21      LEU  15  27.333   3.220  19.669
  688   HD22  LEU  15          HD22      LEU  15  27.102   2.002  18.417
  689   HD23  LEU  15          HD23      LEU  15  26.997   3.715  18.011
  690    H    SER  16           HN       SER  16  30.636   1.303  14.416
  691    HA   SER  16           HA       SER  16  29.244   2.541  12.233
  692    HB2  SER  16           HB2      SER  16  31.744   0.849  12.344
  693    HB3  SER  16           HB1      SER  16  31.138   1.618  10.880
  694    HG   SER  16           HG       SER  16  32.676   2.921  11.965
  695    H    ALA  17           HN       ALA  17  30.023  -0.817  13.129
  696    HA   ALA  17           HA       ALA  17  28.936  -2.094  10.893
  697    HB1  ALA  17           HB1      ALA  17  28.873  -3.112  13.746
  698    HB2  ALA  17           HB2      ALA  17  30.294  -3.186  12.705
  699    HB3  ALA  17           HB3      ALA  17  28.839  -4.086  12.276
  700    H    LEU  18           HN       LEU  18  27.383  -1.393  14.051
  701    HA   LEU  18           HA       LEU  18  24.823  -2.330  13.271
  702    HB2  LEU  18           HB2      LEU  18  25.512  -0.286  15.387
  703    HB3  LEU  18           HB1      LEU  18  24.023  -1.226  15.274
  704    HG   LEU  18           HG       LEU  18  26.797  -2.400  15.618
  705   HD11  LEU  18          HD11      LEU  18  26.161  -1.321  17.667
  706   HD12  LEU  18          HD12      LEU  18  25.852  -3.043  17.881
  707   HD13  LEU  18          HD13      LEU  18  24.514  -1.942  17.554
  708   HD21  LEU  18          HD21      LEU  18  24.025  -3.617  15.490
  709   HD22  LEU  18          HD22      LEU  18  25.424  -4.479  16.125
  710   HD23  LEU  18          HD23      LEU  18  25.400  -3.963  14.442
  711    H    HIS  19           HN       HIS  19  26.374   0.835  13.216
  712    HA   HIS  19           HA       HIS  19  24.257   2.481  12.618
  713    HB2  HIS  19           HB2      HIS  19  26.163   3.714  12.804
  714    HB3  HIS  19           HB1      HIS  19  27.149   2.514  11.965
  715    HD2  HIS  19           HD2      HIS  19  27.324   2.855   9.178
  716    HE1  HIS  19           HE1      HIS  19  24.862   6.277   8.936
  717    HE2  HIS  19           HE2      HIS  19  26.440   4.770   7.638
  718    H    PHE  20           HN       PHE  20  26.261   0.740  10.239
  719    HA   PHE  20           HA       PHE  20  24.578   1.525   8.043
  720    HB2  PHE  20           HB2      PHE  20  27.112   0.226   8.418
  721    HB3  PHE  20           HB1      PHE  20  26.112  -0.730   7.324
  722    HD1  PHE  20           HD1      PHE  20  28.264   2.091   7.589
  723    HD2  PHE  20           HD2      PHE  20  24.839   0.607   5.461
  724    HE1  PHE  20           HE1      PHE  20  28.689   3.719   5.765
  725    HE2  PHE  20           HE2      PHE  20  25.266   2.233   3.640
  726    HZ   PHE  20           HZ       PHE  20  27.183   3.791   3.795
  727    H    MET  21           HN       MET  21  24.557  -1.055  10.361
  728    HA   MET  21           HA       MET  21  23.090  -2.939   8.782
  729    HB2  MET  21           HB2      MET  21  24.167  -2.740  11.434
  730    HB3  MET  21           HB1      MET  21  22.521  -3.369  11.503
  731    HG2  MET  21           HG2      MET  21  23.080  -5.108   9.892
  732    HG3  MET  21           HG1      MET  21  24.693  -4.430   9.672
  733    HE1  MET  21           HE1      MET  21  22.540  -6.952  11.808
  734    HE2  MET  21           HE2      MET  21  22.165  -5.302  12.296
  735    HE3  MET  21           HE3      MET  21  22.965  -6.386  13.430
  736    H    ALA  22           HN       ALA  22  22.049  -0.975  11.565
  737    HA   ALA  22           HA       ALA  22  19.286  -1.428  11.159
  738    HB1  ALA  22           HB1      ALA  22  20.398  -0.649  13.300
  739    HB2  ALA  22           HB2      ALA  22  18.916   0.198  12.857
  740    HB3  ALA  22           HB3      ALA  22  20.482   0.954  12.570
  741    H    TRP  23           HN       TRP  23  21.450   1.222  10.163
  742    HA   TRP  23           HA       TRP  23  19.471   2.939   9.144
  743    HB2  TRP  23           HB2      TRP  23  21.869   3.528   9.579
  744    HB3  TRP  23           HB1      TRP  23  22.299   2.629   8.123
  745    HD1  TRP  23           HD1      TRP  23  20.726   5.846   9.317
  746    HE1  TRP  23           HE1      TRP  23  20.295   7.384   7.293
  747    HE3  TRP  23           HE3      TRP  23  21.741   2.598   5.508
  748    HZ2  TRP  23           HZ2      TRP  23  20.365   7.251   4.436
  749    HZ3  TRP  23           HZ3      TRP  23  21.547   3.328   3.147
  750    HH2  TRP  23           HH2      TRP  23  20.861   5.648   2.607
  751    H    THR  24           HN       THR  24  21.330   0.322   7.613
  752    HA   THR  24           HA       THR  24  20.334   0.725   4.993
  753    HB   THR  24           HB       THR  24  21.494  -1.690   6.383
  754    HG1  THR  24           HG1      THR  24  23.302  -0.986   5.543
  755   HG21  THR  24          HG21      THR  24  20.186  -2.694   4.713
  756   HG22  THR  24          HG22      THR  24  21.752  -2.490   3.931
  757   HG23  THR  24          HG23      THR  24  20.438  -1.368   3.577
  758    H    ILE  25           HN       ILE  25  19.240  -1.336   7.669
  759    HA   ILE  25           HA       ILE  25  17.174  -2.656   6.284
  760    HB   ILE  25           HB       ILE  25  17.482  -1.962   9.210
  761   HG12  ILE  25          HG12      ILE  25  17.795  -4.627   7.808
  762   HG13  ILE  25          HG11      ILE  25  19.147  -3.516   8.025
  763   HG21  ILE  25          HG21      ILE  25  15.462  -3.691   7.759
  764   HG22  ILE  25          HG22      ILE  25  15.137  -2.336   8.839
  765   HG23  ILE  25          HG23      ILE  25  15.789  -3.843   9.485
  766   HD11  ILE  25          HD11      ILE  25  18.775  -3.540  10.468
  767   HD12  ILE  25          HD12      ILE  25  19.078  -5.165   9.855
  768   HD13  ILE  25          HD13      ILE  25  17.433  -4.665  10.249
  769    H    GLY  26           HN       GLY  26  17.155   0.331   8.230
  770    HA2  GLY  26           HA2      GLY  26  14.406   0.879   8.048
  771    HA3  GLY  26           HA1      GLY  26  15.666   2.083   8.312
  772    H    HIS  27           HN       HIS  27  17.119   1.825   5.943
  773    HA   HIS  27           HA       HIS  27  15.743   3.495   4.188
  774    HB2  HIS  27           HB2      HIS  27  17.933   3.594   3.621
  775    HB3  HIS  27           HB1      HIS  27  18.241   1.937   4.140
  776    HD2  HIS  27           HD2      HIS  27  16.411   3.593   0.997
  777    HE1  HIS  27           HE1      HIS  27  18.270  -0.005  -0.192
  778    HE2  HIS  27           HE2      HIS  27  16.917   1.987  -0.998
  779    H    LEU  28           HN       LEU  28  16.136  -0.032   4.150
  780    HA   LEU  28           HA       LEU  28  14.498  -0.273   1.758
  781    HB2  LEU  28           HB2      LEU  28  16.414  -1.791   2.130
  782    HB3  LEU  28           HB1      LEU  28  15.623  -2.417   3.576
  783    HG   LEU  28           HG       LEU  28  13.674  -3.099   2.157
  784   HD11  LEU  28          HD11      LEU  28  15.503  -2.062  -0.018
  785   HD12  LEU  28          HD12      LEU  28  13.821  -1.632   0.288
  786   HD13  LEU  28          HD13      LEU  28  14.219  -3.225  -0.352
  787   HD21  LEU  28          HD21      LEU  28  16.392  -4.193   1.370
  788   HD22  LEU  28          HD22      LEU  28  14.857  -5.000   1.056
  789   HD23  LEU  28          HD23      LEU  28  15.393  -4.741   2.715
  790    H    ASN  29           HN       ASN  29  12.392  -0.934   1.668
  791    HA   ASN  29           HA       ASN  29  10.836  -0.730   4.096
  792    HB2  ASN  29           HB2      ASN  29  10.101  -1.303   1.220
  793    HB3  ASN  29           HB1      ASN  29   8.919  -1.205   2.522
  794   HD21  ASN  29          HD21      ASN  29   9.032   0.646   0.260
  795   HD22  ASN  29          HD22      ASN  29   9.376   2.183   0.893
  796    H    GLN  30           HN       GLN  30  10.533  -2.376   5.444
  797    HA   GLN  30           HA       GLN  30  10.584  -5.125   4.349
  798    HB2  GLN  30           HB2      GLN  30  12.415  -4.598   5.948
  799    HB3  GLN  30           HB1      GLN  30  11.202  -4.221   7.172
  800    HG2  GLN  30           HG2      GLN  30  10.300  -6.513   6.983
  801    HG3  GLN  30           HG1      GLN  30  11.529  -6.892   5.778
  802   HE21  GLN  30          HE21      GLN  30  13.227  -8.035   6.700
  803   HE22  GLN  30          HE22      GLN  30  13.827  -7.795   8.269
  804    H    ILE  31           HN       ILE  31   8.680  -6.117   4.323
  805    HA   ILE  31           HA       ILE  31   6.639  -5.304   6.308
  806    HB   ILE  31           HB       ILE  31   6.207  -6.312   3.483
  807   HG12  ILE  31          HG12      ILE  31   5.634  -3.565   4.629
  808   HG13  ILE  31          HG11      ILE  31   7.125  -3.944   3.765
  809   HG21  ILE  31          HG21      ILE  31   3.851  -5.824   3.912
  810   HG22  ILE  31          HG22      ILE  31   4.239  -5.231   5.527
  811   HG23  ILE  31          HG23      ILE  31   4.437  -6.941   5.144
  812   HD11  ILE  31          HD11      ILE  31   5.921  -4.489   1.759
  813   HD12  ILE  31          HD12      ILE  31   5.292  -2.944   2.330
  814   HD13  ILE  31          HD13      ILE  31   4.372  -4.424   2.601
  815    H    LYS  32           HN       LYS  32   6.122  -6.849   7.710
  816    HA   LYS  32           HA       LYS  32   6.721  -9.651   7.014
  817    HB2  LYS  32           HB2      LYS  32   6.419  -8.232   9.661
  818    HB3  LYS  32           HB1      LYS  32   6.479  -9.989   9.522
  819    HG2  LYS  32           HG2      LYS  32   8.658  -9.750   8.291
  820    HG3  LYS  32           HG1      LYS  32   8.612  -8.023   8.646
  821    HD2  LYS  32           HD2      LYS  32   8.436 -10.141  10.796
  822    HD3  LYS  32           HD1      LYS  32   9.964  -9.432  10.277
  823    HE2  LYS  32           HE2      LYS  32   9.012  -7.165  10.793
  824    HE3  LYS  32           HE1      LYS  32   7.592  -7.965  11.465
  825    HZ1  LYS  32           HZ1      LYS  32   8.751  -7.965  13.358
  826    HZ2  LYS  32           HZ2      LYS  32  10.228  -7.654  12.580
  827    HZ3  LYS  32           HZ3      LYS  32   9.641  -9.244  12.688
  828    H    ARG  33           HN       ARG  33   5.077 -10.884   6.460
  829    HA   ARG  33           HA       ARG  33   2.351 -10.111   7.285
  830    HB2  ARG  33           HB2      ARG  33   1.691 -11.797   5.476
  831    HB3  ARG  33           HB1      ARG  33   2.450 -10.304   4.922
  832    HG2  ARG  33           HG2      ARG  33   4.405 -11.355   4.318
  833    HG3  ARG  33           HG1      ARG  33   4.244 -12.600   5.558
  834    HD2  ARG  33           HD2      ARG  33   2.357 -13.587   4.246
  835    HD3  ARG  33           HD1      ARG  33   2.668 -12.403   2.979
  836    HE   ARG  33           HE       ARG  33   4.232 -14.763   3.551
  837   HH11  ARG  33          HH11      ARG  33   4.242 -11.543   2.204
  838   HH12  ARG  33          HH12      ARG  33   5.583 -11.860   1.154
  839   HH21  ARG  33          HH21      ARG  33   5.988 -15.144   2.169
  840   HH22  ARG  33          HH22      ARG  33   6.565 -13.880   1.134
  841    H1   MET   1           HT1      MET   1  54.710   4.507  -3.603
  842    H2   MET   1           HT2      MET   1  55.624   5.715  -2.835
  843    H3   MET   1           HT3      MET   1  53.979   5.522  -2.458
  844    HA   MET   1           HA       MET   1  54.795   3.097  -1.858
  845    HB2  MET   1           HB2      MET   1  57.140   3.734  -2.523
  846    HB3  MET   1           HB1      MET   1  57.151   4.880  -1.182
  847    HG2  MET   1           HG2      MET   1  56.295   2.117  -0.518
  848    HG3  MET   1           HG1      MET   1  57.996   2.318  -0.938
  849    HE1  MET   1           HE1      MET   1  58.018   2.131   2.929
  850    HE2  MET   1           HE2      MET   1  58.920   1.682   1.483
  851    HE3  MET   1           HE3      MET   1  57.234   1.200   1.645
  852    H    PHE   2           HN       PHE   2  54.603   6.451  -0.977
  853    HA   PHE   2           HA       PHE   2  54.076   5.782   1.834
  854    HB2  PHE   2           HB2      PHE   2  54.417   8.452   0.449
  855    HB3  PHE   2           HB1      PHE   2  54.143   8.234   2.177
  856    HD1  PHE   2           HD1      PHE   2  56.568   8.059  -0.535
  857    HD2  PHE   2           HD2      PHE   2  55.836   7.025   3.569
  858    HE1  PHE   2           HE1      PHE   2  58.996   7.689  -0.195
  859    HE2  PHE   2           HE2      PHE   2  58.265   6.655   3.909
  860    HZ   PHE   2           HZ       PHE   2  59.845   6.986   2.026
  861    H    GLU   3           HN       GLU   3  52.050   5.457   2.451
  862    HA   GLU   3           HA       GLU   3  49.842   6.061   0.733
  863    HB2  GLU   3           HB2      GLU   3  50.010   4.987   3.551
  864    HB3  GLU   3           HB1      GLU   3  48.482   5.239   2.709
  865    HG2  GLU   3           HG2      GLU   3  49.267   3.768   0.876
  866    HG3  GLU   3           HG1      GLU   3  50.763   3.485   1.764
  867    HA   PRO   4           HA       PRO   4  48.537  10.083   1.957
  868    HB2  PRO   4           HB2      PRO   4  45.940   8.880   2.823
  869    HB3  PRO   4           HB1      PRO   4  46.243  10.221   1.702
  870    HG2  PRO   4           HG2      PRO   4  45.544   7.807   0.825
  871    HG3  PRO   4           HG1      PRO   4  46.692   8.824  -0.062
  872    HD2  PRO   4           HD2      PRO   4  47.205   6.389   1.562
  873    HD3  PRO   4           HD1      PRO   4  48.082   7.015   0.150
  874    H    PHE   5           HN       PHE   5  47.526   7.525   4.222
  875    HA   PHE   5           HA       PHE   5  48.750   8.924   6.442
  876    HB2  PHE   5           HB2      PHE   5  45.775   8.759   6.111
  877    HB3  PHE   5           HB1      PHE   5  46.472   8.660   7.729
  878    HD1  PHE   5           HD1      PHE   5  45.525  10.845   5.040
  879    HD2  PHE   5           HD2      PHE   5  48.136  10.496   8.433
  880    HE1  PHE   5           HE1      PHE   5  45.824  13.309   5.064
  881    HE2  PHE   5           HE2      PHE   5  48.436  12.957   8.457
  882    HZ   PHE   5           HZ       PHE   5  47.280  14.364   6.772
  883    H    GLN   6           HN       GLN   6  46.295   6.401   5.798
  884    HA   GLN   6           HA       GLN   6  48.002   4.260   6.547
  885    HB2  GLN   6           HB2      GLN   6  47.051   3.644   8.677
  886    HB3  GLN   6           HB1      GLN   6  47.623   5.309   8.793
  887    HG2  GLN   6           HG2      GLN   6  45.192   5.931   8.071
  888    HG3  GLN   6           HG1      GLN   6  44.800   4.294   8.592
  889   HE21  GLN   6          HE21      GLN   6  44.581   3.934  10.836
  890   HE22  GLN   6          HE22      GLN   6  44.935   5.100  12.018
  891    H    ILE   7           HN       ILE   7  46.688   2.208   6.853
  892    HA   ILE   7           HA       ILE   7  44.970   1.845   4.665
  893    HB   ILE   7           HB       ILE   7  45.408   0.202   7.162
  894   HG12  ILE   7          HG12      ILE   7  46.280  -1.225   4.992
  895   HG13  ILE   7          HG11      ILE   7  46.623   0.428   4.480
  896   HG21  ILE   7          HG21      ILE   7  43.207  -0.384   6.420
  897   HG22  ILE   7          HG22      ILE   7  44.286  -1.628   5.789
  898   HG23  ILE   7          HG23      ILE   7  43.698  -0.349   4.726
  899   HD11  ILE   7          HD11      ILE   7  47.422  -0.574   7.218
  900   HD12  ILE   7          HD12      ILE   7  48.026   0.836   6.347
  901   HD13  ILE   7          HD13      ILE   7  48.466  -0.785   5.811
  902    H    LEU   8           HN       LEU   8  44.293   2.456   8.071
  903    HA   LEU   8           HA       LEU   8  41.490   2.067   7.985
  904    HB2  LEU   8           HB2      LEU   8  43.029   2.331  10.041
  905    HB3  LEU   8           HB1      LEU   8  42.839   4.067   9.792
  906    HG   LEU   8           HG       LEU   8  40.293   2.640   9.643
  907   HD11  LEU   8          HD11      LEU   8  41.983   2.450  12.147
  908   HD12  LEU   8          HD12      LEU   8  41.201   1.134  11.271
  909   HD13  LEU   8          HD13      LEU   8  40.226   2.299  12.166
  910   HD21  LEU   8          HD21      LEU   8  39.746   4.416  11.374
  911   HD22  LEU   8          HD22      LEU   8  40.369   5.039   9.847
  912   HD23  LEU   8          HD23      LEU   8  41.425   4.942  11.257
  913    H    SER   9           HN       SER   9  43.539   4.768   7.147
  914    HA   SER   9           HA       SER   9  41.408   6.693   6.933
  915    HB2  SER   9           HB2      SER   9  44.268   6.716   5.968
  916    HB3  SER   9           HB1      SER   9  43.156   8.065   5.754
  917    HG   SER   9           HG       SER   9  44.563   7.978   7.725
  918    H    ILE  10           HN       ILE  10  43.153   4.582   4.706
  919    HA   ILE  10           HA       ILE  10  42.084   5.630   2.306
  920    HB   ILE  10           HB       ILE  10  43.179   2.898   3.007
  921   HG12  ILE  10          HG12      ILE  10  44.353   5.106   1.295
  922   HG13  ILE  10          HG11      ILE  10  44.672   4.971   3.024
  923   HG21  ILE  10          HG21      ILE  10  43.366   2.715   0.451
  924   HG22  ILE  10          HG22      ILE  10  42.197   4.034   0.379
  925   HG23  ILE  10          HG23      ILE  10  41.755   2.506   1.138
  926   HD11  ILE  10          HD11      ILE  10  45.424   2.583   2.582
  927   HD12  ILE  10          HD12      ILE  10  46.469   3.835   1.912
  928   HD13  ILE  10          HD13      ILE  10  45.349   2.965   0.863
  929    H    CYS  11           HN       CYS  11  41.054   2.925   4.378
  930    HA   CYS  11           HA       CYS  11  38.853   2.119   2.801
  931    HB2  CYS  11           HB2      CYS  11  39.415   1.869   5.756
  932    HB3  CYS  11           HB1      CYS  11  38.009   1.141   4.981
  933    HG   CYS  11           HG       CYS  11  39.836  -0.107   3.376
  934    H    SER  12           HN       SER  12  38.992   4.240   5.686
  935    HA   SER  12           HA       SER  12  36.302   4.926   5.785
  936    HB2  SER  12           HB2      SER  12  37.845   5.554   7.552
  937    HB3  SER  12           HB1      SER  12  38.733   6.599   6.448
  938    HG   SER  12           HG       SER  12  36.227   6.938   7.641
  939    H    PHE  13           HN       PHE  13  38.913   6.334   3.855
  940    HA   PHE  13           HA       PHE  13  37.513   8.534   2.812
  941    HB2  PHE  13           HB2      PHE  13  39.959   8.215   2.595
  942    HB3  PHE  13           HB1      PHE  13  39.671   6.889   1.468
  943    HD1  PHE  13           HD1      PHE  13  39.279  10.537   1.998
  944    HD2  PHE  13           HD2      PHE  13  39.012   7.298  -0.811
  945    HE1  PHE  13           HE1      PHE  13  39.071  12.166   0.141
  946    HE2  PHE  13           HE2      PHE  13  38.804   8.928  -2.668
  947    HZ   PHE  13           HZ       PHE  13  38.834  11.362  -2.193
  948    H    ILE  14           HN       ILE  14  37.898   5.229   1.524
  949    HA   ILE  14           HA       ILE  14  36.345   5.632  -0.811
  950    HB   ILE  14           HB       ILE  14  36.985   3.116   0.747
  951   HG12  ILE  14          HG12      ILE  14  38.105   4.145  -1.875
  952   HG13  ILE  14          HG11      ILE  14  38.864   4.466  -0.316
  953   HG21  ILE  14          HG21      ILE  14  35.651   3.546  -1.937
  954   HG22  ILE  14          HG22      ILE  14  35.016   2.658  -0.553
  955   HG23  ILE  14          HG23      ILE  14  36.381   2.011  -1.465
  956   HD11  ILE  14          HD11      ILE  14  38.459   1.802  -1.681
  957   HD12  ILE  14          HD12      ILE  14  38.807   1.914   0.044
  958   HD13  ILE  14          HD13      ILE  14  39.969   2.528  -1.132
  959    H    LEU  15           HN       LEU  15  35.533   4.434   2.415
  960    HA   LEU  15           HA       LEU  15  32.839   3.776   1.893
  961    HB2  LEU  15           HB2      LEU  15  34.311   4.492   4.430
  962    HB3  LEU  15           HB1      LEU  15  32.596   4.080   4.420
  963    HG   LEU  15           HG       LEU  15  34.702   2.291   3.186
  964   HD11  LEU  15          HD11      LEU  15  33.621   2.386   6.013
  965   HD12  LEU  15          HD12      LEU  15  35.307   2.385   5.496
  966   HD13  LEU  15          HD13      LEU  15  34.332   0.926   5.325
  967   HD21  LEU  15          HD21      LEU  15  32.816   0.603   3.664
  968   HD22  LEU  15          HD22      LEU  15  32.515   1.766   2.375
  969   HD23  LEU  15          HD23      LEU  15  31.787   2.003   3.963
  970    H    SER  16           HN       SER  16  34.454   6.782   2.526
  971    HA   SER  16           HA       SER  16  32.091   8.265   3.210
  972    HB2  SER  16           HB2      SER  16  34.840   9.139   2.314
  973    HB3  SER  16           HB1      SER  16  33.566  10.246   2.816
  974    HG   SER  16           HG       SER  16  34.933   9.702   4.556
  975    H    ALA  17           HN       ALA  17  34.061   7.894   0.266
  976    HA   ALA  17           HA       ALA  17  32.673   9.680  -1.376
  977    HB1  ALA  17           HB1      ALA  17  33.912   7.050  -2.229
  978    HB2  ALA  17           HB2      ALA  17  34.833   8.525  -1.942
  979    HB3  ALA  17           HB3      ALA  17  33.643   8.467  -3.243
  980    H    LEU  18           HN       LEU  18  32.196   6.146  -0.996
  981    HA   LEU  18           HA       LEU  18  29.908   6.033  -2.669
  982    HB2  LEU  18           HB2      LEU  18  30.679   4.178  -0.412
  983    HB3  LEU  18           HB1      LEU  18  29.581   3.816  -1.745
  984    HG   LEU  18           HG       LEU  18  32.511   4.528  -2.049
  985   HD11  LEU  18          HD11      LEU  18  32.349   2.327  -1.107
  986   HD12  LEU  18          HD12      LEU  18  32.642   2.119  -2.834
  987   HD13  LEU  18          HD13      LEU  18  31.018   1.898  -2.181
  988   HD21  LEU  18          HD21      LEU  18  30.343   3.761  -4.021
  989   HD22  LEU  18          HD22      LEU  18  32.061   3.698  -4.412
  990   HD23  LEU  18          HD23      LEU  18  31.308   5.238  -4.004
  991    H    HIS  19           HN       HIS  19  30.365   6.442   0.802
  992    HA   HIS  19           HA       HIS  19  27.796   6.166   1.738
  993    HB2  HIS  19           HB2      HIS  19  29.209   6.586   3.474
  994    HB3  HIS  19           HB1      HIS  19  30.137   7.785   2.572
  995    HD2  HIS  19           HD2      HIS  19  29.214  10.433   2.810
  996    HE1  HIS  19           HE1      HIS  19  25.962   9.599   5.370
  997    HE2  HIS  19           HE2      HIS  19  27.339  11.453   4.315
  998    H    PHE  20           HN       PHE  20  29.246   9.191   0.528
  999    HA   PHE  20           HA       PHE  20  26.752  10.612   0.696
 1000    HB2  PHE  20           HB2      PHE  20  29.514  11.222   0.202
 1001    HB3  PHE  20           HB1      PHE  20  28.514  11.951  -1.055
 1002    HD1  PHE  20           HD1      PHE  20  29.718  12.297   2.275
 1003    HD2  PHE  20           HD2      PHE  20  26.339  13.167  -0.232
 1004    HE1  PHE  20           HE1      PHE  20  28.992  14.061   3.863
 1005    HE2  PHE  20           HE2      PHE  20  25.615  14.928   1.356
 1006    HZ   PHE  20           HZ       PHE  20  26.938  15.373   3.402
 1007    H    MET  21           HN       MET  21  28.287   8.590  -1.668
 1008    HA   MET  21           HA       MET  21  26.961   9.666  -3.968
 1009    HB2  MET  21           HB2      MET  21  28.795   7.550  -3.342
 1010    HB3  MET  21           HB1      MET  21  27.531   6.947  -4.413
 1011    HG2  MET  21           HG2      MET  21  27.958   8.753  -5.991
 1012    HG3  MET  21           HG1      MET  21  29.130   9.478  -4.892
 1013    HE1  MET  21           HE1      MET  21  28.661   6.872  -7.818
 1014    HE2  MET  21           HE2      MET  21  28.035   6.191  -6.318
 1015    HE3  MET  21           HE3      MET  21  29.451   5.471  -7.079
 1016    H    ALA  22           HN       ALA  22  26.447   6.589  -2.251
 1017    HA   ALA  22           HA       ALA  22  23.970   6.027  -3.503
 1018    HB1  ALA  22           HB1      ALA  22  25.490   4.367  -2.339
 1019    HB2  ALA  22           HB2      ALA  22  23.772   4.214  -1.973
 1020    HB3  ALA  22           HB3      ALA  22  24.854   4.984  -0.813
 1021    H    TRP  23           HN       TRP  23  24.792   7.554  -0.390
 1022    HA   TRP  23           HA       TRP  23  22.178   7.714   0.634
 1023    HB2  TRP  23           HB2      TRP  23  24.299   8.113   1.910
 1024    HB3  TRP  23           HB1      TRP  23  24.430   9.677   1.104
 1025    HD1  TRP  23           HD1      TRP  23  22.523   7.825   3.784
 1026    HE1  TRP  23           HE1      TRP  23  20.989   9.477   5.033
 1027    HE3  TRP  23           HE3      TRP  23  23.023  11.929   0.786
 1028    HZ2  TRP  23           HZ2      TRP  23  20.088  12.182   4.788
 1029    HZ3  TRP  23           HZ3      TRP  23  21.814  14.027   1.315
 1030    HH2  TRP  23           HH2      TRP  23  20.348  14.158   3.310
 1031    H    THR  24           HN       THR  24  24.045   9.943  -1.412
 1032    HA   THR  24           HA       THR  24  22.123  12.026  -1.437
 1033    HB   THR  24           HB       THR  24  24.332  11.271  -3.349
 1034    HG1  THR  24           HG1      THR  24  25.451  12.643  -2.197
 1035   HG21  THR  24          HG21      THR  24  22.865  12.438  -4.763
 1036   HG22  THR  24          HG22      THR  24  23.932  13.702  -4.152
 1037   HG23  THR  24          HG23      THR  24  22.316  13.509  -3.472
 1038    H    ILE  25           HN       ILE  25  22.674   9.259  -3.596
 1039    HA   ILE  25           HA       ILE  25  20.723   9.912  -5.517
 1040    HB   ILE  25           HB       ILE  25  21.824   7.239  -4.628
 1041   HG12  ILE  25          HG12      ILE  25  22.380   8.821  -7.149
 1042   HG13  ILE  25          HG11      ILE  25  23.340   9.023  -5.683
 1043   HG21  ILE  25          HG21      ILE  25  20.015   8.000  -6.936
 1044   HG22  ILE  25          HG22      ILE  25  19.712   6.795  -5.685
 1045   HG23  ILE  25          HG23      ILE  25  20.952   6.507  -6.905
 1046   HD11  ILE  25          HD11      ILE  25  23.873   6.611  -5.700
 1047   HD12  ILE  25          HD12      ILE  25  24.395   7.387  -7.196
 1048   HD13  ILE  25          HD13      ILE  25  22.924   6.413  -7.173
 1049    H    GLY  26           HN       GLY  26  20.538   7.912  -2.571
 1050    HA2  GLY  26           HA2      GLY  26  17.866   7.090  -2.846
 1051    HA3  GLY  26           HA1      GLY  26  18.739   7.212  -1.319
 1052    H    HIS  27           HN       HIS  27  19.277   9.950  -1.267
 1053    HA   HIS  27           HA       HIS  27  16.958  11.017  -0.145
 1054    HB2  HIS  27           HB2      HIS  27  18.686  12.304   0.551
 1055    HB3  HIS  27           HB1      HIS  27  19.615  12.024  -0.921
 1056    HD2  HIS  27           HD2      HIS  27  16.407  14.227  -0.012
 1057    HE1  HIS  27           HE1      HIS  27  18.674  16.198  -2.978
 1058    HE2  HIS  27           HE2      HIS  27  16.617  16.364  -1.500
 1059    H    LEU  28           HN       LEU  28  18.300  11.391  -3.411
 1060    HA   LEU  28           HA       LEU  28  16.072  13.073  -4.224
 1061    HB2  LEU  28           HB2      LEU  28  18.344  13.481  -5.110
 1062    HB3  LEU  28           HB1      LEU  28  18.324  11.887  -5.865
 1063    HG   LEU  28           HG       LEU  28  16.284  12.570  -7.148
 1064   HD11  LEU  28          HD11      LEU  28  16.851  15.184  -5.733
 1065   HD12  LEU  28          HD12      LEU  28  15.337  14.283  -5.794
 1066   HD13  LEU  28          HD13      LEU  28  15.925  15.117  -7.233
 1067   HD21  LEU  28          HD21      LEU  28  18.742  14.324  -7.449
 1068   HD22  LEU  28          HD22      LEU  28  17.493  14.125  -8.679
 1069   HD23  LEU  28          HD23      LEU  28  18.483  12.747  -8.196
 1070    H    ASN  29           HN       ASN  29  14.355  12.462  -5.487
 1071    HA   ASN  29           HA       ASN  29  13.761   9.631  -5.606
 1072    HB2  ASN  29           HB2      ASN  29  12.260  12.099  -6.498
 1073    HB3  ASN  29           HB1      ASN  29  11.632  10.463  -6.689
 1074   HD21  ASN  29          HD21      ASN  29  10.407  12.504  -4.990
 1075   HD22  ASN  29          HD22      ASN  29  10.494  11.936  -3.392
 1076    H    GLN  30           HN       GLN  30  14.427   8.362  -7.205
 1077    HA   GLN  30           HA       GLN  30  14.875   9.563  -9.871
 1078    HB2  GLN  30           HB2      GLN  30  16.918   8.679  -8.762
 1079    HB3  GLN  30           HB1      GLN  30  16.160   7.088  -8.691
 1080    HG2  GLN  30           HG2      GLN  30  15.944   7.087 -11.154
 1081    HG3  GLN  30           HG1      GLN  30  16.731   8.662 -11.217
 1082   HE21  GLN  30          HE21      GLN  30  18.897   8.455 -11.771
 1083   HE22  GLN  30          HE22      GLN  30  19.908   7.176 -11.295
 1084    H    ILE  31           HN       ILE  31  13.446   8.981 -11.364
 1085    HA   ILE  31           HA       ILE  31  12.096   6.363 -11.079
 1086    HB   ILE  31           HB       ILE  31  11.007   8.911 -12.307
 1087   HG12  ILE  31          HG12      ILE  31  10.110   7.477  -9.790
 1088   HG13  ILE  31          HG11      ILE  31  11.242   8.830  -9.764
 1089   HG21  ILE  31          HG21      ILE  31   8.919   7.655 -12.500
 1090   HG22  ILE  31          HG22      ILE  31   9.663   6.247 -11.745
 1091   HG23  ILE  31          HG23      ILE  31  10.195   6.775 -13.339
 1092   HD11  ILE  31          HD11      ILE  31   9.619  10.314 -10.733
 1093   HD12  ILE  31          HD12      ILE  31   8.817   9.471  -9.407
 1094   HD13  ILE  31          HD13      ILE  31   8.517   8.979 -11.074
 1095    H    LYS  32           HN       LYS  32  12.567   4.961 -12.639
 1096    HA   LYS  32           HA       LYS  32  13.662   5.982 -15.180
 1097    HB2  LYS  32           HB2      LYS  32  13.916   3.322 -13.776
 1098    HB3  LYS  32           HB1      LYS  32  14.420   3.568 -15.450
 1099    HG2  LYS  32           HG2      LYS  32  15.866   5.469 -14.666
 1100    HG3  LYS  32           HG1      LYS  32  15.459   5.030 -13.006
 1101    HD2  LYS  32           HD2      LYS  32  16.657   3.071 -14.976
 1102    HD3  LYS  32           HD1      LYS  32  17.636   4.052 -13.885
 1103    HE2  LYS  32           HE2      LYS  32  16.322   3.112 -11.963
 1104    HE3  LYS  32           HE1      LYS  32  15.518   2.033 -13.100
 1105    HZ1  LYS  32           HZ1      LYS  32  17.212   0.664 -12.682
 1106    HZ2  LYS  32           HZ2      LYS  32  18.166   1.885 -11.988
 1107    HZ3  LYS  32           HZ3      LYS  32  18.142   1.677 -13.675
 1108    H    ARG  33           HN       ARG  33  12.347   6.005 -16.853
 1109    HA   ARG  33           HA       ARG  33   9.986   4.236 -16.859
 1110    HB2  ARG  33           HB2      ARG  33   9.246   5.792 -18.750
 1111    HB3  ARG  33           HB1      ARG  33   9.307   6.492 -17.133
 1112    HG2  ARG  33           HG2      ARG  33  11.145   7.792 -17.610
 1113    HG3  ARG  33           HG1      ARG  33  11.782   6.647 -18.791
 1114    HD2  ARG  33           HD2      ARG  33   9.920   7.280 -20.334
 1115    HD3  ARG  33           HD1      ARG  33   9.418   8.503 -19.169
 1116    HE   ARG  33           HE       ARG  33  11.685   8.653 -20.954
 1117   HH11  ARG  33          HH11      ARG  33  10.308   9.724 -17.931
 1118   HH12  ARG  33          HH12      ARG  33  11.228  11.192 -17.897
 1119   HH21  ARG  33          HH21      ARG  33  12.875  10.580 -20.879
 1120   HH22  ARG  33          HH22      ARG  33  12.670  11.672 -19.550
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1  51.699  27.360   8.544
    2    H2   MET   1           HT2      MET   1  50.472  28.366   7.939
    3    H3   MET   1           HT3      MET   1  50.076  27.025   8.903
    4    HA   MET   1           HA       MET   1  51.532  28.167  10.676
    5    HB2  MET   1           HB2      MET   1  50.985  30.312   8.639
    6    HB3  MET   1           HB1      MET   1  51.138  30.724  10.349
    7    HG2  MET   1           HG2      MET   1  53.352  29.701  10.435
    8    HG3  MET   1           HG1      MET   1  53.200  29.170   8.760
    9    HE1  MET   1           HE1      MET   1  55.628  30.361   8.582
   10    HE2  MET   1           HE2      MET   1  55.471  30.952  10.235
   11    HE3  MET   1           HE3      MET   1  55.898  32.072   8.943
   12    H    PHE   2           HN       PHE   2  48.633  28.691   8.780
   13    HA   PHE   2           HA       PHE   2  47.097  29.290  11.216
   14    HB2  PHE   2           HB2      PHE   2  46.344  29.444   8.291
   15    HB3  PHE   2           HB1      PHE   2  45.252  29.806   9.628
   16    HD1  PHE   2           HD1      PHE   2  47.865  31.070   7.499
   17    HD2  PHE   2           HD2      PHE   2  45.936  31.620  11.296
   18    HE1  PHE   2           HE1      PHE   2  48.789  33.368   7.634
   19    HE2  PHE   2           HE2      PHE   2  46.858  33.919  11.432
   20    HZ   PHE   2           HZ       PHE   2  48.285  34.792   9.602
   21    H    GLU   3           HN       GLU   3  48.131  26.579   9.738
   22    HA   GLU   3           HA       GLU   3  45.796  25.084   9.319
   23    HB2  GLU   3           HB2      GLU   3  48.621  24.264   9.977
   24    HB3  GLU   3           HB1      GLU   3  47.340  23.111   9.592
   25    HG2  GLU   3           HG2      GLU   3  47.740  25.426   7.745
   26    HG3  GLU   3           HG1      GLU   3  48.909  24.107   7.684
   27    HA   PRO   4           HA       PRO   4  44.767  24.706  13.707
   28    HB2  PRO   4           HB2      PRO   4  42.565  23.112  13.428
   29    HB3  PRO   4           HB1      PRO   4  42.544  24.860  13.124
   30    HG2  PRO   4           HG2      PRO   4  42.684  22.599  11.196
   31    HG3  PRO   4           HG1      PRO   4  41.805  24.134  11.078
   32    HD2  PRO   4           HD2      PRO   4  44.180  23.662   9.795
   33    HD3  PRO   4           HD1      PRO   4  43.642  25.280  10.289
   34    H    PHE   5           HN       PHE   5  44.983  21.936  11.524
   35    HA   PHE   5           HA       PHE   5  46.437  20.425  13.533
   36    HB2  PHE   5           HB2      PHE   5  43.697  19.631  12.570
   37    HB3  PHE   5           HB1      PHE   5  44.863  18.419  13.098
   38    HD1  PHE   5           HD1      PHE   5  42.403  20.804  14.149
   39    HD2  PHE   5           HD2      PHE   5  45.961  18.757  15.413
   40    HE1  PHE   5           HE1      PHE   5  41.845  21.294  16.516
   41    HE2  PHE   5           HE2      PHE   5  45.404  19.248  17.779
   42    HZ   PHE   5           HZ       PHE   5  43.345  20.516  18.331
   43    H    GLN   6           HN       GLN   6  44.595  19.278  10.740
   44    HA   GLN   6           HA       GLN   6  47.009  19.111   9.109
   45    HB2  GLN   6           HB2      GLN   6  45.388  16.662   9.855
   46    HB3  GLN   6           HB1      GLN   6  46.711  16.704   8.690
   47    HG2  GLN   6           HG2      GLN   6  48.215  17.531  10.518
   48    HG3  GLN   6           HG1      GLN   6  46.891  17.292  11.656
   49   HE21  GLN   6          HE21      GLN   6  49.562  15.853  11.441
   50   HE22  GLN   6          HE22      GLN   6  49.152  14.210  11.328
   51    H    ILE   7           HN       ILE   7  46.478  18.278   6.905
   52    HA   ILE   7           HA       ILE   7  44.383  19.734   5.741
   53    HB   ILE   7           HB       ILE   7  45.977  17.384   4.716
   54   HG12  ILE   7          HG12      ILE   7  46.071  20.312   3.941
   55   HG13  ILE   7          HG11      ILE   7  47.082  19.635   5.217
   56   HG21  ILE   7          HG21      ILE   7  45.120  18.218   2.458
   57   HG22  ILE   7          HG22      ILE   7  43.898  19.117   3.358
   58   HG23  ILE   7          HG23      ILE   7  43.947  17.356   3.453
   59   HD11  ILE   7          HD11      ILE   7  48.221  18.199   3.704
   60   HD12  ILE   7          HD12      ILE   7  48.115  19.746   2.864
   61   HD13  ILE   7          HD13      ILE   7  47.012  18.437   2.441
   62    H    LEU   8           HN       LEU   8  44.579  16.377   6.774
   63    HA   LEU   8           HA       LEU   8  42.050  15.568   5.699
   64    HB2  LEU   8           HB2      LEU   8  44.084  14.129   6.516
   65    HB3  LEU   8           HB1      LEU   8  43.287  14.237   8.086
   66    HG   LEU   8           HG       LEU   8  41.534  13.551   5.790
   67   HD11  LEU   8          HD11      LEU   8  43.512  11.559   6.939
   68   HD12  LEU   8          HD12      LEU   8  43.594  12.241   5.313
   69   HD13  LEU   8          HD13      LEU   8  42.239  11.208   5.770
   70   HD21  LEU   8          HD21      LEU   8  40.716  11.913   7.548
   71   HD22  LEU   8          HD22      LEU   8  40.592  13.611   8.005
   72   HD23  LEU   8          HD23      LEU   8  41.900  12.618   8.650
   73    H    SER   9           HN       SER   9  43.108  16.920   8.746
   74    HA   SER   9           HA       SER   9  40.684  16.490  10.205
   75    HB2  SER   9           HB2      SER   9  42.829  16.957  11.328
   76    HB3  SER   9           HB1      SER   9  42.828  18.575  10.634
   77    HG   SER   9           HG       SER   9  41.958  18.378  12.817
   78    H    ILE  10           HN       ILE  10  41.972  19.249   8.358
   79    HA   ILE  10           HA       ILE  10  39.756  20.959   8.897
   80    HB   ILE  10           HB       ILE  10  40.664  22.348   7.066
   81   HG12  ILE  10          HG12      ILE  10  42.656  20.096   6.736
   82   HG13  ILE  10          HG11      ILE  10  41.331  20.405   5.619
   83   HG21  ILE  10          HG21      ILE  10  41.655  22.509   9.301
   84   HG22  ILE  10          HG22      ILE  10  42.911  22.698   8.079
   85   HG23  ILE  10          HG23      ILE  10  42.741  21.168   8.940
   86   HD11  ILE  10          HD11      ILE  10  43.214  21.484   4.656
   87   HD12  ILE  10          HD12      ILE  10  43.716  22.163   6.205
   88   HD13  ILE  10          HD13      ILE  10  42.272  22.776   5.398
   89    H    CYS  11           HN       CYS  11  40.439  18.499   6.482
   90    HA   CYS  11           HA       CYS  11  38.431  19.201   4.618
   91    HB2  CYS  11           HB2      CYS  11  40.233  17.594   4.121
   92    HB3  CYS  11           HB1      CYS  11  39.548  16.469   5.294
   93    HG   CYS  11           HG       CYS  11  38.545  15.809   2.989
   94    H    SER  12           HN       SER  12  38.422  16.810   7.293
   95    HA   SER  12           HA       SER  12  35.726  16.071   7.036
   96    HB2  SER  12           HB2      SER  12  37.328  14.789   8.383
   97    HB3  SER  12           HB1      SER  12  37.444  16.128   9.523
   98    HG   SER  12           HG       SER  12  35.934  14.519  10.181
   99    H    PHE  13           HN       PHE  13  37.265  18.726   8.750
  100    HA   PHE  13           HA       PHE  13  35.076  19.584  10.307
  101    HB2  PHE  13           HB2      PHE  13  37.206  20.527  10.768
  102    HB3  PHE  13           HB1      PHE  13  37.412  21.062   9.101
  103    HD1  PHE  13           HD1      PHE  13  35.129  21.500  12.047
  104    HD2  PHE  13           HD2      PHE  13  36.811  23.236   8.496
  105    HE1  PHE  13           HE1      PHE  13  34.060  23.669  12.598
  106    HE2  PHE  13           HE2      PHE  13  35.740  25.404   9.047
  107    HZ   PHE  13           HZ       PHE  13  34.364  25.621  11.098
  108    H    ILE  14           HN       ILE  14  36.116  20.657   7.054
  109    HA   ILE  14           HA       ILE  14  33.928  22.418   6.652
  110    HB   ILE  14           HB       ILE  14  35.757  21.038   4.674
  111   HG12  ILE  14          HG12      ILE  14  36.674  22.701   6.433
  112   HG13  ILE  14          HG11      ILE  14  37.062  23.015   4.743
  113   HG21  ILE  14          HG21      ILE  14  33.854  21.672   3.417
  114   HG22  ILE  14          HG22      ILE  14  34.963  23.026   3.216
  115   HG23  ILE  14          HG23      ILE  14  33.615  23.152   4.347
  116   HD11  ILE  14          HD11      ILE  14  36.210  24.997   6.183
  117   HD12  ILE  14          HD12      ILE  14  34.619  24.256   6.018
  118   HD13  ILE  14          HD13      ILE  14  35.503  24.775   4.583
  119    H    LEU  15           HN       LEU  15  34.496  19.020   5.859
  120    HA   LEU  15           HA       LEU  15  32.221  18.594   4.264
  121    HB2  LEU  15           HB2      LEU  15  33.804  16.775   6.075
  122    HB3  LEU  15           HB1      LEU  15  32.421  16.192   5.148
  123    HG   LEU  15           HG       LEU  15  34.713  17.693   3.870
  124   HD11  LEU  15          HD11      LEU  15  35.671  15.561   3.248
  125   HD12  LEU  15          HD12      LEU  15  34.331  14.690   3.993
  126   HD13  LEU  15          HD13      LEU  15  35.476  15.576   5.000
  127   HD21  LEU  15          HD21      LEU  15  32.403  16.000   2.881
  128   HD22  LEU  15          HD22      LEU  15  33.786  16.392   1.860
  129   HD23  LEU  15          HD23      LEU  15  32.761  17.682   2.484
  130    H    SER  16           HN       SER  16  32.593  17.702   7.705
  131    HA   SER  16           HA       SER  16  29.993  17.102   8.293
  132    HB2  SER  16           HB2      SER  16  32.025  18.528  10.011
  133    HB3  SER  16           HB1      SER  16  30.491  17.918  10.625
  134    HG   SER  16           HG       SER  16  32.445  16.497  10.714
  135    H    ALA  17           HN       ALA  17  31.447  20.317   8.023
  136    HA   ALA  17           HA       ALA  17  29.313  21.824   9.062
  137    HB1  ALA  17           HB1      ALA  17  31.738  22.471   8.208
  138    HB2  ALA  17           HB2      ALA  17  30.434  23.659   8.229
  139    HB3  ALA  17           HB3      ALA  17  30.865  22.847   6.723
  140    H    LEU  18           HN       LEU  18  30.028  20.995   5.662
  141    HA   LEU  18           HA       LEU  18  27.576  22.076   4.664
  142    HB2  LEU  18           HB2      LEU  18  29.386  20.025   3.364
  143    HB3  LEU  18           HB1      LEU  18  28.205  21.057   2.556
  144    HG   LEU  18           HG       LEU  18  30.656  22.011   4.060
  145   HD11  LEU  18          HD11      LEU  18  31.432  22.715   1.827
  146   HD12  LEU  18          HD12      LEU  18  29.987  22.012   1.102
  147   HD13  LEU  18          HD13      LEU  18  31.176  20.971   1.885
  148   HD21  LEU  18          HD21      LEU  18  28.421  23.465   2.628
  149   HD22  LEU  18          HD22      LEU  18  29.974  24.222   2.979
  150   HD23  LEU  18          HD23      LEU  18  28.944  23.669   4.299
  151    H    HIS  19           HN       HIS  19  28.441  19.113   6.150
  152    HA   HIS  19           HA       HIS  19  26.437  17.459   5.018
  153    HB2  HIS  19           HB2      HIS  19  28.300  16.400   6.068
  154    HB3  HIS  19           HB1      HIS  19  28.042  17.289   7.566
  155    HD2  HIS  19           HD2      HIS  19  25.925  16.332   9.184
  156    HE1  HIS  19           HE1      HIS  19  25.097  12.920   6.840
  157    HE2  HIS  19           HE2      HIS  19  24.614  14.075   9.049
  158    H    PHE  20           HN       PHE  20  26.616  19.396   7.987
  159    HA   PHE  20           HA       PHE  20  23.939  18.660   8.786
  160    HB2  PHE  20           HB2      PHE  20  26.196  19.975   9.976
  161    HB3  PHE  20           HB1      PHE  20  24.760  20.982  10.164
  162    HD1  PHE  20           HD1      PHE  20  25.975  17.463  10.580
  163    HD2  PHE  20           HD2      PHE  20  23.140  20.461  11.776
  164    HE1  PHE  20           HE1      PHE  20  25.128  15.955  12.358
  165    HE2  PHE  20           HE2      PHE  20  22.295  18.953  13.552
  166    HZ   PHE  20           HZ       PHE  20  23.286  16.700  13.836
  167    H    MET  21           HN       MET  21  25.414  21.104   6.821
  168    HA   MET  21           HA       MET  21  23.325  23.047   7.033
  169    HB2  MET  21           HB2      MET  21  25.552  22.554   5.060
  170    HB3  MET  21           HB1      MET  21  24.373  23.848   4.833
  171    HG2  MET  21           HG2      MET  21  25.949  23.500   7.391
  172    HG3  MET  21           HG1      MET  21  26.494  24.527   6.067
  173    HE1  MET  21           HE1      MET  21  26.345  25.513   8.748
  174    HE2  MET  21           HE2      MET  21  25.278  26.907   8.895
  175    HE3  MET  21           HE3      MET  21  26.446  26.836   7.580
  176    H    ALA  22           HN       ALA  22  24.203  20.862   4.361
  177    HA   ALA  22           HA       ALA  22  21.807  21.294   2.912
  178    HB1  ALA  22           HB1      ALA  22  22.597  19.719   1.402
  179    HB2  ALA  22           HB2      ALA  22  23.344  18.735   2.661
  180    HB3  ALA  22           HB3      ALA  22  24.092  20.254   2.168
  181    H    TRP  23           HN       TRP  23  22.775  18.755   5.195
  182    HA   TRP  23           HA       TRP  23  20.485  17.144   4.892
  183    HB2  TRP  23           HB2      TRP  23  22.641  16.535   6.061
  184    HB3  TRP  23           HB1      TRP  23  22.061  17.456   7.449
  185    HD1  TRP  23           HD1      TRP  23  21.615  14.215   5.581
  186    HE1  TRP  23           HE1      TRP  23  19.942  12.714   6.844
  187    HE3  TRP  23           HE3      TRP  23  19.864  17.546   9.045
  188    HZ2  TRP  23           HZ2      TRP  23  18.108  12.895   9.025
  189    HZ3  TRP  23           HZ3      TRP  23  18.152  16.850  10.699
  190    HH2  TRP  23           HH2      TRP  23  17.274  14.532  10.693
  191    H    THR  24           HN       THR  24  21.121  19.968   6.914
  192    HA   THR  24           HA       THR  24  18.756  19.805   8.491
  193    HB   THR  24           HB       THR  24  20.657  22.036   7.816
  194    HG1  THR  24           HG1      THR  24  19.978  20.558  10.131
  195   HG21  THR  24          HG21      THR  24  19.359  23.304   9.627
  196   HG22  THR  24          HG22      THR  24  18.048  22.162   9.332
  197   HG23  THR  24          HG23      THR  24  18.612  23.214   8.033
  198    H    ILE  25           HN       ILE  25  19.544  21.503   5.464
  199    HA   ILE  25           HA       ILE  25  17.099  22.876   5.186
  200    HB   ILE  25           HB       ILE  25  19.079  21.880   3.130
  201   HG12  ILE  25          HG12      ILE  25  18.522  24.691   4.113
  202   HG13  ILE  25          HG11      ILE  25  19.735  23.647   4.856
  203   HG21  ILE  25          HG21      ILE  25  17.909  23.634   1.676
  204   HG22  ILE  25          HG22      ILE  25  16.594  23.588   2.851
  205   HG23  ILE  25          HG23      ILE  25  17.021  22.136   1.945
  206   HD11  ILE  25          HD11      ILE  25  20.967  23.486   2.786
  207   HD12  ILE  25          HD12      ILE  25  20.647  25.195   3.081
  208   HD13  ILE  25          HD13      ILE  25  19.683  24.309   1.900
  209    H    GLY  26           HN       GLY  26  18.130  19.673   4.061
  210    HA2  GLY  26           HA2      GLY  26  15.785  19.015   2.623
  211    HA3  GLY  26           HA1      GLY  26  16.933  17.859   3.293
  212    H    HIS  27           HN       HIS  27  16.708  18.534   6.009
  213    HA   HIS  27           HA       HIS  27  14.517  16.970   6.815
  214    HB2  HIS  27           HB2      HIS  27  16.381  17.144   8.288
  215    HB3  HIS  27           HB1      HIS  27  16.277  18.903   8.324
  216    HD2  HIS  27           HD2      HIS  27  14.724  19.869  10.391
  217    HE1  HIS  27           HE1      HIS  27  12.685  16.292  11.327
  218    HE2  HIS  27           HE2      HIS  27  13.028  18.714  12.007
  219    H    LEU  28           HN       LEU  28  14.948  20.489   6.699
  220    HA   LEU  28           HA       LEU  28  12.390  21.074   7.854
  221    HB2  LEU  28           HB2      LEU  28  14.324  22.765   6.252
  222    HB3  LEU  28           HB1      LEU  28  12.875  23.387   7.043
  223    HG   LEU  28           HG       LEU  28  15.024  21.857   8.526
  224   HD11  LEU  28          HD11      LEU  28  15.953  23.962   9.223
  225   HD12  LEU  28          HD12      LEU  28  14.655  24.863   8.440
  226   HD13  LEU  28          HD13      LEU  28  15.851  24.009   7.464
  227   HD21  LEU  28          HD21      LEU  28  13.926  23.125  10.457
  228   HD22  LEU  28          HD22      LEU  28  12.938  21.868   9.712
  229   HD23  LEU  28          HD23      LEU  28  12.648  23.563   9.322
  230    H    ASN  29           HN       ASN  29  10.477  21.579   6.864
  231    HA   ASN  29           HA       ASN  29  10.260  20.826   4.032
  232    HB2  ASN  29           HB2      ASN  29   8.785  19.806   5.862
  233    HB3  ASN  29           HB1      ASN  29   7.976  21.371   5.925
  234   HD21  ASN  29          HD21      ASN  29   5.972  20.524   5.020
  235   HD22  ASN  29          HD22      ASN  29   5.865  20.052   3.394
  236    H    GLN  30           HN       GLN  30   9.459  22.192   2.478
  237    HA   GLN  30           HA       GLN  30   9.224  25.025   3.266
  238    HB2  GLN  30           HB2      GLN  30  10.189  23.652   0.786
  239    HB3  GLN  30           HB1      GLN  30   9.516  25.277   0.662
  240    HG2  GLN  30           HG2      GLN  30  11.690  25.863   1.102
  241    HG3  GLN  30           HG1      GLN  30  11.145  25.664   2.765
  242   HE21  GLN  30          HE21      GLN  30  13.898  25.272   1.848
  243   HE22  GLN  30          HE22      GLN  30  14.285  23.643   2.135
  244    H    ILE  31           HN       ILE  31   7.329  26.019   3.098
  245    HA   ILE  31           HA       ILE  31   5.321  25.004   1.209
  246    HB   ILE  31           HB       ILE  31   3.566  25.136   2.942
  247   HG12  ILE  31          HG12      ILE  31   5.860  25.415   4.907
  248   HG13  ILE  31          HG11      ILE  31   4.866  26.776   4.385
  249   HG21  ILE  31          HG21      ILE  31   4.248  23.096   4.175
  250   HG22  ILE  31          HG22      ILE  31   5.911  23.341   3.640
  251   HG23  ILE  31          HG23      ILE  31   4.650  22.981   2.461
  252   HD11  ILE  31          HD11      ILE  31   3.722  24.254   5.615
  253   HD12  ILE  31          HD12      ILE  31   2.874  25.766   5.289
  254   HD13  ILE  31          HD13      ILE  31   4.110  25.701   6.545
  255    H    LYS  32           HN       LYS  32   3.709  26.558   0.641
  256    HA   LYS  32           HA       LYS  32   4.524  29.337   1.239
  257    HB2  LYS  32           HB2      LYS  32   3.119  28.219  -1.199
  258    HB3  LYS  32           HB1      LYS  32   3.448  29.929  -0.918
  259    HG2  LYS  32           HG2      LYS  32   5.914  29.191  -0.613
  260    HG3  LYS  32           HG1      LYS  32   5.412  27.694  -1.400
  261    HD2  LYS  32           HD2      LYS  32   4.954  30.451  -2.569
  262    HD3  LYS  32           HD1      LYS  32   6.318  29.418  -2.993
  263    HE2  LYS  32           HE2      LYS  32   4.704  27.645  -3.694
  264    HE3  LYS  32           HE1      LYS  32   3.383  28.770  -3.378
  265    HZ1  LYS  32           HZ1      LYS  32   5.464  28.895  -5.457
  266    HZ2  LYS  32           HZ2      LYS  32   4.708  30.321  -4.926
  267    HZ3  LYS  32           HZ3      LYS  32   3.784  29.071  -5.613
  268    H    ARG  33           HN       ARG  33   3.178  30.449   2.475
  269    HA   ARG  33           HA       ARG  33   0.483  29.446   2.971
  270    HB2  ARG  33           HB2      ARG  33   2.353  31.326   4.303
  271    HB3  ARG  33           HB1      ARG  33   0.633  31.665   4.485
  272    HG2  ARG  33           HG2      ARG  33   1.610  28.857   4.888
  273    HG3  ARG  33           HG1      ARG  33   1.838  30.039   6.178
  274    HD2  ARG  33           HD2      ARG  33  -0.644  30.594   5.908
  275    HD3  ARG  33           HD1      ARG  33  -0.760  29.141   4.921
  276    HE   ARG  33           HE       ARG  33   0.497  28.466   7.349
  277   HH11  ARG  33          HH11      ARG  33  -2.591  29.530   6.131
  278   HH12  ARG  33          HH12      ARG  33  -3.487  28.753   7.392
  279   HH21  ARG  33          HH21      ARG  33  -0.699  27.464   8.985
  280   HH22  ARG  33          HH22      ARG  33  -2.427  27.590   8.997
  281    H1   MET   1           HT1      MET   1  43.939  19.911  32.714
  282    H2   MET   1           HT2      MET   1  42.350  20.021  33.304
  283    H3   MET   1           HT3      MET   1  42.703  19.008  31.987
  284    HA   MET   1           HA       MET   1  44.303  17.842  33.616
  285    HB2  MET   1           HB2      MET   1  42.511  19.508  35.367
  286    HB3  MET   1           HB1      MET   1  43.126  17.957  35.941
  287    HG2  MET   1           HG2      MET   1  45.423  18.683  35.555
  288    HG3  MET   1           HG1      MET   1  44.854  20.205  34.871
  289    HE1  MET   1           HE1      MET   1  46.639  21.206  36.649
  290    HE2  MET   1           HE2      MET   1  46.906  19.594  37.309
  291    HE3  MET   1           HE3      MET   1  46.530  20.931  38.393
  292    H    PHE   2           HN       PHE   2  40.904  18.576  33.192
  293    HA   PHE   2           HA       PHE   2  40.204  15.742  33.553
  294    HB2  PHE   2           HB2      PHE   2  38.473  18.205  33.267
  295    HB3  PHE   2           HB1      PHE   2  37.857  16.561  33.428
  296    HD1  PHE   2           HD1      PHE   2  39.111  19.452  35.172
  297    HD2  PHE   2           HD2      PHE   2  38.543  15.206  35.487
  298    HE1  PHE   2           HE1      PHE   2  39.346  19.604  37.636
  299    HE2  PHE   2           HE2      PHE   2  38.778  15.357  37.951
  300    HZ   PHE   2           HZ       PHE   2  39.180  17.557  39.026
  301    H    GLU   3           HN       GLU   3  41.370  17.549  31.107
  302    HA   GLU   3           HA       GLU   3  39.550  17.142  29.015
  303    HB2  GLU   3           HB2      GLU   3  42.536  17.547  29.033
  304    HB3  GLU   3           HB1      GLU   3  41.575  17.476  27.555
  305    HG2  GLU   3           HG2      GLU   3  40.652  19.297  29.737
  306    HG3  GLU   3           HG1      GLU   3  42.046  19.794  28.778
  307    HA   PRO   4           HA       PRO   4  40.252  12.684  28.726
  308    HB2  PRO   4           HB2      PRO   4  38.626  12.197  26.585
  309    HB3  PRO   4           HB1      PRO   4  38.015  12.437  28.233
  310    HG2  PRO   4           HG2      PRO   4  38.102  14.337  25.946
  311    HG3  PRO   4           HG1      PRO   4  36.846  14.104  27.176
  312    HD2  PRO   4           HD2      PRO   4  38.663  16.156  27.255
  313    HD3  PRO   4           HD1      PRO   4  37.900  15.469  28.704
  314    H    PHE   5           HN       PHE   5  40.460  14.861  25.950
  315    HA   PHE   5           HA       PHE   5  42.877  13.529  25.047
  316    HB2  PHE   5           HB2      PHE   5  40.309  13.476  23.477
  317    HB3  PHE   5           HB1      PHE   5  41.874  13.421  22.665
  318    HD1  PHE   5           HD1      PHE   5  39.371  11.515  24.381
  319    HD2  PHE   5           HD2      PHE   5  43.566  11.641  23.469
  320    HE1  PHE   5           HE1      PHE   5  39.555   9.094  24.889
  321    HE2  PHE   5           HE2      PHE   5  43.750   9.219  23.976
  322    HZ   PHE   5           HZ       PHE   5  41.744   7.946  24.685
  323    H    GLN   6           HN       GLN   6  40.577  15.518  23.231
  324    HA   GLN   6           HA       GLN   6  42.225  17.896  23.587
  325    HB2  GLN   6           HB2      GLN   6  41.711  16.678  20.860
  326    HB3  GLN   6           HB1      GLN   6  42.482  18.235  21.161
  327    HG2  GLN   6           HG2      GLN   6  44.233  17.041  22.503
  328    HG3  GLN   6           HG1      GLN   6  43.507  15.512  22.009
  329   HE21  GLN   6          HE21      GLN   6  46.225  16.692  21.323
  330   HE22  GLN   6          HE22      GLN   6  46.275  16.687  19.626
  331    H    ILE   7           HN       ILE   7  41.219  19.785  22.473
  332    HA   ILE   7           HA       ILE   7  38.532  20.100  23.214
  333    HB   ILE   7           HB       ILE   7  40.260  21.674  21.303
  334   HG12  ILE   7          HG12      ILE   7  39.261  22.370  24.077
  335   HG13  ILE   7          HG11      ILE   7  40.797  21.549  23.800
  336   HG21  ILE   7          HG21      ILE   7  38.477  23.462  21.695
  337   HG22  ILE   7          HG22      ILE   7  37.445  22.168  22.303
  338   HG23  ILE   7          HG23      ILE   7  38.010  22.134  20.633
  339   HD11  ILE   7          HD11      ILE   7  41.692  23.398  22.604
  340   HD12  ILE   7          HD12      ILE   7  40.877  24.112  23.994
  341   HD13  ILE   7          HD13      ILE   7  40.106  24.145  22.408
  342    H    LEU   8           HN       LEU   8  39.998  19.274  20.125
  343    HA   LEU   8           HA       LEU   8  37.586  19.402  18.588
  344    HB2  LEU   8           HB2      LEU   8  40.091  19.388  17.813
  345    HB3  LEU   8           HB1      LEU   8  39.887  17.637  17.830
  346    HG   LEU   8           HG       LEU   8  37.714  19.176  16.520
  347   HD11  LEU   8          HD11      LEU   8  40.437  18.844  15.226
  348   HD12  LEU   8          HD12      LEU   8  39.760  20.378  15.774
  349   HD13  LEU   8          HD13      LEU   8  38.990  19.495  14.456
  350   HD21  LEU   8          HD21      LEU   8  38.044  17.277  14.867
  351   HD22  LEU   8          HD22      LEU   8  37.620  16.770  16.503
  352   HD23  LEU   8          HD23      LEU   8  39.290  16.652  15.948
  353    H    SER   9           HN       SER   9  39.215  16.894  20.405
  354    HA   SER   9           HA       SER   9  37.664  14.684  19.465
  355    HB2  SER   9           HB2      SER   9  39.844  14.385  20.577
  356    HB3  SER   9           HB1      SER   9  39.154  14.999  22.075
  357    HG   SER   9           HG       SER   9  39.185  12.654  21.829
  358    H    ILE  10           HN       ILE  10  37.416  16.805  22.317
  359    HA   ILE  10           HA       ILE  10  35.139  15.483  23.408
  360    HB   ILE  10           HB       ILE  10  34.933  17.487  24.838
  361   HG12  ILE  10          HG12      ILE  10  37.228  18.551  23.180
  362   HG13  ILE  10          HG11      ILE  10  35.568  19.119  23.035
  363   HG21  ILE  10          HG21      ILE  10  36.551  15.748  25.435
  364   HG22  ILE  10          HG22      ILE  10  37.201  17.331  25.853
  365   HG23  ILE  10          HG23      ILE  10  37.770  16.497  24.407
  366   HD11  ILE  10          HD11      ILE  10  36.624  20.662  24.498
  367   HD12  ILE  10          HD12      ILE  10  37.420  19.377  25.407
  368   HD13  ILE  10          HD13      ILE  10  35.676  19.608  25.546
  369    H    CYS  11           HN       CYS  11  35.598  18.037  21.036
  370    HA   CYS  11           HA       CYS  11  32.959  19.050  21.024
  371    HB2  CYS  11           HB2      CYS  11  34.848  20.189  19.922
  372    HB3  CYS  11           HB1      CYS  11  34.950  18.873  18.751
  373    HG   CYS  11           HG       CYS  11  33.436  20.687  17.668
  374    H    SER  12           HN       SER  12  34.539  16.598  18.940
  375    HA   SER  12           HA       SER  12  32.241  15.899  17.487
  376    HB2  SER  12           HB2      SER  12  34.497  15.233  16.791
  377    HB3  SER  12           HB1      SER  12  34.628  14.181  18.200
  378    HG   SER  12           HG       SER  12  33.947  13.064  16.304
  379    H    PHE  13           HN       PHE  13  33.477  14.779  20.585
  380    HA   PHE  13           HA       PHE  13  31.813  12.535  20.947
  381    HB2  PHE  13           HB2      PHE  13  33.620  12.838  22.457
  382    HB3  PHE  13           HB1      PHE  13  33.079  14.459  22.894
  383    HD1  PHE  13           HD1      PHE  13  31.933  10.887  22.941
  384    HD2  PHE  13           HD2      PHE  13  31.727  14.766  24.775
  385    HE1  PHE  13           HE1      PHE  13  30.563   9.946  24.783
  386    HE2  PHE  13           HE2      PHE  13  30.357  13.825  26.616
  387    HZ   PHE  13           HZ       PHE  13  29.775  11.416  26.619
  388    H    ILE  14           HN       ILE  14  31.326  15.920  22.004
  389    HA   ILE  14           HA       ILE  14  28.734  15.484  23.074
  390    HB   ILE  14           HB       ILE  14  30.070  18.010  22.078
  391   HG12  ILE  14          HG12      ILE  14  31.040  16.658  24.060
  392   HG13  ILE  14          HG11      ILE  14  30.714  18.368  24.330
  393   HG21  ILE  14          HG21      ILE  14  27.755  18.501  22.080
  394   HG22  ILE  14          HG22      ILE  14  28.304  19.052  23.662
  395   HG23  ILE  14          HG23      ILE  14  27.449  17.514  23.510
  396   HD11  ILE  14          HD11      ILE  14  29.900  16.678  26.121
  397   HD12  ILE  14          HD12      ILE  14  28.624  16.282  24.972
  398   HD13  ILE  14          HD13      ILE  14  28.773  17.926  25.592
  399    H    LEU  15           HN       LEU  15  29.911  16.501  19.902
  400    HA   LEU  15           HA       LEU  15  27.440  17.193  18.753
  401    HB2  LEU  15           HB2      LEU  15  29.993  16.100  17.577
  402    HB3  LEU  15           HB1      LEU  15  28.595  16.486  16.571
  403    HG   LEU  15           HG       LEU  15  29.787  18.465  18.522
  404   HD11  LEU  15          HD11      LEU  15  31.023  19.430  16.681
  405   HD12  LEU  15          HD12      LEU  15  30.322  18.276  15.545
  406   HD13  LEU  15          HD13      LEU  15  31.450  17.723  16.782
  407   HD21  LEU  15          HD21      LEU  15  27.845  18.602  16.200
  408   HD22  LEU  15          HD22      LEU  15  28.621  20.041  16.863
  409   HD23  LEU  15          HD23      LEU  15  27.562  19.066  17.878
  410    H    SER  16           HN       SER  16  29.211  14.129  18.268
  411    HA   SER  16           HA       SER  16  27.253  12.668  17.045
  412    HB2  SER  16           HB2      SER  16  29.271  11.754  19.095
  413    HB3  SER  16           HB1      SER  16  28.279  10.648  18.147
  414    HG   SER  16           HG       SER  16  30.454  11.285  17.311
  415    H    ALA  17           HN       ALA  17  27.573  13.362  20.503
  416    HA   ALA  17           HA       ALA  17  25.596  11.608  21.460
  417    HB1  ALA  17           HB1      ALA  17  27.295  13.252  22.662
  418    HB2  ALA  17           HB2      ALA  17  25.804  12.745  23.456
  419    HB3  ALA  17           HB3      ALA  17  25.894  14.324  22.672
  420    H    LEU  18           HN       LEU  18  25.295  15.054  20.589
  421    HA   LEU  18           HA       LEU  18  22.449  15.099  20.888
  422    HB2  LEU  18           HB2      LEU  18  24.191  16.999  19.300
  423    HB3  LEU  18           HB1      LEU  18  22.567  17.315  19.911
  424    HG   LEU  18           HG       LEU  18  25.019  16.755  21.602
  425   HD11  LEU  18          HD11      LEU  18  24.744  19.104  22.308
  426   HD12  LEU  18          HD12      LEU  18  23.393  19.284  21.189
  427   HD13  LEU  18          HD13      LEU  18  25.019  18.996  20.569
  428   HD21  LEU  18          HD21      LEU  18  22.114  17.270  22.288
  429   HD22  LEU  18          HD22      LEU  18  23.417  17.477  23.458
  430   HD23  LEU  18          HD23      LEU  18  23.105  15.889  22.755
  431    H    HIS  19           HN       HIS  19  24.559  14.073  18.394
  432    HA   HIS  19           HA       HIS  19  22.834  14.462  16.179
  433    HB2  HIS  19           HB2      HIS  19  25.159  14.163  15.743
  434    HB3  HIS  19           HB1      HIS  19  25.200  12.651  16.647
  435    HD2  HIS  19           HD2      HIS  19  24.129  10.408  15.290
  436    HE1  HIS  19           HE1      HIS  19  23.524  12.380  11.606
  437    HE2  HIS  19           HE2      HIS  19  23.536  10.119  12.763
  438    H    PHE  20           HN       PHE  20  23.484  11.707  18.321
  439    HA   PHE  20           HA       PHE  20  21.565  10.029  16.963
  440    HB2  PHE  20           HB2      PHE  20  23.637   9.685  18.922
  441    HB3  PHE  20           HB1      PHE  20  22.135   8.980  19.522
  442    HD1  PHE  20           HD1      PHE  20  24.343   9.091  16.497
  443    HD2  PHE  20           HD2      PHE  20  21.386   6.911  18.718
  444    HE1  PHE  20           HE1      PHE  20  24.621   7.157  14.967
  445    HE2  PHE  20           HE2      PHE  20  21.661   4.977  17.192
  446    HZ   PHE  20           HZ       PHE  20  23.271   5.096  15.309
  447    H    MET  21           HN       MET  21  21.531  12.332  19.553
  448    HA   MET  21           HA       MET  21  19.190  11.355  20.875
  449    HB2  MET  21           HB2      MET  21  20.640  14.000  20.839
  450    HB3  MET  21           HB1      MET  21  19.145  13.767  21.748
  451    HG2  MET  21           HG2      MET  21  21.538  11.942  22.040
  452    HG3  MET  21           HG1      MET  21  21.283  13.352  23.066
  453    HE1  MET  21           HE1      MET  21  21.803  10.771  24.185
  454    HE2  MET  21           HE2      MET  21  20.512  10.225  25.252
  455    HE3  MET  21           HE3      MET  21  21.122  11.871  25.392
  456    H    ALA  22           HN       ALA  22  19.660  14.207  18.805
  457    HA   ALA  22           HA       ALA  22  16.889  14.706  18.459
  458    HB1  ALA  22           HB1      ALA  22  17.512  16.430  17.037
  459    HB2  ALA  22           HB2      ALA  22  18.891  15.540  16.391
  460    HB3  ALA  22           HB3      ALA  22  18.969  16.236  18.011
  461    H    TRP  23           HN       TRP  23  19.253  12.969  16.459
  462    HA   TRP  23           HA       TRP  23  17.544  12.475  14.277
  463    HB2  TRP  23           HB2      TRP  23  20.048  12.159  14.361
  464    HB3  TRP  23           HB1      TRP  23  19.755  10.637  15.201
  465    HD1  TRP  23           HD1      TRP  23  19.609  12.294  11.821
  466    HE1  TRP  23           HE1      TRP  23  18.965  10.552  10.032
  467    HE3  TRP  23           HE3      TRP  23  18.313   8.364  14.827
  468    HZ2  TRP  23           HZ2      TRP  23  18.027   7.859   9.890
  469    HZ3  TRP  23           HZ3      TRP  23  17.547   6.226  13.832
  470    HH2  TRP  23           HH2      TRP  23  17.402   5.969  11.371
  471    H    THR  24           HN       THR  24  18.033  10.747  17.318
  472    HA   THR  24           HA       THR  24  16.501   8.442  16.656
  473    HB   THR  24           HB       THR  24  17.350   9.700  19.254
  474    HG1  THR  24           HG1      THR  24  17.954   7.326  17.838
  475   HG21  THR  24          HG21      THR  24  16.463   7.518  20.269
  476   HG22  THR  24          HG22      THR  24  15.503   7.356  18.799
  477   HG23  THR  24          HG23      THR  24  15.267   8.747  19.858
  478    H    ILE  25           HN       ILE  25  15.690  11.509  18.261
  479    HA   ILE  25           HA       ILE  25  13.020  10.878  18.901
  480    HB   ILE  25           HB       ILE  25  14.358  13.523  18.309
  481   HG12  ILE  25          HG12      ILE  25  13.418  12.347  20.938
  482   HG13  ILE  25          HG11      ILE  25  15.053  12.106  20.320
  483   HG21  ILE  25          HG21      ILE  25  12.319  14.431  19.565
  484   HG22  ILE  25          HG22      ILE  25  11.561  12.867  19.265
  485   HG23  ILE  25          HG23      ILE  25  12.032  13.894  17.911
  486   HD11  ILE  25          HD11      ILE  25  15.484  14.480  20.328
  487   HD12  ILE  25          HD12      ILE  25  14.824  14.056  21.908
  488   HD13  ILE  25          HD13      ILE  25  13.798  14.836  20.706
  489    H    GLY  26           HN       GLY  26  14.445  12.358  16.012
  490    HA2  GLY  26           HA2      GLY  26  12.028  12.890  14.639
  491    HA3  GLY  26           HA1      GLY  26  13.610  12.696  13.887
  492    H    HIS  27           HN       HIS  27  14.161  10.060  14.688
  493    HA   HIS  27           HA       HIS  27  12.910   8.566  12.668
  494    HB2  HIS  27           HB2      HIS  27  15.042   7.845  13.450
  495    HB3  HIS  27           HB1      HIS  27  14.471   7.738  15.116
  496    HD2  HIS  27           HD2      HIS  27  13.529   5.234  15.793
  497    HE1  HIS  27           HE1      HIS  27  13.019   3.711  11.887
  498    HE2  HIS  27           HE2      HIS  27  12.889   3.146  14.360
  499    H    LEU  28           HN       LEU  28  12.282   8.747  16.155
  500    HA   LEU  28           HA       LEU  28  10.224   6.752  16.125
  501    HB2  LEU  28           HB2      LEU  28  10.934   8.899  18.138
  502    HB3  LEU  28           HB1      LEU  28   9.735   7.633  18.412
  503    HG   LEU  28           HG       LEU  28  12.598   7.041  17.633
  504   HD11  LEU  28          HD11      LEU  28  13.088   6.675  19.959
  505   HD12  LEU  28          HD12      LEU  28  11.403   6.927  20.414
  506   HD13  LEU  28          HD13      LEU  28  12.374   8.281  19.836
  507   HD21  LEU  28          HD21      LEU  28  11.930   4.821  18.711
  508   HD22  LEU  28          HD22      LEU  28  11.138   5.192  17.180
  509   HD23  LEU  28          HD23      LEU  28  10.271   5.420  18.700
  510    H    ASN  29           HN       ASN  29   8.027   6.989  16.019
  511    HA   ASN  29           HA       ASN  29   7.059   9.576  15.013
  512    HB2  ASN  29           HB2      ASN  29   6.656   7.363  13.786
  513    HB3  ASN  29           HB1      ASN  29   5.517   6.985  15.078
  514   HD21  ASN  29          HD21      ASN  29   3.644   7.136  13.657
  515   HD22  ASN  29          HD22      ASN  29   3.116   8.629  13.045
  516    H    GLN  30           HN       GLN  30   5.425  10.715  15.987
  517    HA   GLN  30           HA       GLN  30   4.700   9.834  18.709
  518    HB2  GLN  30           HB2      GLN  30   5.088  12.523  17.451
  519    HB3  GLN  30           HB1      GLN  30   3.990  12.367  18.821
  520    HG2  GLN  30           HG2      GLN  30   5.928  12.715  19.999
  521    HG3  GLN  30           HG1      GLN  30   6.071  10.971  19.795
  522   HE21  GLN  30          HE21      GLN  30   8.329  12.812  20.081
  523   HE22  GLN  30          HE22      GLN  30   9.228  12.716  18.644
  524    H    ILE  31           HN       ILE  31   2.668   9.300  19.144
  525    HA   ILE  31           HA       ILE  31   0.497  10.375  17.483
  526    HB   ILE  31           HB       ILE  31  -0.512   8.130  17.278
  527   HG12  ILE  31          HG12      ILE  31   2.146   7.099  18.315
  528   HG13  ILE  31          HG11      ILE  31   0.697   7.206  19.315
  529   HG21  ILE  31          HG21      ILE  31   1.091   7.263  15.600
  530   HG22  ILE  31          HG22      ILE  31   2.329   8.346  16.236
  531   HG23  ILE  31          HG23      ILE  31   0.891   9.009  15.459
  532   HD11  ILE  31          HD11      ILE  31   0.798   5.705  16.684
  533   HD12  ILE  31          HD12      ILE  31  -0.495   5.676  17.884
  534   HD13  ILE  31          HD13      ILE  31   1.066   4.942  18.252
  535    H    LYS  32           HN       LYS  32  -1.577  10.299  18.498
  536    HA   LYS  32           HA       LYS  32  -1.411   9.971  21.432
  537    HB2  LYS  32           HB2      LYS  32  -3.205  11.776  19.790
  538    HB3  LYS  32           HB1      LYS  32  -3.287  11.593  21.543
  539    HG2  LYS  32           HG2      LYS  32  -0.766  12.199  21.517
  540    HG3  LYS  32           HG1      LYS  32  -1.072  12.787  19.883
  541    HD2  LYS  32           HD2      LYS  32  -2.653  13.660  22.315
  542    HD3  LYS  32           HD1      LYS  32  -1.290  14.562  21.654
  543    HE2  LYS  32           HE2      LYS  32  -2.488  14.683  19.464
  544    HE3  LYS  32           HE1      LYS  32  -3.875  13.894  20.216
  545    HZ1  LYS  32           HZ1      LYS  32  -2.765  16.573  20.728
  546    HZ2  LYS  32           HZ2      LYS  32  -3.655  15.778  21.936
  547    HZ3  LYS  32           HZ3      LYS  32  -4.372  16.120  20.435
  548    H    ARG  33           HN       ARG  33  -2.499   8.315  22.240
  549    HA   ARG  33           HA       ARG  33  -4.463   6.918  20.597
  550    HB2  ARG  33           HB2      ARG  33  -2.848   6.296  23.008
  551    HB3  ARG  33           HB1      ARG  33  -4.422   5.508  22.888
  552    HG2  ARG  33           HG2      ARG  33  -2.626   5.538  20.486
  553    HG3  ARG  33           HG1      ARG  33  -2.304   4.387  21.784
  554    HD2  ARG  33           HD2      ARG  33  -4.775   3.748  21.632
  555    HD3  ARG  33           HD1      ARG  33  -4.818   4.661  20.128
  556    HE   ARG  33           HE       ARG  33  -2.662   2.851  20.007
  557   HH11  ARG  33          HH11      ARG  33  -6.148   2.871  20.108
  558   HH12  ARG  33          HH12      ARG  33  -6.298   1.392  19.222
  559   HH21  ARG  33          HH21      ARG  33  -2.890   0.919  18.854
  560   HH22  ARG  33          HH22      ARG  33  -4.468   0.292  18.516
  561    H1   MET   1           HT1      MET   1  47.210  -5.600  25.484
  562    H2   MET   1           HT2      MET   1  45.940  -6.701  25.238
  563    H3   MET   1           HT3      MET   1  46.101  -5.345  24.227
  564    HA   MET   1           HA       MET   1  48.404  -6.324  23.675
  565    HB2  MET   1           HB2      MET   1  46.908  -8.583  24.983
  566    HB3  MET   1           HB1      MET   1  48.078  -8.913  23.705
  567    HG2  MET   1           HG2      MET   1  49.827  -7.759  24.956
  568    HG3  MET   1           HG1      MET   1  48.669  -7.309  26.208
  569    HE1  MET   1           HE1      MET   1  50.592  -8.365  27.803
  570    HE2  MET   1           HE2      MET   1  51.493  -8.892  26.383
  571    HE3  MET   1           HE3      MET   1  51.146 -10.039  27.675
  572    H    PHE   2           HN       PHE   2  44.993  -7.096  23.465
  573    HA   PHE   2           HA       PHE   2  45.259  -7.679  20.594
  574    HB2  PHE   2           HB2      PHE   2  42.925  -8.001  22.490
  575    HB3  PHE   2           HB1      PHE   2  42.873  -8.368  20.765
  576    HD1  PHE   2           HD1      PHE   2  43.787  -9.569  24.036
  577    HD2  PHE   2           HD2      PHE   2  44.546 -10.069  19.838
  578    HE1  PHE   2           HE1      PHE   2  44.772 -11.801  24.479
  579    HE2  PHE   2           HE2      PHE   2  45.530 -12.300  20.281
  580    HZ   PHE   2           HZ       PHE   2  45.643 -13.167  22.602
  581    H    GLU   3           HN       GLU   3  45.009  -4.978  22.396
  582    HA   GLU   3           HA       GLU   3  42.786  -3.641  21.336
  583    HB2  GLU   3           HB2      GLU   3  45.378  -2.630  22.494
  584    HB3  GLU   3           HB1      GLU   3  44.040  -1.572  22.037
  585    HG2  GLU   3           HG2      GLU   3  43.427  -3.934  23.760
  586    HG3  GLU   3           HG1      GLU   3  44.232  -2.554  24.505
  587    HA   PRO   4           HA       PRO   4  44.549  -3.136  17.202
  588    HB2  PRO   4           HB2      PRO   4  42.507  -1.685  16.110
  589    HB3  PRO   4           HB1      PRO   4  42.435  -3.443  16.342
  590    HG2  PRO   4           HG2      PRO   4  41.235  -1.263  17.971
  591    HG3  PRO   4           HG1      PRO   4  40.572  -2.851  17.541
  592    HD2  PRO   4           HD2      PRO   4  41.675  -2.296  19.989
  593    HD3  PRO   4           HD1      PRO   4  41.654  -3.920  19.273
  594    H    PHE   5           HN       PHE   5  43.222  -0.455  19.081
  595    HA   PHE   5           HA       PHE   5  45.473   1.223  18.335
  596    HB2  PHE   5           HB2      PHE   5  42.648   1.813  17.472
  597    HB3  PHE   5           HB1      PHE   5  43.809   3.114  17.745
  598    HD1  PHE   5           HD1      PHE   5  42.639   0.637  15.433
  599    HD2  PHE   5           HD2      PHE   5  46.092   2.938  16.546
  600    HE1  PHE   5           HE1      PHE   5  43.639   0.217  13.202
  601    HE2  PHE   5           HE2      PHE   5  47.090   2.519  14.315
  602    HZ   PHE   5           HZ       PHE   5  45.864   1.160  12.644
  603    H    GLN   6           HN       GLN   6  42.252   2.142  19.479
  604    HA   GLN   6           HA       GLN   6  43.202   2.379  22.226
  605    HB2  GLN   6           HB2      GLN   6  42.171   4.759  20.658
  606    HB3  GLN   6           HB1      GLN   6  42.539   4.745  22.384
  607    HG2  GLN   6           HG2      GLN   6  44.891   4.086  21.815
  608    HG3  GLN   6           HG1      GLN   6  44.493   4.295  20.112
  609   HE21  GLN   6          HE21      GLN   6  46.397   5.876  21.878
  610   HE22  GLN   6          HE22      GLN   6  45.883   7.487  21.724
  611    H    ILE   7           HN       ILE   7  41.403   3.086  23.677
  612    HA   ILE   7           HA       ILE   7  39.138   1.462  23.358
  613    HB   ILE   7           HB       ILE   7  39.634   3.854  25.133
  614   HG12  ILE   7          HG12      ILE   7  39.459   0.907  25.813
  615   HG13  ILE   7          HG11      ILE   7  40.979   1.695  25.392
  616   HG21  ILE   7          HG21      ILE   7  37.662   2.876  26.431
  617   HG22  ILE   7          HG22      ILE   7  37.287   1.947  24.980
  618   HG23  ILE   7          HG23      ILE   7  37.255   3.710  24.932
  619   HD11  ILE   7          HD11      ILE   7  40.884   3.130  27.285
  620   HD12  ILE   7          HD12      ILE   7  40.411   1.545  27.896
  621   HD13  ILE   7          HD13      ILE   7  39.182   2.768  27.575
  622    H    LEU   8           HN       LEU   8  39.667   4.867  22.646
  623    HA   LEU   8           HA       LEU   8  36.948   5.479  22.000
  624    HB2  LEU   8           HB2      LEU   8  38.958   7.067  22.555
  625    HB3  LEU   8           HB1      LEU   8  39.260   6.978  20.820
  626    HG   LEU   8           HG       LEU   8  36.443   7.465  21.615
  627   HD11  LEU   8          HD11      LEU   8  38.566   9.615  21.874
  628   HD12  LEU   8          HD12      LEU   8  37.713   8.871  23.226
  629   HD13  LEU   8          HD13      LEU   8  36.826   9.842  22.051
  630   HD21  LEU   8          HD21      LEU   8  36.718   9.126  19.715
  631   HD22  LEU   8          HD22      LEU   8  37.013   7.444  19.276
  632   HD23  LEU   8          HD23      LEU   8  38.372   8.538  19.539
  633    H    SER   9           HN       SER   9  39.708   4.325  20.184
  634    HA   SER   9           HA       SER   9  38.604   4.673  17.567
  635    HB2  SER   9           HB2      SER   9  41.023   4.378  17.948
  636    HB3  SER   9           HB1      SER   9  40.725   2.735  18.505
  637    HG   SER   9           HG       SER   9  41.315   2.973  16.234
  638    H    ILE  10           HN       ILE  10  38.735   1.917  19.819
  639    HA   ILE  10           HA       ILE  10  37.406   0.105  18.065
  640    HB   ILE  10           HB       ILE  10  37.141  -1.306  20.076
  641   HG12  ILE  10          HG12      ILE  10  38.375   1.042  21.530
  642   HG13  ILE  10          HG11      ILE  10  36.672   0.609  21.635
  643   HG21  ILE  10          HG21      ILE  10  39.278  -1.314  18.877
  644   HG22  ILE  10          HG22      ILE  10  39.567  -1.482  20.607
  645   HG23  ILE  10          HG23      ILE  10  39.834   0.072  19.813
  646   HD11  ILE  10          HD11      ILE  10  37.683  -0.399  23.532
  647   HD12  ILE  10          HD12      ILE  10  39.056  -0.981  22.590
  648   HD13  ILE  10          HD13      ILE  10  37.465  -1.711  22.376
  649    H    CYS  11           HN       CYS  11  36.334   2.499  20.409
  650    HA   CYS  11           HA       CYS  11  33.670   1.599  20.704
  651    HB2  CYS  11           HB2      CYS  11  34.699   3.286  22.179
  652    HB3  CYS  11           HB1      CYS  11  34.768   4.417  20.827
  653    HG   CYS  11           HG       CYS  11  32.545   4.920  22.078
  654    H    SER  12           HN       SER  12  35.081   4.099  18.554
  655    HA   SER  12           HA       SER  12  32.720   4.668  17.148
  656    HB2  SER  12           HB2      SER  12  34.711   6.095  17.023
  657    HB3  SER  12           HB1      SER  12  35.582   4.815  16.181
  658    HG   SER  12           HG       SER  12  34.648   6.360  14.749
  659    H    PHE  13           HN       PHE  13  35.164   2.182  16.694
  660    HA   PHE  13           HA       PHE  13  34.402   1.266  14.139
  661    HB2  PHE  13           HB2      PHE  13  36.449   0.468  15.041
  662    HB3  PHE  13           HB1      PHE  13  35.659  -0.125  16.501
  663    HD1  PHE  13           HD1      PHE  13  35.620  -0.570  12.776
  664    HD2  PHE  13           HD2      PHE  13  34.973  -2.355  16.630
  665    HE1  PHE  13           HE1      PHE  13  35.248  -2.771  11.696
  666    HE2  PHE  13           HE2      PHE  13  34.601  -4.555  15.549
  667    HZ   PHE  13           HZ       PHE  13  34.738  -4.764  13.082
  668    H    ILE  14           HN       ILE  14  33.373   0.116  17.370
  669    HA   ILE  14           HA       ILE  14  31.512  -1.784  16.386
  670    HB   ILE  14           HB       ILE  14  31.696  -0.385  19.063
  671   HG12  ILE  14          HG12      ILE  14  33.597  -1.917  18.202
  672   HG13  ILE  14          HG11      ILE  14  32.923  -2.278  19.790
  673   HG21  ILE  14          HG21      ILE  14  29.470  -1.182  18.938
  674   HG22  ILE  14          HG22      ILE  14  30.336  -2.478  19.762
  675   HG23  ILE  14          HG23      ILE  14  29.938  -2.632  18.049
  676   HD11  ILE  14          HD11      ILE  14  33.243  -4.245  18.128
  677   HD12  ILE  14          HD12      ILE  14  31.818  -3.604  17.309
  678   HD13  ILE  14          HD13      ILE  14  31.707  -4.131  18.987
  679    H    LEU  15           HN       LEU  15  31.246   1.605  17.361
  680    HA   LEU  15           HA       LEU  15  28.447   1.828  17.280
  681    HB2  LEU  15           HB2      LEU  15  30.661   3.812  16.771
  682    HB3  LEU  15           HB1      LEU  15  28.960   4.273  16.689
  683    HG   LEU  15           HG       LEU  15  30.140   2.855  19.085
  684   HD11  LEU  15          HD11      LEU  15  30.382   5.011  20.153
  685   HD12  LEU  15          HD12      LEU  15  29.691   5.834  18.755
  686   HD13  LEU  15          HD13      LEU  15  31.272   5.059  18.632
  687   HD21  LEU  15          HD21      LEU  15  27.581   4.368  18.497
  688   HD22  LEU  15          HD22      LEU  15  28.109   4.014  20.142
  689   HD23  LEU  15          HD23      LEU  15  27.753   2.694  19.030
  690    H    SER  16           HN       SER  16  30.729   2.889  14.743
  691    HA   SER  16           HA       SER  16  28.957   3.359  12.717
  692    HB2  SER  16           HB2      SER  16  31.709   2.128  12.554
  693    HB3  SER  16           HB1      SER  16  30.804   2.674  11.144
  694    HG   SER  16           HG       SER  16  32.317   4.208  12.239
  695    H    ALA  17           HN       ALA  17  30.192   0.225  13.803
  696    HA   ALA  17           HA       ALA  17  29.212  -1.357  11.695
  697    HB1  ALA  17           HB1      ALA  17  30.689  -1.899  13.830
  698    HB2  ALA  17           HB2      ALA  17  29.743  -3.158  13.035
  699    HB3  ALA  17           HB3      ALA  17  29.132  -2.387  14.500
  700    H    LEU  18           HN       LEU  18  27.698  -0.636  14.850
  701    HA   LEU  18           HA       LEU  18  25.219  -1.895  14.187
  702    HB2  LEU  18           HB2      LEU  18  25.745   0.200  16.308
  703    HB3  LEU  18           HB1      LEU  18  24.394  -0.933  16.253
  704    HG   LEU  18           HG       LEU  18  27.320  -1.676  16.510
  705   HD11  LEU  18          HD11      LEU  18  26.660  -2.429  18.766
  706   HD12  LEU  18          HD12      LEU  18  25.021  -1.843  18.483
  707   HD13  LEU  18          HD13      LEU  18  26.365  -0.701  18.565
  708   HD21  LEU  18          HD21      LEU  18  24.783  -3.319  16.325
  709   HD22  LEU  18          HD22      LEU  18  26.290  -3.969  16.972
  710   HD23  LEU  18          HD23      LEU  18  26.211  -3.420  15.297
  711    H    HIS  19           HN       HIS  19  26.583   1.174  13.511
  712    HA   HIS  19           HA       HIS  19  24.188   2.659  13.222
  713    HB2  HIS  19           HB2      HIS  19  26.228   3.867  13.489
  714    HB3  HIS  19           HB1      HIS  19  26.977   3.028  12.134
  715    HD2  HIS  19           HD2      HIS  19  26.179   3.929   9.571
  716    HE1  HIS  19           HE1      HIS  19  23.873   7.184  10.956
  717    HE2  HIS  19           HE2      HIS  19  24.887   6.098   8.897
  718    H    PHE  20           HN       PHE  20  26.238   0.866  10.945
  719    HA   PHE  20           HA       PHE  20  24.517   1.476   8.708
  720    HB2  PHE  20           HB2      PHE  20  27.126   0.346   9.104
  721    HB3  PHE  20           HB1      PHE  20  26.161  -0.734   8.097
  722    HD1  PHE  20           HD1      PHE  20  27.134   2.864   8.481
  723    HD2  PHE  20           HD2      PHE  20  25.792  -0.246   5.836
  724    HE1  PHE  20           HE1      PHE  20  27.421   4.384   6.541
  725    HE2  PHE  20           HE2      PHE  20  26.081   1.275   3.901
  726    HZ   PHE  20           HZ       PHE  20  26.902   3.579   4.256
  727    H    MET  21           HN       MET  21  24.706  -0.960  11.166
  728    HA   MET  21           HA       MET  21  23.302  -3.011   9.751
  729    HB2  MET  21           HB2      MET  21  23.874  -2.470  12.662
  730    HB3  MET  21           HB1      MET  21  22.888  -3.839  12.142
  731    HG2  MET  21           HG2      MET  21  25.647  -3.294  11.031
  732    HG3  MET  21           HG1      MET  21  25.366  -4.344  12.419
  733    HE1  MET  21           HE1      MET  21  26.916  -5.222  10.179
  734    HE2  MET  21           HE2      MET  21  26.249  -6.668   9.423
  735    HE3  MET  21           HE3      MET  21  26.394  -6.586  11.176
  736    H    ALA  22           HN       ALA  22  22.253  -0.893  12.414
  737    HA   ALA  22           HA       ALA  22  19.505  -1.525  12.149
  738    HB1  ALA  22           HB1      ALA  22  19.127   0.030  13.831
  739    HB2  ALA  22           HB2      ALA  22  20.404   1.107  13.263
  740    HB3  ALA  22           HB3      ALA  22  20.819  -0.384  14.108
  741    H    TRP  23           HN       TRP  23  21.458   1.161  10.892
  742    HA   TRP  23           HA       TRP  23  19.330   2.620   9.767
  743    HB2  TRP  23           HB2      TRP  23  21.705   3.403  10.116
  744    HB3  TRP  23           HB1      TRP  23  22.135   2.510   8.656
  745    HD1  TRP  23           HD1      TRP  23  20.432   5.637   9.887
  746    HE1  TRP  23           HE1      TRP  23  19.739   7.090   7.874
  747    HE3  TRP  23           HE3      TRP  23  21.334   2.360   6.065
  748    HZ2  TRP  23           HZ2      TRP  23  19.584   6.896   5.029
  749    HZ3  TRP  23           HZ3      TRP  23  20.900   3.025   3.716
  750    HH2  TRP  23           HH2      TRP  23  20.026   5.286   3.195
  751    H    THR  24           HN       THR  24  21.249  -0.070   8.523
  752    HA   THR  24           HA       THR  24  20.279   0.019   5.848
  753    HB   THR  24           HB       THR  24  21.560  -2.126   7.527
  754    HG1  THR  24           HG1      THR  24  22.289  -0.592   5.264
  755   HG21  THR  24          HG21      THR  24  21.691  -3.388   5.299
  756   HG22  THR  24          HG22      THR  24  20.384  -2.337   4.753
  757   HG23  THR  24          HG23      THR  24  20.138  -3.410   6.132
  758    H    ILE  25           HN       ILE  25  19.232  -1.759   8.748
  759    HA   ILE  25           HA       ILE  25  17.208  -3.282   7.512
  760    HB   ILE  25           HB       ILE  25  17.495  -2.261  10.342
  761   HG12  ILE  25          HG12      ILE  25  17.837  -5.054   9.223
  762   HG13  ILE  25          HG11      ILE  25  19.175  -3.912   9.352
  763   HG21  ILE  25          HG21      ILE  25  15.820  -4.141  10.812
  764   HG22  ILE  25          HG22      ILE  25  15.464  -4.120   9.084
  765   HG23  ILE  25          HG23      ILE  25  15.161  -2.686  10.064
  766   HD11  ILE  25          HD11      ILE  25  18.916  -3.768  11.747
  767   HD12  ILE  25          HD12      ILE  25  18.959  -5.478  11.320
  768   HD13  ILE  25          HD13      ILE  25  17.421  -4.701  11.692
  769    H    GLY  26           HN       GLY  26  17.132  -0.073   9.028
  770    HA2  GLY  26           HA2      GLY  26  14.353   0.383   8.780
  771    HA3  GLY  26           HA1      GLY  26  15.585   1.633   8.928
  772    H    HIS  27           HN       HIS  27  17.073   1.066   6.615
  773    HA   HIS  27           HA       HIS  27  15.687   2.529   4.660
  774    HB2  HIS  27           HB2      HIS  27  18.068   2.527   4.591
  775    HB3  HIS  27           HB1      HIS  27  18.132   0.767   4.501
  776    HD2  HIS  27           HD2      HIS  27  18.191  -0.199   1.917
  777    HE1  HIS  27           HE1      HIS  27  16.861   3.291  -0.055
  778    HE2  HIS  27           HE2      HIS  27  17.714   0.923  -0.393
  779    H    LEU  28           HN       LEU  28  16.220  -0.960   5.010
  780    HA   LEU  28           HA       LEU  28  14.900  -1.643   2.559
  781    HB2  LEU  28           HB2      LEU  28  15.615  -3.285   4.998
  782    HB3  LEU  28           HB1      LEU  28  14.972  -3.957   3.499
  783    HG   LEU  28           HG       LEU  28  17.464  -2.244   3.592
  784   HD11  LEU  28          HD11      LEU  28  18.775  -4.259   3.590
  785   HD12  LEU  28          HD12      LEU  28  17.334  -5.267   3.444
  786   HD13  LEU  28          HD13      LEU  28  17.647  -4.386   4.940
  787   HD21  LEU  28          HD21      LEU  28  17.826  -3.490   1.389
  788   HD22  LEU  28          HD22      LEU  28  16.504  -2.324   1.395
  789   HD23  LEU  28          HD23      LEU  28  16.159  -4.048   1.536
  790    H    ASN  29           HN       ASN  29  12.817  -2.301   2.210
  791    HA   ASN  29           HA       ASN  29  10.900  -1.682   4.352
  792    HB2  ASN  29           HB2      ASN  29  10.739  -0.673   2.002
  793    HB3  ASN  29           HB1      ASN  29  10.241  -2.279   1.471
  794   HD21  ASN  29          HD21      ASN  29   8.039  -1.590   0.998
  795   HD22  ASN  29          HD22      ASN  29   6.950  -1.193   2.239
  796    H    GLN  30           HN       GLN  30   9.433  -3.158   5.121
  797    HA   GLN  30           HA       GLN  30   9.919  -5.965   4.350
  798    HB2  GLN  30           HB2      GLN  30   9.115  -4.644   6.914
  799    HB3  GLN  30           HB1      GLN  30   8.619  -6.309   6.613
  800    HG2  GLN  30           HG2      GLN  30  10.662  -6.748   7.558
  801    HG3  GLN  30           HG1      GLN  30  11.203  -6.511   5.899
  802   HE21  GLN  30          HE21      GLN  30  12.830  -5.999   8.280
  803   HE22  GLN  30          HE22      GLN  30  13.194  -4.341   8.279
  804    H    ILE  31           HN       ILE  31   8.374  -7.072   3.352
  805    HA   ILE  31           HA       ILE  31   5.569  -6.258   3.669
  806    HB   ILE  31           HB       ILE  31   5.208  -6.416   1.230
  807   HG12  ILE  31          HG12      ILE  31   8.234  -6.479   1.024
  808   HG13  ILE  31          HG11      ILE  31   7.225  -7.915   0.850
  809   HG21  ILE  31          HG21      ILE  31   6.340  -4.291   0.647
  810   HG22  ILE  31          HG22      ILE  31   7.370  -4.460   2.069
  811   HG23  ILE  31          HG23      ILE  31   5.633  -4.224   2.262
  812   HD11  ILE  31          HD11      ILE  31   6.861  -5.414  -0.821
  813   HD12  ILE  31          HD12      ILE  31   6.098  -6.985  -1.066
  814   HD13  ILE  31          HD13      ILE  31   7.830  -6.795  -1.334
  815    H    LYS  32           HN       LYS  32   4.053  -7.924   3.162
  816    HA   LYS  32           HA       LYS  32   5.262 -10.623   3.170
  817    HB2  LYS  32           HB2      LYS  32   2.605  -9.695   4.286
  818    HB3  LYS  32           HB1      LYS  32   3.158 -11.369   4.258
  819    HG2  LYS  32           HG2      LYS  32   5.260 -10.477   5.486
  820    HG3  LYS  32           HG1      LYS  32   4.282  -9.046   5.817
  821    HD2  LYS  32           HD2      LYS  32   3.417 -11.872   6.483
  822    HD3  LYS  32           HD1      LYS  32   4.183 -10.781   7.637
  823    HE2  LYS  32           HE2      LYS  32   2.345  -9.136   7.235
  824    HE3  LYS  32           HE1      LYS  32   1.558 -10.320   6.192
  825    HZ1  LYS  32           HZ1      LYS  32   1.993 -10.413   9.102
  826    HZ2  LYS  32           HZ2      LYS  32   1.808 -11.857   8.226
  827    HZ3  LYS  32           HZ3      LYS  32   0.569 -10.693   8.225
  828    H    ARG  33           HN       ARG  33   5.002 -11.759   1.376
  829    HA   ARG  33           HA       ARG  33   3.069 -10.893  -0.631
  830    HB2  ARG  33           HB2      ARG  33   5.495 -12.603  -0.582
  831    HB3  ARG  33           HB1      ARG  33   4.250 -13.034  -1.755
  832    HG2  ARG  33           HG2      ARG  33   5.070 -10.160  -1.496
  833    HG3  ARG  33           HG1      ARG  33   6.105 -11.271  -2.394
  834    HD2  ARG  33           HD2      ARG  33   4.000 -11.980  -3.660
  835    HD3  ARG  33           HD1      ARG  33   3.214 -10.580  -2.938
  836    HE   ARG  33           HE       ARG  33   5.618  -9.729  -4.135
  837   HH11  ARG  33          HH11      ARG  33   2.498 -11.022  -5.002
  838   HH12  ARG  33          HH12      ARG  33   2.475 -10.244  -6.548
  839   HH21  ARG  33          HH21      ARG  33   5.563  -8.729  -6.163
  840   HH22  ARG  33          HH22      ARG  33   4.197  -8.956  -7.204
  841    H1   MET   1           HT1      MET   1  55.024   2.180   1.423
  842    H2   MET   1           HT2      MET   1  54.113   1.988   0.002
  843    H3   MET   1           HT3      MET   1  53.536   2.977   1.257
  844    HA   MET   1           HA       MET   1  55.704   4.296   0.893
  845    HB2  MET   1           HB2      MET   1  55.434   2.578  -1.562
  846    HB3  MET   1           HB1      MET   1  56.156   4.184  -1.674
  847    HG2  MET   1           HG2      MET   1  57.816   3.597   0.014
  848    HG3  MET   1           HG1      MET   1  57.064   2.018   0.241
  849    HE1  MET   1           HE1      MET   1  59.621   1.194  -0.109
  850    HE2  MET   1           HE2      MET   1  60.112   2.842  -0.497
  851    HE3  MET   1           HE3      MET   1  60.554   1.521  -1.577
  852    H    PHE   2           HN       PHE   2  52.786   3.333  -0.789
  853    HA   PHE   2           HA       PHE   2  52.237   6.126  -1.527
  854    HB2  PHE   2           HB2      PHE   2  50.859   3.548  -2.302
  855    HB3  PHE   2           HB1      PHE   2  50.345   5.154  -2.819
  856    HD1  PHE   2           HD1      PHE   2  52.594   2.410  -3.436
  857    HD2  PHE   2           HD2      PHE   2  52.024   6.619  -4.076
  858    HE1  PHE   2           HE1      PHE   2  54.261   2.357  -5.271
  859    HE2  PHE   2           HE2      PHE   2  53.690   6.566  -5.912
  860    HZ   PHE   2           HZ       PHE   2  54.810   4.436  -6.509
  861    H    GLU   3           HN       GLU   3  51.843   4.317   1.152
  862    HA   GLU   3           HA       GLU   3  49.111   4.533   1.739
  863    HB2  GLU   3           HB2      GLU   3  51.540   4.323   3.511
  864    HB3  GLU   3           HB1      GLU   3  49.884   4.282   4.124
  865    HG2  GLU   3           HG2      GLU   3  50.577   2.481   1.843
  866    HG3  GLU   3           HG1      GLU   3  51.156   2.041   3.450
  867    HA   PRO   4           HA       PRO   4  49.179   9.016   2.341
  868    HB2  PRO   4           HB2      PRO   4  46.568   9.324   3.083
  869    HB3  PRO   4           HB1      PRO   4  47.079   9.101   1.399
  870    HG2  PRO   4           HG2      PRO   4  45.922   7.134   3.306
  871    HG3  PRO   4           HG1      PRO   4  45.634   7.329   1.568
  872    HD2  PRO   4           HD2      PRO   4  47.281   5.402   2.612
  873    HD3  PRO   4           HD1      PRO   4  47.486   6.086   0.986
  874    H    PHE   5           HN       PHE   5  47.848   6.764   4.717
  875    HA   PHE   5           HA       PHE   5  49.147   8.218   6.869
  876    HB2  PHE   5           HB2      PHE   5  46.153   8.052   6.595
  877    HB3  PHE   5           HB1      PHE   5  46.918   8.181   8.180
  878    HD1  PHE   5           HD1      PHE   5  45.803   9.977   5.287
  879    HD2  PHE   5           HD2      PHE   5  48.623  10.093   8.524
  880    HE1  PHE   5           HE1      PHE   5  46.080  12.420   4.959
  881    HE2  PHE   5           HE2      PHE   5  48.900  12.535   8.197
  882    HZ   PHE   5           HZ       PHE   5  47.628  13.699   6.415
  883    H    GLN   6           HN       GLN   6  46.370   6.026   6.975
  884    HA   GLN   6           HA       GLN   6  48.069   3.770   7.699
  885    HB2  GLN   6           HB2      GLN   6  45.946   4.861   9.566
  886    HB3  GLN   6           HB1      GLN   6  46.854   3.367   9.803
  887    HG2  GLN   6           HG2      GLN   6  48.968   4.716   9.759
  888    HG3  GLN   6           HG1      GLN   6  47.984   6.177   9.703
  889   HE21  GLN   6          HE21      GLN   6  49.834   5.153  11.890
  890   HE22  GLN   6          HE22      GLN   6  48.862   5.103  13.280
  891    H    ILE   7           HN       ILE   7  46.737   1.786   8.014
  892    HA   ILE   7           HA       ILE   7  45.052   1.322   5.820
  893    HB   ILE   7           HB       ILE   7  45.408  -0.200   8.402
  894   HG12  ILE   7          HG12      ILE   7  46.312  -0.865   5.589
  895   HG13  ILE   7          HG11      ILE   7  47.317   0.043   6.718
  896   HG21  ILE   7          HG21      ILE   7  44.344  -2.086   7.043
  897   HG22  ILE   7          HG22      ILE   7  43.788  -0.840   5.926
  898   HG23  ILE   7          HG23      ILE   7  43.242  -0.828   7.603
  899   HD11  ILE   7          HD11      ILE   7  47.452  -1.784   8.233
  900   HD12  ILE   7          HD12      ILE   7  47.680  -2.502   6.640
  901   HD13  ILE   7          HD13      ILE   7  46.121  -2.637   7.451
  902    H    LEU   8           HN       LEU   8  44.326   2.137   9.163
  903    HA   LEU   8           HA       LEU   8  41.489   1.801   8.960
  904    HB2  LEU   8           HB2      LEU   8  43.030   1.951  11.076
  905    HB3  LEU   8           HB1      LEU   8  42.751   3.685  10.922
  906    HG   LEU   8           HG       LEU   8  40.342   1.966  10.692
  907   HD11  LEU   8          HD11      LEU   8  41.726   2.428  13.352
  908   HD12  LEU   8          HD12      LEU   8  41.620   0.873  12.526
  909   HD13  LEU   8          HD13      LEU   8  40.156   1.660  13.113
  910   HD21  LEU   8          HD21      LEU   8  39.486   3.825  12.194
  911   HD22  LEU   8          HD22      LEU   8  40.083   4.358  10.623
  912   HD23  LEU   8          HD23      LEU   8  41.081   4.565  12.063
  913    H    SER   9           HN       SER   9  43.696   4.469   8.444
  914    HA   SER   9           HA       SER   9  41.736   6.541   8.248
  915    HB2  SER   9           HB2      SER   9  44.121   7.018   8.654
  916    HB3  SER   9           HB1      SER   9  44.505   6.411   7.047
  917    HG   SER   9           HG       SER   9  44.214   8.744   7.237
  918    H    ILE  10           HN       ILE  10  43.389   4.508   5.836
  919    HA   ILE  10           HA       ILE  10  42.121   5.716   3.588
  920    HB   ILE  10           HB       ILE  10  42.953   3.752   2.340
  921   HG12  ILE  10          HG12      ILE  10  43.878   2.783   5.052
  922   HG13  ILE  10          HG11      ILE  10  42.504   2.105   4.185
  923   HG21  ILE  10          HG21      ILE  10  44.478   5.612   2.806
  924   HG22  ILE  10          HG22      ILE  10  45.361   4.088   2.876
  925   HG23  ILE  10          HG23      ILE  10  44.895   4.907   4.367
  926   HD11  ILE  10          HD11      ILE  10  44.331   0.682   3.657
  927   HD12  ILE  10          HD12      ILE  10  45.417   2.045   3.389
  928   HD13  ILE  10          HD13      ILE  10  44.122   1.709   2.240
  929    H    CYS  11           HN       CYS  11  41.261   3.119   5.791
  930    HA   CYS  11           HA       CYS  11  39.214   1.936   4.239
  931    HB2  CYS  11           HB2      CYS  11  40.149   0.885   6.263
  932    HB3  CYS  11           HB1      CYS  11  39.441   2.164   7.249
  933    HG   CYS  11           HG       CYS  11  37.714   0.222   7.237
  934    H    SER  12           HN       SER  12  39.062   4.416   6.826
  935    HA   SER  12           HA       SER  12  36.307   4.916   6.614
  936    HB2  SER  12           HB2      SER  12  37.650   5.700   8.510
  937    HB3  SER  12           HB1      SER  12  38.516   6.807   7.446
  938    HG   SER  12           HG       SER  12  36.762   7.812   8.548
  939    H    PHE  13           HN       PHE  13  39.062   6.216   4.855
  940    HA   PHE  13           HA       PHE  13  37.786   8.360   3.547
  941    HB2  PHE  13           HB2      PHE  13  40.153   8.224   3.414
  942    HB3  PHE  13           HB1      PHE  13  40.095   6.587   2.759
  943    HD1  PHE  13           HD1      PHE  13  38.949  10.078   1.996
  944    HD2  PHE  13           HD2      PHE  13  40.157   6.258   0.447
  945    HE1  PHE  13           HE1      PHE  13  38.884  10.990  -0.310
  946    HE2  PHE  13           HE2      PHE  13  40.090   7.170  -1.858
  947    HZ   PHE  13           HZ       PHE  13  39.453   9.536  -2.237
  948    H    ILE  14           HN       ILE  14  38.267   4.989   2.445
  949    HA   ILE  14           HA       ILE  14  36.800   5.296   0.039
  950    HB   ILE  14           HB       ILE  14  37.457   2.824   1.660
  951   HG12  ILE  14          HG12      ILE  14  39.317   4.305   0.631
  952   HG13  ILE  14          HG11      ILE  14  39.342   2.587   0.241
  953   HG21  ILE  14          HG21      ILE  14  35.641   2.189   0.282
  954   HG22  ILE  14          HG22      ILE  14  37.061   1.727  -0.653
  955   HG23  ILE  14          HG23      ILE  14  36.180   3.202  -1.057
  956   HD11  ILE  14          HD11      ILE  14  39.634   4.280  -1.703
  957   HD12  ILE  14          HD12      ILE  14  37.900   4.553  -1.545
  958   HD13  ILE  14          HD13      ILE  14  38.507   2.945  -1.935
  959    H    LEU  15           HN       LEU  15  35.923   4.260   3.305
  960    HA   LEU  15           HA       LEU  15  33.312   3.355   2.737
  961    HB2  LEU  15           HB2      LEU  15  34.563   4.568   5.201
  962    HB3  LEU  15           HB1      LEU  15  32.876   4.053   5.175
  963    HG   LEU  15           HG       LEU  15  35.140   2.232   4.345
  964   HD11  LEU  15          HD11      LEU  15  35.102   1.287   6.572
  965   HD12  LEU  15          HD12      LEU  15  33.782   2.355   7.050
  966   HD13  LEU  15          HD13      LEU  15  35.382   3.022   6.723
  967   HD21  LEU  15          HD21      LEU  15  32.215   1.883   5.054
  968   HD22  LEU  15          HD22      LEU  15  33.338   0.525   5.000
  969   HD23  LEU  15          HD23      LEU  15  33.020   1.462   3.542
  970    H    SER  16           HN       SER  16  34.238   6.511   4.138
  971    HA   SER  16           HA       SER  16  31.829   7.796   3.950
  972    HB2  SER  16           HB2      SER  16  34.597   8.916   3.503
  973    HB3  SER  16           HB1      SER  16  33.157   9.919   3.657
  974    HG   SER  16           HG       SER  16  34.442   9.396   5.635
  975    H    ALA  17           HN       ALA  17  34.190   7.248   1.374
  976    HA   ALA  17           HA       ALA  17  33.051   8.902  -0.591
  977    HB1  ALA  17           HB1      ALA  17  35.243   7.411  -0.523
  978    HB2  ALA  17           HB2      ALA  17  34.488   7.847  -2.056
  979    HB3  ALA  17           HB3      ALA  17  34.205   6.253  -1.354
  980    H    LEU  18           HN       LEU  18  32.538   5.416  -0.033
  981    HA   LEU  18           HA       LEU  18  30.441   5.196  -1.967
  982    HB2  LEU  18           HB2      LEU  18  31.022   3.363   0.370
  983    HB3  LEU  18           HB1      LEU  18  30.111   2.964  -1.086
  984    HG   LEU  18           HG       LEU  18  33.039   3.735  -0.984
  985   HD11  LEU  18          HD11      LEU  18  33.407   1.399  -1.687
  986   HD12  LEU  18          HD12      LEU  18  31.673   1.095  -1.593
  987   HD13  LEU  18          HD13      LEU  18  32.583   1.466  -0.129
  988   HD21  LEU  18          HD21      LEU  18  31.162   3.056  -3.262
  989   HD22  LEU  18          HD22      LEU  18  32.918   2.974  -3.420
  990   HD23  LEU  18          HD23      LEU  18  32.135   4.513  -3.062
  991    H    HIS  19           HN       HIS  19  30.571   6.273   1.280
  992    HA   HIS  19           HA       HIS  19  27.901   5.700   2.032
  993    HB2  HIS  19           HB2      HIS  19  29.478   6.131   3.768
  994    HB3  HIS  19           HB1      HIS  19  29.942   7.672   3.050
  995    HD2  HIS  19           HD2      HIS  19  28.115   9.795   3.474
  996    HE1  HIS  19           HE1      HIS  19  25.577   7.665   6.089
  997    HE2  HIS  19           HE2      HIS  19  26.112   9.959   5.143
  998    H    PHE  20           HN       PHE  20  29.499   8.559   0.668
  999    HA   PHE  20           HA       PHE  20  27.034  10.065   0.595
 1000    HB2  PHE  20           HB2      PHE  20  29.835  10.604   0.253
 1001    HB3  PHE  20           HB1      PHE  20  28.939  11.232  -1.131
 1002    HD1  PHE  20           HD1      PHE  20  28.913  11.157   2.614
 1003    HD2  PHE  20           HD2      PHE  20  27.713  13.220  -0.956
 1004    HE1  PHE  20           HE1      PHE  20  28.085  13.050   3.986
 1005    HE2  PHE  20           HE2      PHE  20  26.885  15.113   0.414
 1006    HZ   PHE  20           HZ       PHE  20  27.063  15.024   2.885
 1007    H    MET  21           HN       MET  21  28.715   7.855  -1.478
 1008    HA   MET  21           HA       MET  21  27.560   8.722  -3.945
 1009    HB2  MET  21           HB2      MET  21  28.887   6.177  -3.021
 1010    HB3  MET  21           HB1      MET  21  28.218   6.342  -4.645
 1011    HG2  MET  21           HG2      MET  21  30.174   8.326  -3.470
 1012    HG3  MET  21           HG1      MET  21  30.683   6.939  -4.431
 1013    HE1  MET  21           HE1      MET  21  31.582   9.584  -5.048
 1014    HE2  MET  21           HE2      MET  21  31.144  10.081  -6.680
 1015    HE3  MET  21           HE3      MET  21  31.834   8.483  -6.410
 1016    H    ALA  22           HN       ALA  22  26.908   5.838  -1.970
 1017    HA   ALA  22           HA       ALA  22  24.520   5.150  -3.340
 1018    HB1  ALA  22           HB1      ALA  22  24.295   3.421  -1.810
 1019    HB2  ALA  22           HB2      ALA  22  24.949   4.375  -0.479
 1020    HB3  ALA  22           HB3      ALA  22  26.026   3.743  -1.724
 1021    H    TRP  23           HN       TRP  23  25.095   6.968  -0.345
 1022    HA   TRP  23           HA       TRP  23  22.392   7.277   0.380
 1023    HB2  TRP  23           HB2      TRP  23  24.420   7.759   1.804
 1024    HB3  TRP  23           HB1      TRP  23  24.576   9.286   0.935
 1025    HD1  TRP  23           HD1      TRP  23  22.563   7.510   3.578
 1026    HE1  TRP  23           HE1      TRP  23  20.859   9.144   4.610
 1027    HE3  TRP  23           HE3      TRP  23  23.037  11.447   0.351
 1028    HZ2  TRP  23           HZ2      TRP  23  19.831  11.765   4.135
 1029    HZ3  TRP  23           HZ3      TRP  23  21.679  13.497   0.666
 1030    HH2  TRP  23           HH2      TRP  23  20.078  13.660   2.553
 1031    H    THR  24           HN       THR  24  24.471   9.133  -1.788
 1032    HA   THR  24           HA       THR  24  22.686  11.312  -2.199
 1033    HB   THR  24           HB       THR  24  25.004  10.199  -3.761
 1034    HG1  THR  24           HG1      THR  24  24.473  12.558  -2.291
 1035   HG21  THR  24          HG21      THR  24  24.742  12.352  -5.129
 1036   HG22  THR  24          HG22      THR  24  23.085  12.403  -4.525
 1037   HG23  THR  24          HG23      THR  24  23.628  11.036  -5.499
 1038    H    ILE  25           HN       ILE  25  23.213   8.255  -3.935
 1039    HA   ILE  25           HA       ILE  25  21.413   8.733  -6.050
 1040    HB   ILE  25           HB       ILE  25  22.321   6.162  -4.745
 1041   HG12  ILE  25          HG12      ILE  25  23.051   7.362  -7.428
 1042   HG13  ILE  25          HG11      ILE  25  23.973   7.688  -5.960
 1043   HG21  ILE  25          HG21      ILE  25  21.505   5.167  -6.958
 1044   HG22  ILE  25          HG22      ILE  25  20.607   6.668  -7.189
 1045   HG23  ILE  25          HG23      ILE  25  20.250   5.629  -5.810
 1046   HD11  ILE  25          HD11      ILE  25  24.494   5.347  -5.683
 1047   HD12  ILE  25          HD12      ILE  25  24.878   5.783  -7.348
 1048   HD13  ILE  25          HD13      ILE  25  23.396   4.897  -6.987
 1049    H    GLY  26           HN       GLY  26  20.940   7.252  -2.863
 1050    HA2  GLY  26           HA2      GLY  26  18.225   6.520  -3.197
 1051    HA3  GLY  26           HA1      GLY  26  19.028   6.789  -1.652
 1052    H    HIS  27           HN       HIS  27  19.758   9.480  -1.999
 1053    HA   HIS  27           HA       HIS  27  17.447  10.823  -1.139
 1054    HB2  HIS  27           HB2      HIS  27  19.566  11.705  -0.503
 1055    HB3  HIS  27           HB1      HIS  27  20.094  11.832  -2.181
 1056    HD2  HIS  27           HD2      HIS  27  19.564  14.291  -3.315
 1057    HE1  HIS  27           HE1      HIS  27  16.720  15.644  -0.502
 1058    HE2  HIS  27           HE2      HIS  27  18.048  16.284  -2.570
 1059    H    LEU  28           HN       LEU  28  19.034  10.719  -4.309
 1060    HA   LEU  28           HA       LEU  28  17.227  12.574  -5.536
 1061    HB2  LEU  28           HB2      LEU  28  19.149  10.547  -6.704
 1062    HB3  LEU  28           HB1      LEU  28  18.263  11.742  -7.653
 1063    HG   LEU  28           HG       LEU  28  20.046  12.491  -5.326
 1064   HD11  LEU  28          HD11      LEU  28  21.798  12.966  -6.903
 1065   HD12  LEU  28          HD12      LEU  28  20.740  12.621  -8.272
 1066   HD13  LEU  28          HD13      LEU  28  21.268  11.313  -7.214
 1067   HD21  LEU  28          HD21      LEU  28  19.995  14.699  -6.615
 1068   HD22  LEU  28          HD22      LEU  28  18.477  14.225  -5.855
 1069   HD23  LEU  28          HD23      LEU  28  18.703  13.994  -7.588
 1070    H    ASN  29           HN       ASN  29  15.424  12.194  -6.758
 1071    HA   ASN  29           HA       ASN  29  14.236   9.518  -6.500
 1072    HB2  ASN  29           HB2      ASN  29  13.023  11.657  -5.782
 1073    HB3  ASN  29           HB1      ASN  29  12.856  12.005  -7.502
 1074   HD21  ASN  29          HD21      ASN  29  10.523  11.686  -7.478
 1075   HD22  ASN  29          HD22      ASN  29   9.842  10.142  -7.285
 1076    H    GLN  30           HN       GLN  30  13.592   8.309  -8.244
 1077    HA   GLN  30           HA       GLN  30  14.570   9.233 -10.871
 1078    HB2  GLN  30           HB2      GLN  30  14.324   6.533  -9.600
 1079    HB3  GLN  30           HB1      GLN  30  14.252   6.665 -11.356
 1080    HG2  GLN  30           HG2      GLN  30  16.527   6.483 -11.140
 1081    HG3  GLN  30           HG1      GLN  30  16.396   8.225 -10.912
 1082   HE21  GLN  30          HE21      GLN  30  18.505   6.542  -9.773
 1083   HE22  GLN  30          HE22      GLN  30  18.359   6.647  -8.084
 1084    H    ILE  31           HN       ILE  31  13.166   9.650 -12.439
 1085    HA   ILE  31           HA       ILE  31  10.516   8.382 -12.391
 1086    HB   ILE  31           HB       ILE  31   9.426  10.551 -12.852
 1087   HG12  ILE  31          HG12      ILE  31  12.096  11.784 -12.110
 1088   HG13  ILE  31          HG11      ILE  31  11.541  11.618 -13.775
 1089   HG21  ILE  31          HG21      ILE  31   9.646  11.461 -10.559
 1090   HG22  ILE  31          HG22      ILE  31  11.093  10.482 -10.318
 1091   HG23  ILE  31          HG23      ILE  31   9.528   9.701 -10.545
 1092   HD11  ILE  31          HD11      ILE  31   9.947  13.032 -11.622
 1093   HD12  ILE  31          HD12      ILE  31   9.625  13.018 -13.356
 1094   HD13  ILE  31          HD13      ILE  31  11.040  13.863 -12.728
 1095    H    LYS  32           HN       LYS  32   9.459   8.353 -14.442
 1096    HA   LYS  32           HA       LYS  32  11.316   8.796 -16.701
 1097    HB2  LYS  32           HB2      LYS  32   9.032   6.825 -16.434
 1098    HB3  LYS  32           HB1      LYS  32   9.998   7.060 -17.892
 1099    HG2  LYS  32           HG2      LYS  32  12.041   6.618 -16.358
 1100    HG3  LYS  32           HG1      LYS  32  10.865   5.955 -15.224
 1101    HD2  LYS  32           HD2      LYS  32  11.111   5.066 -18.109
 1102    HD3  LYS  32           HD1      LYS  32  11.873   4.232 -16.755
 1103    HE2  LYS  32           HE2      LYS  32   9.620   3.960 -15.711
 1104    HE3  LYS  32           HE1      LYS  32   8.902   4.683 -17.150
 1105    HZ1  LYS  32           HZ1      LYS  32  10.286   2.101 -16.869
 1106    HZ2  LYS  32           HZ2      LYS  32  10.238   2.877 -18.379
 1107    HZ3  LYS  32           HZ3      LYS  32   8.793   2.439 -17.599
 1108    H    ARG  33           HN       ARG  33  10.808  10.404 -18.017
 1109    HA   ARG  33           HA       ARG  33   8.157  11.616 -17.886
 1110    HB2  ARG  33           HB2      ARG  33  10.840  12.422 -18.864
 1111    HB3  ARG  33           HB1      ARG  33   9.454  13.103 -19.717
 1112    HG2  ARG  33           HG2      ARG  33   9.462  13.107 -16.716
 1113    HG3  ARG  33           HG1      ARG  33  10.410  14.319 -17.579
 1114    HD2  ARG  33           HD2      ARG  33   8.297  14.793 -18.940
 1115    HD3  ARG  33           HD1      ARG  33   7.432  13.829 -17.747
 1116    HE   ARG  33           HE       ARG  33   8.953  15.768 -16.384
 1117   HH11  ARG  33          HH11      ARG  33   6.228  15.527 -18.546
 1118   HH12  ARG  33          HH12      ARG  33   5.474  16.963 -17.941
 1119   HH21  ARG  33          HH21      ARG  33   7.948  17.641 -15.618
 1120   HH22  ARG  33          HH22      ARG  33   6.437  18.153 -16.296
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1  53.590  27.625  10.358
    2    H2   MET   1           HT2      MET   1  53.016  27.980  11.917
    3    H3   MET   1           HT3      MET   1  52.344  28.756  10.564
    4    HA   MET   1           HA       MET   1  52.111  26.019  10.124
    5    HB2  MET   1           HB2      MET   1  51.521  26.930  12.926
    6    HB3  MET   1           HB1      MET   1  50.517  25.684  12.183
    7    HG2  MET   1           HG2      MET   1  52.527  24.337  11.712
    8    HG3  MET   1           HG1      MET   1  53.536  25.580  12.451
    9    HE1  MET   1           HE1      MET   1  50.662  22.628  14.390
   10    HE2  MET   1           HE2      MET   1  50.988  22.926  12.685
   11    HE3  MET   1           HE3      MET   1  49.953  24.033  13.583
   12    H    PHE   2           HN       PHE   2  51.115  27.140   8.366
   13    HA   PHE   2           HA       PHE   2  48.967  28.953   8.645
   14    HB2  PHE   2           HB2      PHE   2  49.969  27.200   6.432
   15    HB3  PHE   2           HB1      PHE   2  48.417  28.017   6.258
   16    HD1  PHE   2           HD1      PHE   2  52.032  28.407   6.297
   17    HD2  PHE   2           HD2      PHE   2  48.293  30.511   6.454
   18    HE1  PHE   2           HE1      PHE   2  53.198  30.520   5.729
   19    HE2  PHE   2           HE2      PHE   2  49.457  32.625   5.886
   20    HZ   PHE   2           HZ       PHE   2  51.910  32.630   5.523
   21    H    GLU   3           HN       GLU   3  49.063  25.424   8.285
   22    HA   GLU   3           HA       GLU   3  46.222  25.148   8.199
   23    HB2  GLU   3           HB2      GLU   3  46.644  22.755   8.397
   24    HB3  GLU   3           HB1      GLU   3  47.773  23.469   7.244
   25    HG2  GLU   3           HG2      GLU   3  49.483  23.618   9.039
   26    HG3  GLU   3           HG1      GLU   3  48.360  22.839  10.152
   27    HA   PRO   4           HA       PRO   4  45.390  25.229  12.550
   28    HB2  PRO   4           HB2      PRO   4  43.121  23.730  12.678
   29    HB3  PRO   4           HB1      PRO   4  43.161  25.360  11.978
   30    HG2  PRO   4           HG2      PRO   4  43.096  22.720  10.628
   31    HG3  PRO   4           HG1      PRO   4  42.347  24.253  10.155
   32    HD2  PRO   4           HD2      PRO   4  44.694  23.239   9.055
   33    HD3  PRO   4           HD1      PRO   4  44.214  24.950   9.012
   34    H    PHE   5           HN       PHE   5  45.226  22.022  11.035
   35    HA   PHE   5           HA       PHE   5  46.767  20.899  13.246
   36    HB2  PHE   5           HB2      PHE   5  43.922  20.508  12.974
   37    HB3  PHE   5           HB1      PHE   5  44.762  18.974  12.760
   38    HD1  PHE   5           HD1      PHE   5  43.796  21.559  15.111
   39    HD2  PHE   5           HD2      PHE   5  46.401  18.197  14.512
   40    HE1  PHE   5           HE1      PHE   5  44.176  21.417  17.557
   41    HE2  PHE   5           HE2      PHE   5  46.782  18.056  16.958
   42    HZ   PHE   5           HZ       PHE   5  45.667  19.666  18.483
   43    H    GLN   6           HN       GLN   6  44.779  19.394  10.699
   44    HA   GLN   6           HA       GLN   6  47.178  18.702   9.179
   45    HB2  GLN   6           HB2      GLN   6  45.384  16.726  10.575
   46    HB3  GLN   6           HB1      GLN   6  46.256  16.280   9.108
   47    HG2  GLN   6           HG2      GLN   6  47.570  17.447  11.578
   48    HG3  GLN   6           HG1      GLN   6  47.498  15.725  11.216
   49   HE21  GLN   6          HE21      GLN   6  48.607  14.995   9.188
   50   HE22  GLN   6          HE22      GLN   6  49.906  15.906   8.582
   51    H    ILE   7           HN       ILE   7  46.622  17.694   7.096
   52    HA   ILE   7           HA       ILE   7  44.643  19.115   5.712
   53    HB   ILE   7           HB       ILE   7  45.061  17.498   3.869
   54   HG12  ILE   7          HG12      ILE   7  46.815  16.147   5.949
   55   HG13  ILE   7          HG11      ILE   7  45.330  15.480   5.273
   56   HG21  ILE   7          HG21      ILE   7  47.613  18.335   5.270
   57   HG22  ILE   7          HG22      ILE   7  46.573  19.456   4.392
   58   HG23  ILE   7          HG23      ILE   7  47.363  18.132   3.537
   59   HD11  ILE   7          HD11      ILE   7  47.133  14.496   4.036
   60   HD12  ILE   7          HD12      ILE   7  47.917  16.059   3.818
   61   HD13  ILE   7          HD13      ILE   7  46.406  15.707   2.980
   62    H    LEU   8           HN       LEU   8  44.562  16.024   7.326
   63    HA   LEU   8           HA       LEU   8  42.050  15.146   6.251
   64    HB2  LEU   8           HB2      LEU   8  43.662  14.301   8.665
   65    HB3  LEU   8           HB1      LEU   8  42.151  13.523   8.196
   66    HG   LEU   8           HG       LEU   8  44.392  13.860   6.208
   67   HD11  LEU   8          HD11      LEU   8  44.015  11.646   8.243
   68   HD12  LEU   8          HD12      LEU   8  45.423  12.691   8.058
   69   HD13  LEU   8          HD13      LEU   8  45.041  11.500   6.816
   70   HD21  LEU   8          HD21      LEU   8  42.275  11.709   6.472
   71   HD22  LEU   8          HD22      LEU   8  43.275  12.068   5.064
   72   HD23  LEU   8          HD23      LEU   8  42.012  13.194   5.558
   73    H    SER   9           HN       SER   9  43.053  17.056   8.987
   74    HA   SER   9           HA       SER   9  40.543  16.998  10.381
   75    HB2  SER   9           HB2      SER   9  42.662  17.493  11.537
   76    HB3  SER   9           HB1      SER   9  42.825  18.973  10.595
   77    HG   SER   9           HG       SER   9  40.717  18.297  12.377
   78    H    ILE  10           HN       ILE  10  42.095  19.256   8.122
   79    HA   ILE  10           HA       ILE  10  40.010  21.210   8.278
   80    HB   ILE  10           HB       ILE  10  41.112  22.221   6.324
   81   HG12  ILE  10          HG12      ILE  10  42.799  19.708   6.375
   82   HG13  ILE  10          HG11      ILE  10  41.636  20.123   5.121
   83   HG21  ILE  10          HG21      ILE  10  43.231  22.674   7.378
   84   HG22  ILE  10          HG22      ILE  10  43.184  21.143   8.252
   85   HG23  ILE  10          HG23      ILE  10  42.053  22.430   8.666
   86   HD11  ILE  10          HD11      ILE  10  42.974  22.278   4.796
   87   HD12  ILE  10          HD12      ILE  10  43.746  20.789   4.251
   88   HD13  ILE  10          HD13      ILE  10  44.227  21.523   5.781
   89    H    CYS  11           HN       CYS  11  40.648  18.400   6.212
   90    HA   CYS  11           HA       CYS  11  38.686  18.972   4.255
   91    HB2  CYS  11           HB2      CYS  11  39.974  16.412   5.196
   92    HB3  CYS  11           HB1      CYS  11  38.793  16.453   3.887
   93    HG   CYS  11           HG       CYS  11  41.688  17.306   3.653
   94    H    SER  12           HN       SER  12  38.576  16.826   7.129
   95    HA   SER  12           HA       SER  12  35.860  16.150   6.844
   96    HB2  SER  12           HB2      SER  12  35.988  15.372   9.130
   97    HB3  SER  12           HB1      SER  12  37.495  14.967   8.313
   98    HG   SER  12           HG       SER  12  37.091  16.501  10.476
   99    H    PHE  13           HN       PHE  13  37.457  18.911   8.322
  100    HA   PHE  13           HA       PHE  13  35.305  19.913   9.820
  101    HB2  PHE  13           HB2      PHE  13  37.517  20.825  10.106
  102    HB3  PHE  13           HB1      PHE  13  37.577  21.337   8.420
  103    HD1  PHE  13           HD1      PHE  13  35.362  21.712  11.431
  104    HD2  PHE  13           HD2      PHE  13  37.060  23.554   7.942
  105    HE1  PHE  13           HE1      PHE  13  34.298  23.865  12.050
  106    HE2  PHE  13           HE2      PHE  13  35.996  25.707   8.561
  107    HZ   PHE  13           HZ       PHE  13  34.615  25.862  10.615
  108    H    ILE  14           HN       ILE  14  36.300  20.672   6.471
  109    HA   ILE  14           HA       ILE  14  34.117  22.423   5.966
  110    HB   ILE  14           HB       ILE  14  35.895  20.866   4.077
  111   HG12  ILE  14          HG12      ILE  14  36.828  22.674   5.683
  112   HG13  ILE  14          HG11      ILE  14  37.219  22.824   3.971
  113   HG21  ILE  14          HG21      ILE  14  33.974  21.397   2.798
  114   HG22  ILE  14          HG22      ILE  14  35.087  22.722   2.464
  115   HG23  ILE  14          HG23      ILE  14  33.757  22.952   3.600
  116   HD11  ILE  14          HD11      ILE  14  34.782  24.193   5.110
  117   HD12  ILE  14          HD12      ILE  14  35.695  24.588   3.654
  118   HD13  ILE  14          HD13      ILE  14  36.376  24.934   5.241
  119    H    LEU  15           HN       LEU  15  34.659  19.000   5.260
  120    HA   LEU  15           HA       LEU  15  32.244  18.544   3.854
  121    HB2  LEU  15           HB2      LEU  15  34.330  16.877   5.143
  122    HB3  LEU  15           HB1      LEU  15  32.752  16.117   4.935
  123    HG   LEU  15           HG       LEU  15  34.370  15.817   2.995
  124   HD11  LEU  15          HD11      LEU  15  31.830  15.656   2.887
  125   HD12  LEU  15          HD12      LEU  15  32.638  16.002   1.359
  126   HD13  LEU  15          HD13      LEU  15  31.839  17.299   2.247
  127   HD21  LEU  15          HD21      LEU  15  35.137  18.278   3.194
  128   HD22  LEU  15          HD22      LEU  15  33.657  18.680   2.325
  129   HD23  LEU  15          HD23      LEU  15  34.870  17.646   1.571
  130    H    SER  16           HN       SER  16  32.983  18.806   7.224
  131    HA   SER  16           HA       SER  16  30.585  17.534   8.179
  132    HB2  SER  16           HB2      SER  16  32.587  17.620   9.576
  133    HB3  SER  16           HB1      SER  16  32.525  19.381   9.573
  134    HG   SER  16           HG       SER  16  30.475  19.220  10.576
  135    H    ALA  17           HN       ALA  17  31.692  20.881   7.737
  136    HA   ALA  17           HA       ALA  17  29.432  22.175   8.786
  137    HB1  ALA  17           HB1      ALA  17  30.141  24.063   7.239
  138    HB2  ALA  17           HB2      ALA  17  31.414  22.990   6.657
  139    HB3  ALA  17           HB3      ALA  17  31.379  23.481   8.351
  140    H    LEU  18           HN       LEU  18  30.159  21.164   5.439
  141    HA   LEU  18           HA       LEU  18  27.633  22.080   4.439
  142    HB2  LEU  18           HB2      LEU  18  29.517  20.083   3.186
  143    HB3  LEU  18           HB1      LEU  18  28.300  21.064   2.368
  144    HG   LEU  18           HG       LEU  18  30.733  22.125   3.830
  145   HD11  LEU  18          HD11      LEU  18  31.166  21.001   1.631
  146   HD12  LEU  18          HD12      LEU  18  31.555  22.722   1.632
  147   HD13  LEU  18          HD13      LEU  18  30.065  22.155   0.878
  148   HD21  LEU  18          HD21      LEU  18  28.496  23.507   2.322
  149   HD22  LEU  18          HD22      LEU  18  30.002  24.298   2.784
  150   HD23  LEU  18          HD23      LEU  18  28.904  23.700   4.026
  151    H    HIS  19           HN       HIS  19  28.796  19.212   5.970
  152    HA   HIS  19           HA       HIS  19  26.857  17.383   4.986
  153    HB2  HIS  19           HB2      HIS  19  28.685  16.344   5.985
  154    HB3  HIS  19           HB1      HIS  19  28.683  17.446   7.359
  155    HD2  HIS  19           HD2      HIS  19  27.236  16.558   9.534
  156    HE1  HIS  19           HE1      HIS  19  25.274  13.334   7.641
  157    HE2  HIS  19           HE2      HIS  19  25.669  14.495   9.865
  158    H    PHE  20           HN       PHE  20  27.027  19.303   7.979
  159    HA   PHE  20           HA       PHE  20  24.409  18.475   8.831
  160    HB2  PHE  20           HB2      PHE  20  26.633  19.862   9.964
  161    HB3  PHE  20           HB1      PHE  20  25.198  20.871  10.145
  162    HD1  PHE  20           HD1      PHE  20  27.020  18.182  11.545
  163    HD2  PHE  20           HD2      PHE  20  23.010  19.577  10.893
  164    HE1  PHE  20           HE1      PHE  20  26.213  16.727  13.386
  165    HE2  PHE  20           HE2      PHE  20  22.204  18.122  12.732
  166    HZ   PHE  20           HZ       PHE  20  23.799  16.703  13.979
  167    H    MET  21           HN       MET  21  25.692  20.997   6.818
  168    HA   MET  21           HA       MET  21  23.515  22.825   7.091
  169    HB2  MET  21           HB2      MET  21  25.743  22.441   5.126
  170    HB3  MET  21           HB1      MET  21  24.456  23.597   4.794
  171    HG2  MET  21           HG2      MET  21  25.906  23.590   7.439
  172    HG3  MET  21           HG1      MET  21  26.540  24.474   6.051
  173    HE1  MET  21           HE1      MET  21  26.485  26.438   7.727
  174    HE2  MET  21           HE2      MET  21  25.542  25.659   8.995
  175    HE3  MET  21           HE3      MET  21  25.028  27.219   8.358
  176    H    ALA  22           HN       ALA  22  24.408  20.673   4.393
  177    HA   ALA  22           HA       ALA  22  21.947  20.995   3.021
  178    HB1  ALA  22           HB1      ALA  22  22.747  18.763   1.914
  179    HB2  ALA  22           HB2      ALA  22  24.229  19.066   2.820
  180    HB3  ALA  22           HB3      ALA  22  23.659  20.249   1.642
  181    H    TRP  23           HN       TRP  23  23.106  18.529   5.292
  182    HA   TRP  23           HA       TRP  23  20.919  16.770   5.027
  183    HB2  TRP  23           HB2      TRP  23  23.130  16.272   6.136
  184    HB3  TRP  23           HB1      TRP  23  22.565  17.201   7.525
  185    HD1  TRP  23           HD1      TRP  23  22.036  13.946   5.656
  186    HE1  TRP  23           HE1      TRP  23  20.530  12.396   7.061
  187    HE3  TRP  23           HE3      TRP  23  20.631  17.184   9.353
  188    HZ2  TRP  23           HZ2      TRP  23  18.943  12.510   9.434
  189    HZ3  TRP  23           HZ3      TRP  23  19.121  16.434  11.171
  190    HH2  TRP  23           HH2      TRP  23  18.276  14.103  11.215
  191    H    THR  24           HN       THR  24  21.473  19.555   7.149
  192    HA   THR  24           HA       THR  24  19.118  19.246   8.712
  193    HB   THR  24           HB       THR  24  20.888  21.615   8.124
  194    HG1  THR  24           HG1      THR  24  20.424  20.119  10.483
  195   HG21  THR  24          HG21      THR  24  18.396  21.415   9.819
  196   HG22  THR  24          HG22      THR  24  18.774  22.605   8.572
  197   HG23  THR  24          HG23      THR  24  19.636  22.636  10.110
  198    H    ILE  25           HN       ILE  25  19.837  21.097   5.769
  199    HA   ILE  25           HA       ILE  25  17.361  22.425   5.566
  200    HB   ILE  25           HB       ILE  25  19.342  21.568   3.449
  201   HG12  ILE  25          HG12      ILE  25  18.754  24.324   4.553
  202   HG13  ILE  25          HG11      ILE  25  19.971  23.266   5.265
  203   HG21  ILE  25          HG21      ILE  25  18.133  23.373   2.095
  204   HG22  ILE  25          HG22      ILE  25  16.831  23.248   3.278
  205   HG23  ILE  25          HG23      ILE  25  17.269  21.850   2.297
  206   HD11  ILE  25          HD11      ILE  25  21.200  23.175   3.175
  207   HD12  ILE  25          HD12      ILE  25  20.909  24.869   3.572
  208   HD13  ILE  25          HD13      ILE  25  19.928  24.071   2.343
  209    H    GLY  26           HN       GLY  26  18.457  19.307   4.274
  210    HA2  GLY  26           HA2      GLY  26  16.116  18.668   2.822
  211    HA3  GLY  26           HA1      GLY  26  17.294  17.505   3.425
  212    H    HIS  27           HN       HIS  27  17.085  18.014   6.167
  213    HA   HIS  27           HA       HIS  27  14.900  16.395   6.897
  214    HB2  HIS  27           HB2      HIS  27  16.774  16.452   8.364
  215    HB3  HIS  27           HB1      HIS  27  16.700  18.210   8.502
  216    HD2  HIS  27           HD2      HIS  27  14.991  19.146  10.492
  217    HE1  HIS  27           HE1      HIS  27  13.253  15.438  11.515
  218    HE2  HIS  27           HE2      HIS  27  13.403  17.893  12.144
  219    H    LEU  28           HN       LEU  28  15.354  19.911   6.989
  220    HA   LEU  28           HA       LEU  28  12.798  20.402   8.199
  221    HB2  LEU  28           HB2      LEU  28  15.063  21.872   7.963
  222    HB3  LEU  28           HB1      LEU  28  14.098  22.572   6.663
  223    HG   LEU  28           HG       LEU  28  13.600  23.837   8.635
  224   HD11  LEU  28          HD11      LEU  28  11.330  21.848   8.503
  225   HD12  LEU  28          HD12      LEU  28  11.659  22.967   7.179
  226   HD13  LEU  28          HD13      LEU  28  11.251  23.587   8.778
  227   HD21  LEU  28          HD21      LEU  28  14.485  22.003  10.181
  228   HD22  LEU  28          HD22      LEU  28  12.884  21.271  10.075
  229   HD23  LEU  28          HD23      LEU  28  13.072  22.882  10.762
  230    H    ASN  29           HN       ASN  29  10.914  20.224   7.200
  231    HA   ASN  29           HA       ASN  29  10.793  20.778   4.294
  232    HB2  ASN  29           HB2      ASN  29   9.165  18.799   5.904
  233    HB3  ASN  29           HB1      ASN  29   8.937  19.151   4.192
  234   HD21  ASN  29          HD21      ASN  29   9.912  16.616   5.659
  235   HD22  ASN  29          HD22      ASN  29  11.365  16.229   4.871
  236    H    GLN  30           HN       GLN  30   9.543  22.438   3.743
  237    HA   GLN  30           HA       GLN  30   7.410  23.276   5.617
  238    HB2  GLN  30           HB2      GLN  30   9.237  25.006   3.933
  239    HB3  GLN  30           HB1      GLN  30   7.843  25.604   4.834
  240    HG2  GLN  30           HG2      GLN  30   8.828  24.784   6.932
  241    HG3  GLN  30           HG1      GLN  30  10.212  24.148   6.043
  242   HE21  GLN  30          HE21      GLN  30  11.879  25.538   6.764
  243   HE22  GLN  30          HE22      GLN  30  11.835  27.226   6.593
  244    H    ILE  31           HN       ILE  31   5.427  23.423   4.777
  245    HA   ILE  31           HA       ILE  31   5.140  23.627   1.848
  246    HB   ILE  31           HB       ILE  31   3.307  21.973   1.942
  247   HG12  ILE  31          HG12      ILE  31   4.246  21.420   4.770
  248   HG13  ILE  31          HG11      ILE  31   2.826  22.400   4.405
  249   HG21  ILE  31          HG21      ILE  31   5.626  21.268   1.407
  250   HG22  ILE  31          HG22      ILE  31   4.725  19.994   2.227
  251   HG23  ILE  31          HG23      ILE  31   5.909  20.950   3.118
  252   HD11  ILE  31          HD11      ILE  31   2.053  20.153   4.794
  253   HD12  ILE  31          HD12      ILE  31   3.269  19.489   3.701
  254   HD13  ILE  31          HD13      ILE  31   1.938  20.452   3.059
  255    H    LYS  32           HN       LYS  32   3.167  24.570   1.134
  256    HA   LYS  32           HA       LYS  32   1.922  26.297   3.173
  257    HB2  LYS  32           HB2      LYS  32   2.643  26.630   0.351
  258    HB3  LYS  32           HB1      LYS  32   1.013  27.188   0.732
  259    HG2  LYS  32           HG2      LYS  32   3.270  27.931   2.563
  260    HG3  LYS  32           HG1      LYS  32   3.064  28.815   1.050
  261    HD2  LYS  32           HD2      LYS  32   0.897  29.561   1.647
  262    HD3  LYS  32           HD1      LYS  32   0.752  28.367   2.937
  263    HE2  LYS  32           HE2      LYS  32   1.206  30.572   3.901
  264    HE3  LYS  32           HE1      LYS  32   2.588  29.509   4.167
  265    HZ1  LYS  32           HZ1      LYS  32   3.706  30.494   2.301
  266    HZ2  LYS  32           HZ2      LYS  32   3.224  31.727   3.365
  267    HZ3  LYS  32           HZ3      LYS  32   2.354  31.450   1.932
  268    H    ARG  33           HN       ARG  33  -0.129  25.987   3.772
  269    HA   ARG  33           HA       ARG  33  -1.690  23.933   2.367
  270    HB2  ARG  33           HB2      ARG  33  -2.348  25.277   4.992
  271    HB3  ARG  33           HB1      ARG  33  -2.994  23.761   4.360
  272    HG2  ARG  33           HG2      ARG  33  -0.612  22.870   4.388
  273    HG3  ARG  33           HG1      ARG  33  -0.173  24.314   5.302
  274    HD2  ARG  33           HD2      ARG  33  -0.624  22.625   6.931
  275    HD3  ARG  33           HD1      ARG  33  -2.023  23.693   6.936
  276    HE   ARG  33           HE       ARG  33  -2.378  21.506   5.122
  277   HH11  ARG  33          HH11      ARG  33  -2.459  22.418   8.483
  278   HH12  ARG  33          HH12      ARG  33  -3.584  21.180   8.918
  279   HH21  ARG  33          HH21      ARG  33  -3.846  19.892   5.717
  280   HH22  ARG  33          HH22      ARG  33  -4.367  19.757   7.363
  281    H1   MET   1           HT1      MET   1  45.971  18.362  33.923
  282    H2   MET   1           HT2      MET   1  45.876  16.691  34.211
  283    H3   MET   1           HT3      MET   1  44.599  17.710  34.677
  284    HA   MET   1           HA       MET   1  45.018  18.133  31.959
  285    HB2  MET   1           HB2      MET   1  45.167  15.269  32.855
  286    HB3  MET   1           HB1      MET   1  44.370  15.669  31.333
  287    HG2  MET   1           HG2      MET   1  46.404  16.838  30.570
  288    HG3  MET   1           HG1      MET   1  47.203  16.446  32.093
  289    HE1  MET   1           HE1      MET   1  46.109  13.740  28.596
  290    HE2  MET   1           HE2      MET   1  45.745  15.444  28.856
  291    HE3  MET   1           HE3      MET   1  44.803  14.213  29.691
  292    H    PHE   2           HN       PHE   2  43.216  19.410  32.637
  293    HA   PHE   2           HA       PHE   2  40.865  18.357  33.798
  294    HB2  PHE   2           HB2      PHE   2  41.522  20.835  32.245
  295    HB3  PHE   2           HB1      PHE   2  39.836  20.442  32.587
  296    HD1  PHE   2           HD1      PHE   2  42.986  21.625  33.967
  297    HD2  PHE   2           HD2      PHE   2  39.080  20.136  34.954
  298    HE1  PHE   2           HE1      PHE   2  43.243  22.488  36.277
  299    HE2  PHE   2           HE2      PHE   2  39.336  20.998  37.265
  300    HZ   PHE   2           HZ       PHE   2  41.417  22.174  37.927
  301    H    GLU   3           HN       GLU   3  41.832  18.843  30.417
  302    HA   GLU   3           HA       GLU   3  39.329  17.966  29.359
  303    HB2  GLU   3           HB2      GLU   3  40.457  17.999  27.196
  304    HB3  GLU   3           HB1      GLU   3  40.879  19.445  28.116
  305    HG2  GLU   3           HG2      GLU   3  42.975  18.338  28.857
  306    HG3  GLU   3           HG1      GLU   3  42.562  16.933  27.875
  307    HA   PRO   4           HA       PRO   4  40.019  13.593  29.499
  308    HB2  PRO   4           HB2      PRO   4  38.447  12.746  27.443
  309    HB3  PRO   4           HB1      PRO   4  37.786  13.369  28.968
  310    HG2  PRO   4           HG2      PRO   4  38.025  14.696  26.325
  311    HG3  PRO   4           HG1      PRO   4  36.760  14.839  27.555
  312    HD2  PRO   4           HD2      PRO   4  38.792  16.700  27.155
  313    HD3  PRO   4           HD1      PRO   4  37.858  16.529  28.657
  314    H    PHE   5           HN       PHE   5  40.275  15.065  26.278
  315    HA   PHE   5           HA       PHE   5  42.718  13.547  25.778
  316    HB2  PHE   5           HB2      PHE   5  40.182  12.847  24.595
  317    HB3  PHE   5           HB1      PHE   5  41.302  13.384  23.344
  318    HD1  PHE   5           HD1      PHE   5  40.487  10.761  25.711
  319    HD2  PHE   5           HD2      PHE   5  43.580  12.322  23.172
  320    HE1  PHE   5           HE1      PHE   5  41.691   8.597  25.846
  321    HE2  PHE   5           HE2      PHE   5  44.784  10.159  23.308
  322    HZ   PHE   5           HZ       PHE   5  43.839   8.296  24.645
  323    H    GLN   6           HN       GLN   6  40.510  15.305  23.611
  324    HA   GLN   6           HA       GLN   6  42.349  17.578  23.512
  325    HB2  GLN   6           HB2      GLN   6  41.766  15.721  21.215
  326    HB3  GLN   6           HB1      GLN   6  42.185  17.409  20.931
  327    HG2  GLN   6           HG2      GLN   6  43.862  15.502  22.583
  328    HG3  GLN   6           HG1      GLN   6  44.165  15.870  20.887
  329   HE21  GLN   6          HE21      GLN   6  44.690  18.176  20.358
  330   HE22  GLN   6          HE22      GLN   6  45.393  19.160  21.549
  331    H    ILE   7           HN       ILE   7  41.435  19.383  22.244
  332    HA   ILE   7           HA       ILE   7  38.792  19.963  22.970
  333    HB   ILE   7           HB       ILE   7  39.011  21.888  21.412
  334   HG12  ILE   7          HG12      ILE   7  41.667  20.573  20.742
  335   HG13  ILE   7          HG11      ILE   7  40.295  20.727  19.646
  336   HG21  ILE   7          HG21      ILE   7  41.537  21.409  23.015
  337   HG22  ILE   7          HG22      ILE   7  39.991  21.848  23.742
  338   HG23  ILE   7          HG23      ILE   7  40.791  22.961  22.633
  339   HD11  ILE   7          HD11      ILE   7  41.782  22.534  19.122
  340   HD12  ILE   7          HD12      ILE   7  41.966  22.955  20.824
  341   HD13  ILE   7          HD13      ILE   7  40.430  23.238  20.008
  342    H    LEU   8           HN       LEU   8  40.139  18.518  20.094
  343    HA   LEU   8           HA       LEU   8  37.771  18.701  18.482
  344    HB2  LEU   8           HB2      LEU   8  40.270  17.009  18.284
  345    HB3  LEU   8           HB1      LEU   8  38.975  16.960  17.086
  346    HG   LEU   8           HG       LEU   8  40.226  19.582  17.897
  347   HD11  LEU   8          HD11      LEU   8  41.200  17.612  15.810
  348   HD12  LEU   8          HD12      LEU   8  42.106  18.234  17.188
  349   HD13  LEU   8          HD13      LEU   8  41.682  19.307  15.855
  350   HD21  LEU   8          HD21      LEU   8  39.023  18.682  15.266
  351   HD22  LEU   8          HD22      LEU   8  39.348  20.333  15.792
  352   HD23  LEU   8          HD23      LEU   8  38.061  19.403  16.554
  353    H    SER   9           HN       SER   9  39.045  16.413  20.778
  354    HA   SER   9           HA       SER   9  37.275  14.247  20.117
  355    HB2  SER   9           HB2      SER   9  39.427  13.866  21.260
  356    HB3  SER   9           HB1      SER   9  38.836  14.759  22.660
  357    HG   SER   9           HG       SER   9  37.735  12.388  21.545
  358    H    ILE  10           HN       ILE  10  37.268  16.831  22.555
  359    HA   ILE  10           HA       ILE  10  34.895  15.907  23.863
  360    HB   ILE  10           HB       ILE  10  34.942  18.084  25.005
  361   HG12  ILE  10          HG12      ILE  10  37.189  18.693  23.070
  362   HG13  ILE  10          HG11      ILE  10  35.606  19.461  23.060
  363   HG21  ILE  10          HG21      ILE  10  37.071  17.802  26.099
  364   HG22  ILE  10          HG22      ILE  10  37.754  17.010  24.680
  365   HG23  ILE  10          HG23      ILE  10  36.511  16.197  25.628
  366   HD11  ILE  10          HD11      ILE  10  36.086  20.153  25.475
  367   HD12  ILE  10          HD12      ILE  10  37.022  20.974  24.225
  368   HD13  ILE  10          HD13      ILE  10  37.757  19.676  25.166
  369    H    CYS  11           HN       CYS  11  35.574  18.155  21.204
  370    HA   CYS  11           HA       CYS  11  32.994  19.311  21.077
  371    HB2  CYS  11           HB2      CYS  11  35.193  18.944  19.046
  372    HB3  CYS  11           HB1      CYS  11  33.683  19.773  18.669
  373    HG   CYS  11           HG       CYS  11  35.965  20.951  20.271
  374    H    SER  12           HN       SER  12  34.468  16.638  19.184
  375    HA   SER  12           HA       SER  12  32.124  16.004  17.765
  376    HB2  SER  12           HB2      SER  12  33.227  13.926  17.208
  377    HB3  SER  12           HB1      SER  12  34.421  15.220  17.184
  378    HG   SER  12           HG       SER  12  34.346  12.999  18.688
  379    H    PHE  13           HN       PHE  13  33.267  15.076  20.953
  380    HA   PHE  13           HA       PHE  13  31.555  12.898  21.418
  381    HB2  PHE  13           HB2      PHE  13  33.379  13.352  22.926
  382    HB3  PHE  13           HB1      PHE  13  32.721  14.939  23.320
  383    HD1  PHE  13           HD1      PHE  13  31.635  11.344  23.267
  384    HD2  PHE  13           HD2      PHE  13  31.467  15.141  25.269
  385    HE1  PHE  13           HE1      PHE  13  30.274  10.330  25.076
  386    HE2  PHE  13           HE2      PHE  13  30.106  14.127  27.077
  387    HZ   PHE  13           HZ       PHE  13  29.510  11.723  26.981
  388    H    ILE  14           HN       ILE  14  31.108  16.362  22.190
  389    HA   ILE  14           HA       ILE  14  28.482  16.032  23.231
  390    HB   ILE  14           HB       ILE  14  29.888  18.464  22.105
  391   HG12  ILE  14          HG12      ILE  14  30.751  17.215  24.206
  392   HG13  ILE  14          HG11      ILE  14  30.485  18.951  24.343
  393   HG21  ILE  14          HG21      ILE  14  27.583  18.995  21.994
  394   HG22  ILE  14          HG22      ILE  14  28.094  19.644  23.550
  395   HG23  ILE  14          HG23      ILE  14  27.215  18.116  23.477
  396   HD11  ILE  14          HD11      ILE  14  28.290  17.006  25.054
  397   HD12  ILE  14          HD12      ILE  14  28.507  18.673  25.587
  398   HD13  ILE  14          HD13      ILE  14  29.555  17.403  26.216
  399    H    LEU  15           HN       LEU  15  29.704  16.996  20.051
  400    HA   LEU  15           HA       LEU  15  27.194  17.506  18.851
  401    HB2  LEU  15           HB2      LEU  15  29.974  17.059  17.922
  402    HB3  LEU  15           HB1      LEU  15  28.704  16.741  16.741
  403    HG   LEU  15           HG       LEU  15  29.592  19.124  16.772
  404   HD11  LEU  15          HD11      LEU  15  27.319  18.366  15.905
  405   HD12  LEU  15          HD12      LEU  15  27.435  20.067  16.355
  406   HD13  LEU  15          HD13      LEU  15  26.646  18.921  17.437
  407   HD21  LEU  15          HD21      LEU  15  29.648  19.119  19.357
  408   HD22  LEU  15          HD22      LEU  15  27.913  19.420  19.271
  409   HD23  LEU  15          HD23      LEU  15  29.043  20.575  18.567
  410    H    SER  16           HN       SER  16  28.915  14.581  19.536
  411    HA   SER  16           HA       SER  16  27.444  12.906  17.717
  412    HB2  SER  16           HB2      SER  16  29.686  12.272  18.454
  413    HB3  SER  16           HB1      SER  16  29.129  12.198  20.123
  414    HG   SER  16           HG       SER  16  27.665  10.564  19.459
  415    H    ALA  17           HN       ALA  17  27.334  13.597  21.199
  416    HA   ALA  17           HA       ALA  17  25.288  11.798  21.882
  417    HB1  ALA  17           HB1      ALA  17  24.871  13.430  23.784
  418    HB2  ALA  17           HB2      ALA  17  26.124  14.445  23.070
  419    HB3  ALA  17           HB3      ALA  17  26.522  12.825  23.643
  420    H    LEU  18           HN       LEU  18  25.105  15.227  20.885
  421    HA   LEU  18           HA       LEU  18  22.242  15.272  20.998
  422    HB2  LEU  18           HB2      LEU  18  24.082  17.155  19.520
  423    HB3  LEU  18           HB1      LEU  18  22.436  17.477  20.068
  424    HG   LEU  18           HG       LEU  18  24.811  16.899  21.857
  425   HD11  LEU  18          HD11      LEU  18  24.782  19.150  20.753
  426   HD12  LEU  18          HD12      LEU  18  24.644  19.224  22.509
  427   HD13  LEU  18          HD13      LEU  18  23.213  19.444  21.503
  428   HD21  LEU  18          HD21      LEU  18  21.904  17.510  22.460
  429   HD22  LEU  18          HD22      LEU  18  23.188  17.563  23.667
  430   HD23  LEU  18          HD23      LEU  18  22.788  16.041  22.875
  431    H    HIS  19           HN       HIS  19  24.617  14.325  18.675
  432    HA   HIS  19           HA       HIS  19  23.062  14.644  16.321
  433    HB2  HIS  19           HB2      HIS  19  25.334  14.365  15.900
  434    HB3  HIS  19           HB1      HIS  19  25.482  13.035  17.047
  435    HD2  HIS  19           HD2      HIS  19  25.166  10.528  15.939
  436    HE1  HIS  19           HE1      HIS  19  23.682  11.746  12.178
  437    HE2  HIS  19           HE2      HIS  19  24.454   9.752  13.549
  438    H    PHE  20           HN       PHE  20  23.675  11.827  18.408
  439    HA   PHE  20           HA       PHE  20  21.844  10.163  16.947
  440    HB2  PHE  20           HB2      PHE  20  23.826   9.816  18.973
  441    HB3  PHE  20           HB1      PHE  20  22.311   9.122  19.553
  442    HD1  PHE  20           HD1      PHE  20  25.182   8.521  17.582
  443    HD2  PHE  20           HD2      PHE  20  20.968   7.715  17.752
  444    HE1  PHE  20           HE1      PHE  20  25.496   6.570  16.083
  445    HE2  PHE  20           HE2      PHE  20  21.280   5.764  16.253
  446    HZ   PHE  20           HZ       PHE  20  23.543   5.201  15.419
  447    H    MET  21           HN       MET  21  21.601  12.416  19.576
  448    HA   MET  21           HA       MET  21  19.221  11.355  20.744
  449    HB2  MET  21           HB2      MET  21  20.673  13.972  20.863
  450    HB3  MET  21           HB1      MET  21  19.078  13.809  21.591
  451    HG2  MET  21           HG2      MET  21  21.269  11.818  22.166
  452    HG3  MET  21           HG1      MET  21  21.121  13.310  23.096
  453    HE1  MET  21           HE1      MET  21  21.076  11.652  25.076
  454    HE2  MET  21           HE2      MET  21  20.876  10.164  24.154
  455    HE3  MET  21           HE3      MET  21  19.757  10.538  25.463
  456    H    ALA  22           HN       ALA  22  19.729  14.272  18.748
  457    HA   ALA  22           HA       ALA  22  16.973  14.711  18.278
  458    HB1  ALA  22           HB1      ALA  22  17.959  16.089  16.285
  459    HB2  ALA  22           HB2      ALA  22  19.507  15.732  17.050
  460    HB3  ALA  22           HB3      ALA  22  18.264  16.610  17.942
  461    H    TRP  23           HN       TRP  23  19.474  13.046  16.393
  462    HA   TRP  23           HA       TRP  23  17.918  12.605  14.080
  463    HB2  TRP  23           HB2      TRP  23  20.418  12.331  14.294
  464    HB3  TRP  23           HB1      TRP  23  20.112  10.804  15.121
  465    HD1  TRP  23           HD1      TRP  23  19.933  12.486  11.730
  466    HE1  TRP  23           HE1      TRP  23  19.494  10.704   9.920
  467    HE3  TRP  23           HE3      TRP  23  18.992   8.429  14.691
  468    HZ2  TRP  23           HZ2      TRP  23  18.831   7.930   9.750
  469    HZ3  TRP  23           HZ3      TRP  23  18.459   6.231  13.676
  470    HH2  TRP  23           HH2      TRP  23  18.377   5.977  11.211
  471    H    THR  24           HN       THR  24  18.334  10.712  17.050
  472    HA   THR  24           HA       THR  24  16.832   8.452  16.204
  473    HB   THR  24           HB       THR  24  17.552   9.529  18.925
  474    HG1  THR  24           HG1      THR  24  18.351   7.207  17.516
  475   HG21  THR  24          HG21      THR  24  15.939   7.094  18.156
  476   HG22  THR  24          HG22      THR  24  15.521   8.357  19.314
  477   HG23  THR  24          HG23      THR  24  16.802   7.205  19.690
  478    H    ILE  25           HN       ILE  25  15.962  11.408  17.976
  479    HA   ILE  25           HA       ILE  25  13.296  10.706  18.550
  480    HB   ILE  25           HB       ILE  25  14.609  13.398  18.135
  481   HG12  ILE  25          HG12      ILE  25  13.668  12.071  20.688
  482   HG13  ILE  25          HG11      ILE  25  15.301  11.851  20.059
  483   HG21  ILE  25          HG21      ILE  25  12.556  14.200  19.437
  484   HG22  ILE  25          HG22      ILE  25  11.818  12.650  19.035
  485   HG23  ILE  25          HG23      ILE  25  12.280  13.766  17.751
  486   HD11  ILE  25          HD11      ILE  25  15.727  14.236  20.173
  487   HD12  ILE  25          HD12      ILE  25  15.120  13.707  21.742
  488   HD13  ILE  25          HD13      ILE  25  14.052  14.555  20.623
  489    H    GLY  26           HN       GLY  26  14.731  12.402  15.777
  490    HA2  GLY  26           HA2      GLY  26  12.324  12.983  14.418
  491    HA3  GLY  26           HA1      GLY  26  13.914  12.856  13.672
  492    H    HIS  27           HN       HIS  27  14.502  10.191  14.287
  493    HA   HIS  27           HA       HIS  27  13.244   8.813  12.177
  494    HB2  HIS  27           HB2      HIS  27  15.404   8.073  12.853
  495    HB3  HIS  27           HB1      HIS  27  14.884   7.860  14.525
  496    HD2  HIS  27           HD2      HIS  27  13.750   5.377  15.083
  497    HE1  HIS  27           HE1      HIS  27  13.586   3.946  11.114
  498    HE2  HIS  27           HE2      HIS  27  13.235   3.326  13.552
  499    H    LEU  28           HN       LEU  28  12.682   8.770  15.679
  500    HA   LEU  28           HA       LEU  28  10.653   6.746  15.521
  501    HB2  LEU  28           HB2      LEU  28  12.192   7.692  17.542
  502    HB3  LEU  28           HB1      LEU  28  10.690   8.560  17.857
  503    HG   LEU  28           HG       LEU  28  10.544   6.498  19.066
  504   HD11  LEU  28          HD11      LEU  28   9.025   5.914  16.520
  505   HD12  LEU  28          HD12      LEU  28   8.561   7.233  17.593
  506   HD13  LEU  28          HD13      LEU  28   8.553   5.573  18.183
  507   HD21  LEU  28          HD21      LEU  28  12.378   5.405  17.657
  508   HD22  LEU  28          HD22      LEU  28  11.113   4.984  16.503
  509   HD23  LEU  28          HD23      LEU  28  11.054   4.350  18.147
  510    H    ASN  29           HN       ASN  29   8.678   7.049  14.757
  511    HA   ASN  29           HA       ASN  29   7.437   9.720  15.060
  512    HB2  ASN  29           HB2      ASN  29   7.077   7.716  12.819
  513    HB3  ASN  29           HB1      ASN  29   6.198   9.235  12.977
  514   HD21  ASN  29          HD21      ASN  29   8.287   8.272  10.919
  515   HD22  ASN  29          HD22      ASN  29   9.437   9.520  10.898
  516    H    GLN  30           HN       GLN  30   5.659   9.758  16.265
  517    HA   GLN  30           HA       GLN  30   4.133   7.244  16.602
  518    HB2  GLN  30           HB2      GLN  30   4.716   9.393  18.653
  519    HB3  GLN  30           HB1      GLN  30   3.597   8.051  18.900
  520    HG2  GLN  30           HG2      GLN  30   5.419   6.444  18.530
  521    HG3  GLN  30           HG1      GLN  30   6.544   7.771  18.246
  522   HE21  GLN  30          HE21      GLN  30   7.889   7.613  20.090
  523   HE22  GLN  30          HE22      GLN  30   7.312   7.705  21.683
  524    H    ILE  31           HN       ILE  31   2.026   7.353  16.136
  525    HA   ILE  31           HA       ILE  31   0.729  10.001  16.053
  526    HB   ILE  31           HB       ILE  31  -0.415   9.343  13.964
  527   HG12  ILE  31          HG12      ILE  31   1.535   7.024  13.887
  528   HG13  ILE  31          HG11      ILE  31  -0.141   6.851  14.407
  529   HG21  ILE  31          HG21      ILE  31   1.690  10.660  13.900
  530   HG22  ILE  31          HG22      ILE  31   1.518   9.624  12.482
  531   HG23  ILE  31          HG23      ILE  31   2.608   9.157  13.789
  532   HD11  ILE  31          HD11      ILE  31  -0.067   6.296  12.065
  533   HD12  ILE  31          HD12      ILE  31   0.848   7.758  11.694
  534   HD13  ILE  31          HD13      ILE  31  -0.836   7.877  12.203
  535    H    LYS  32           HN       LYS  32  -1.549   9.970  16.362
  536    HA   LYS  32           HA       LYS  32  -2.476   7.575  17.807
  537    HB2  LYS  32           HB2      LYS  32  -2.868  10.461  18.136
  538    HB3  LYS  32           HB1      LYS  32  -4.363   9.532  18.242
  539    HG2  LYS  32           HG2      LYS  32  -1.934   8.555  19.707
  540    HG3  LYS  32           HG1      LYS  32  -2.878   9.878  20.394
  541    HD2  LYS  32           HD2      LYS  32  -4.836   8.554  20.547
  542    HD3  LYS  32           HD1      LYS  32  -4.194   7.331  19.450
  543    HE2  LYS  32           HE2      LYS  32  -4.090   6.510  21.754
  544    HE3  LYS  32           HE1      LYS  32  -2.457   6.764  21.136
  545    HZ1  LYS  32           HZ1      LYS  32  -2.356   8.864  22.263
  546    HZ2  LYS  32           HZ2      LYS  32  -2.784   7.661  23.384
  547    HZ3  LYS  32           HZ3      LYS  32  -3.965   8.722  22.781
  548    H    ARG  33           HN       ARG  33  -4.030   6.325  16.982
  549    HA   ARG  33           HA       ARG  33  -5.319   7.180  14.484
  550    HB2  ARG  33           HB2      ARG  33  -5.411   4.446  15.766
  551    HB3  ARG  33           HB1      ARG  33  -5.773   4.869  14.092
  552    HG2  ARG  33           HG2      ARG  33  -3.372   5.684  13.900
  553    HG3  ARG  33           HG1      ARG  33  -3.080   4.928  15.468
  554    HD2  ARG  33           HD2      ARG  33  -2.460   3.298  13.834
  555    HD3  ARG  33           HD1      ARG  33  -4.019   2.782  14.469
  556    HE   ARG  33           HE       ARG  33  -4.322   4.437  12.152
  557   HH11  ARG  33          HH11      ARG  33  -3.530   1.221  13.232
  558   HH12  ARG  33          HH12      ARG  33  -4.044   0.470  11.762
  559   HH21  ARG  33          HH21      ARG  33  -4.982   3.430  10.238
  560   HH22  ARG  33          HH22      ARG  33  -4.861   1.710  10.076
  561    H1   MET   1           HT1      MET   1  49.791  -5.313  25.207
  562    H2   MET   1           HT2      MET   1  50.279  -5.674  23.619
  563    H3   MET   1           HT3      MET   1  48.994  -6.526  24.331
  564    HA   MET   1           HA       MET   1  48.350  -3.825  24.481
  565    HB2  MET   1           HB2      MET   1  49.601  -4.710  21.896
  566    HB3  MET   1           HB1      MET   1  48.266  -3.557  21.871
  567    HG2  MET   1           HG2      MET   1  49.506  -2.081  23.409
  568    HG3  MET   1           HG1      MET   1  50.841  -3.233  23.441
  569    HE1  MET   1           HE1      MET   1  49.475  -0.451  20.103
  570    HE2  MET   1           HE2      MET   1  48.747  -0.762  21.676
  571    HE3  MET   1           HE3      MET   1  48.527  -1.922  20.368
  572    H    PHE   2           HN       PHE   2  46.587  -5.053  25.331
  573    HA   PHE   2           HA       PHE   2  45.160  -7.010  23.877
  574    HB2  PHE   2           HB2      PHE   2  44.526  -5.239  26.210
  575    HB3  PHE   2           HB1      PHE   2  43.237  -6.171  25.448
  576    HD1  PHE   2           HD1      PHE   2  46.187  -6.299  27.570
  577    HD2  PHE   2           HD2      PHE   2  43.429  -8.662  25.278
  578    HE1  PHE   2           HE1      PHE   2  46.936  -8.337  28.770
  579    HE2  PHE   2           HE2      PHE   2  44.177 -10.699  26.477
  580    HZ   PHE   2           HZ       PHE   2  45.930 -10.537  28.223
  581    H    GLU   3           HN       GLU   3  44.771  -3.492  24.137
  582    HA   GLU   3           HA       GLU   3  42.422  -3.424  22.514
  583    HB2  GLU   3           HB2      GLU   3  42.709  -1.003  22.547
  584    HB3  GLU   3           HB1      GLU   3  42.979  -1.660  24.162
  585    HG2  GLU   3           HG2      GLU   3  45.426  -1.646  23.735
  586    HG3  GLU   3           HG1      GLU   3  45.131  -0.924  22.155
  587    HA   PRO   4           HA       PRO   4  44.342  -3.467  18.522
  588    HB2  PRO   4           HB2      PRO   4  42.491  -2.132  17.036
  589    HB3  PRO   4           HB1      PRO   4  42.223  -3.770  17.663
  590    HG2  PRO   4           HG2      PRO   4  41.182  -1.171  18.646
  591    HG3  PRO   4           HG1      PRO   4  40.411  -2.765  18.621
  592    HD2  PRO   4           HD2      PRO   4  41.568  -1.611  20.873
  593    HD3  PRO   4           HD1      PRO   4  41.280  -3.353  20.664
  594    H    PHE   5           HN       PHE   5  43.081  -0.314  19.565
  595    HA   PHE   5           HA       PHE   5  45.548   0.968  18.672
  596    HB2  PHE   5           HB2      PHE   5  43.079   1.145  17.195
  597    HB3  PHE   5           HB1      PHE   5  43.515   2.731  17.828
  598    HD1  PHE   5           HD1      PHE   5  44.321   0.139  15.425
  599    HD2  PHE   5           HD2      PHE   5  45.812   3.664  17.376
  600    HE1  PHE   5           HE1      PHE   5  46.070   0.364  13.680
  601    HE2  PHE   5           HE2      PHE   5  47.560   3.888  15.632
  602    HZ   PHE   5           HZ       PHE   5  47.690   2.239  13.784
  603    H    GLN   6           HN       GLN   6  42.335   2.267  19.508
  604    HA   GLN   6           HA       GLN   6  43.308   3.094  22.136
  605    HB2  GLN   6           HB2      GLN   6  42.558   4.968  19.900
  606    HB3  GLN   6           HB1      GLN   6  42.356   5.442  21.587
  607    HG2  GLN   6           HG2      GLN   6  44.958   4.429  20.409
  608    HG3  GLN   6           HG1      GLN   6  44.562   6.132  20.614
  609   HE21  GLN   6          HE21      GLN   6  44.197   6.894  22.886
  610   HE22  GLN   6          HE22      GLN   6  44.942   6.066  24.166
  611    H    ILE   7           HN       ILE   7  41.556   4.006  23.460
  612    HA   ILE   7           HA       ILE   7  39.247   2.421  23.433
  613    HB   ILE   7           HB       ILE   7  38.375   4.021  25.124
  614   HG12  ILE   7          HG12      ILE   7  40.918   5.543  24.455
  615   HG13  ILE   7          HG11      ILE   7  39.278   6.086  24.106
  616   HG21  ILE   7          HG21      ILE   7  41.313   3.402  25.529
  617   HG22  ILE   7          HG22      ILE   7  40.037   2.189  25.648
  618   HG23  ILE   7          HG23      ILE   7  40.070   3.549  26.773
  619   HD11  ILE   7          HD11      ILE   7  39.924   7.168  26.145
  620   HD12  ILE   7          HD12      ILE   7  40.532   5.658  26.824
  621   HD13  ILE   7          HD13      ILE   7  38.798   5.886  26.592
  622    H    LEU   8           HN       LEU   8  39.923   5.528  22.013
  623    HA   LEU   8           HA       LEU   8  37.207   6.205  21.363
  624    HB2  LEU   8           HB2      LEU   8  39.873   7.219  20.359
  625    HB3  LEU   8           HB1      LEU   8  38.328   7.875  19.818
  626    HG   LEU   8           HG       LEU   8  38.966   7.656  22.757
  627   HD11  LEU   8          HD11      LEU   8  39.715   9.882  20.842
  628   HD12  LEU   8          HD12      LEU   8  40.808   8.939  21.856
  629   HD13  LEU   8          HD13      LEU   8  39.675  10.071  22.595
  630   HD21  LEU   8          HD21      LEU   8  37.272   9.653  21.235
  631   HD22  LEU   8          HD22      LEU   8  37.264   9.336  22.970
  632   HD23  LEU   8          HD23      LEU   8  36.626   8.133  21.851
  633    H    SER   9           HN       SER   9  39.770   4.435  19.806
  634    HA   SER   9           HA       SER   9  38.582   4.344  17.192
  635    HB2  SER   9           HB2      SER   9  41.002   4.027  17.531
  636    HB3  SER   9           HB1      SER   9  40.679   2.542  18.422
  637    HG   SER   9           HG       SER   9  40.000   3.106  15.720
  638    H    ILE  10           HN       ILE  10  38.647   2.150  19.984
  639    HA   ILE  10           HA       ILE  10  37.205   0.058  18.670
  640    HB   ILE  10           HB       ILE  10  37.001  -0.916  20.920
  641   HG12  ILE  10          HG12      ILE  10  38.204   1.712  21.819
  642   HG13  ILE  10          HG11      ILE  10  36.558   1.186  22.149
  643   HG21  ILE  10          HG21      ILE  10  39.359  -1.189  21.342
  644   HG22  ILE  10          HG22      ILE  10  39.729   0.351  20.568
  645   HG23  ILE  10          HG23      ILE  10  39.159  -1.007  19.599
  646   HD11  ILE  10          HD11      ILE  10  37.595  -0.875  23.255
  647   HD12  ILE  10          HD12      ILE  10  37.783   0.653  24.116
  648   HD13  ILE  10          HD13      ILE  10  39.128  -0.008  23.187
  649    H    CYS  11           HN       CYS  11  36.294   2.852  20.645
  650    HA   CYS  11           HA       CYS  11  33.597   2.105  21.070
  651    HB2  CYS  11           HB2      CYS  11  35.008   4.771  21.012
  652    HB3  CYS  11           HB1      CYS  11  33.287   4.615  21.367
  653    HG   CYS  11           HG       CYS  11  35.530   3.969  23.294
  654    H    SER  12           HN       SER  12  35.067   4.292  18.635
  655    HA   SER  12           HA       SER  12  32.668   4.771  17.239
  656    HB2  SER  12           HB2      SER  12  34.071   5.608  15.457
  657    HB3  SER  12           HB1      SER  12  34.765   6.102  16.998
  658    HG   SER  12           HG       SER  12  35.833   4.591  15.054
  659    H    PHE  13           HN       PHE  13  35.022   2.167  17.064
  660    HA   PHE  13           HA       PHE  13  34.257   1.046  14.607
  661    HB2  PHE  13           HB2      PHE  13  36.265   0.303  15.711
  662    HB3  PHE  13           HB1      PHE  13  35.349  -0.243  17.115
  663    HD1  PHE  13           HD1      PHE  13  35.386  -0.707  13.388
  664    HD2  PHE  13           HD2      PHE  13  34.811  -2.501  17.247
  665    HE1  PHE  13           HE1      PHE  13  35.055  -2.916  12.311
  666    HE2  PHE  13           HE2      PHE  13  34.479  -4.711  16.171
  667    HZ   PHE  13           HZ       PHE  13  34.602  -4.918  13.702
  668    H    ILE  14           HN       ILE  14  33.122   0.282  17.908
  669    HA   ILE  14           HA       ILE  14  31.196  -1.630  17.063
  670    HB   ILE  14           HB       ILE  14  31.389   0.007  19.601
  671   HG12  ILE  14          HG12      ILE  14  33.221  -1.691  18.905
  672   HG13  ILE  14          HG11      ILE  14  32.530  -1.850  20.518
  673   HG21  ILE  14          HG21      ILE  14  29.128  -0.690  19.503
  674   HG22  ILE  14          HG22      ILE  14  29.918  -1.940  20.464
  675   HG23  ILE  14          HG23      ILE  14  29.542  -2.238  18.766
  676   HD11  ILE  14          HD11      ILE  14  31.348  -3.367  18.192
  677   HD12  ILE  14          HD12      ILE  14  31.246  -3.727  19.915
  678   HD13  ILE  14          HD13      ILE  14  32.759  -3.987  19.048
  679    H    LEU  15           HN       LEU  15  30.971   1.802  17.865
  680    HA   LEU  15           HA       LEU  15  28.166   2.057  17.556
  681    HB2  LEU  15           HB2      LEU  15  30.484   3.896  17.717
  682    HB3  LEU  15           HB1      LEU  15  29.042   4.536  16.930
  683    HG   LEU  15           HG       LEU  15  29.166   4.907  19.444
  684   HD11  LEU  15          HD11      LEU  15  27.054   4.882  18.017
  685   HD12  LEU  15          HD12      LEU  15  26.820   4.563  19.735
  686   HD13  LEU  15          HD13      LEU  15  26.798   3.232  18.582
  687   HD21  LEU  15          HD21      LEU  15  30.076   2.513  19.797
  688   HD22  LEU  15          HD22      LEU  15  28.401   1.986  19.628
  689   HD23  LEU  15          HD23      LEU  15  28.853   3.087  20.930
  690    H    SER  16           HN       SER  16  30.776   1.917  15.290
  691    HA   SER  16           HA       SER  16  29.332   3.042  13.067
  692    HB2  SER  16           HB2      SER  16  31.772   3.130  13.131
  693    HB3  SER  16           HB1      SER  16  31.847   1.370  13.142
  694    HG   SER  16           HG       SER  16  30.784   1.406  11.113
  695    H    ALA  17           HN       ALA  17  30.192  -0.227  14.162
  696    HA   ALA  17           HA       ALA  17  29.096  -1.656  12.008
  697    HB1  ALA  17           HB1      ALA  17  28.881  -3.522  13.721
  698    HB2  ALA  17           HB2      ALA  17  29.480  -2.373  14.916
  699    HB3  ALA  17           HB3      ALA  17  30.492  -2.827  13.545
  700    H    LEU  18           HN       LEU  18  27.623  -0.673  15.107
  701    HA   LEU  18           HA       LEU  18  25.067  -1.790  14.437
  702    HB2  LEU  18           HB2      LEU  18  25.693   0.311  16.515
  703    HB3  LEU  18           HB1      LEU  18  24.301  -0.774  16.474
  704    HG   LEU  18           HG       LEU  18  27.194  -1.623  16.769
  705   HD11  LEU  18          HD11      LEU  18  26.157  -0.522  18.766
  706   HD12  LEU  18          HD12      LEU  18  26.592  -2.210  19.039
  707   HD13  LEU  18          HD13      LEU  18  24.909  -1.769  18.748
  708   HD21  LEU  18          HD21      LEU  18  24.604  -3.196  16.687
  709   HD22  LEU  18          HD22      LEU  18  26.143  -3.866  17.229
  710   HD23  LEU  18          HD23      LEU  18  25.958  -3.322  15.563
  711    H    HIS  19           HN       HIS  19  26.705   1.187  13.820
  712    HA   HIS  19           HA       HIS  19  24.435   2.848  13.419
  713    HB2  HIS  19           HB2      HIS  19  26.417   4.040  13.677
  714    HB3  HIS  19           HB1      HIS  19  27.313   2.975  12.597
  715    HD2  HIS  19           HD2      HIS  19  27.379   3.809   9.967
  716    HE1  HIS  19           HE1      HIS  19  24.450   6.836  10.249
  717    HE2  HIS  19           HE2      HIS  19  26.170   5.759   8.722
  718    H    PHE  20           HN       PHE  20  26.480   1.010  11.162
  719    HA   PHE  20           HA       PHE  20  24.831   1.673   8.902
  720    HB2  PHE  20           HB2      PHE  20  27.383   0.473   9.348
  721    HB3  PHE  20           HB1      PHE  20  26.412  -0.629   8.372
  722    HD1  PHE  20           HD1      PHE  20  28.514   2.209   8.275
  723    HD2  PHE  20           HD2      PHE  20  25.017   0.527   6.435
  724    HE1  PHE  20           HE1      PHE  20  28.873   3.643   6.283
  725    HE2  PHE  20           HE2      PHE  20  25.374   1.960   4.443
  726    HZ   PHE  20           HZ       PHE  20  27.308   3.512   4.369
  727    H    MET  21           HN       MET  21  24.845  -0.796  11.343
  728    HA   MET  21           HA       MET  21  23.391  -2.767   9.876
  729    HB2  MET  21           HB2      MET  21  23.985  -2.272  12.771
  730    HB3  MET  21           HB1      MET  21  22.840  -3.525  12.301
  731    HG2  MET  21           HG2      MET  21  25.570  -3.351  11.035
  732    HG3  MET  21           HG1      MET  21  25.318  -4.220  12.548
  733    HE1  MET  21           HE1      MET  21  26.408  -6.144  11.218
  734    HE2  MET  21           HE2      MET  21  26.353  -5.406   9.619
  735    HE3  MET  21           HE3      MET  21  25.673  -7.013   9.864
  736    H    ALA  22           HN       ALA  22  22.356  -0.621  12.525
  737    HA   ALA  22           HA       ALA  22  19.591  -1.149  12.179
  738    HB1  ALA  22           HB1      ALA  22  19.415   1.108  13.489
  739    HB2  ALA  22           HB2      ALA  22  21.162   0.934  13.648
  740    HB3  ALA  22           HB3      ALA  22  20.090  -0.313  14.286
  741    H    TRP  23           HN       TRP  23  21.690   1.447  10.981
  742    HA   TRP  23           HA       TRP  23  19.654   3.038   9.849
  743    HB2  TRP  23           HB2      TRP  23  22.048   3.720  10.257
  744    HB3  TRP  23           HB1      TRP  23  22.487   2.784   8.827
  745    HD1  TRP  23           HD1      TRP  23  20.718   5.947   9.936
  746    HE1  TRP  23           HE1      TRP  23  20.235   7.417   7.876
  747    HE3  TRP  23           HE3      TRP  23  22.020   2.703   6.208
  748    HZ2  TRP  23           HZ2      TRP  23  20.379   7.243   5.027
  749    HZ3  TRP  23           HZ3      TRP  23  21.835   3.384   3.832
  750    HH2  TRP  23           HH2      TRP  23  21.018   5.647   3.238
  751    H    THR  24           HN       THR  24  21.552   0.345   8.542
  752    HA   THR  24           HA       THR  24  20.572   0.525   5.878
  753    HB   THR  24           HB       THR  24  21.812  -1.725   7.458
  754    HG1  THR  24           HG1      THR  24  22.732  -0.209   5.251
  755   HG21  THR  24          HG21      THR  24  20.808  -1.665   4.611
  756   HG22  THR  24          HG22      THR  24  20.452  -2.851   5.866
  757   HG23  THR  24          HG23      THR  24  22.060  -2.787   5.144
  758    H    ILE  25           HN       ILE  25  19.533  -1.339   8.718
  759    HA   ILE  25           HA       ILE  25  17.524  -2.846   7.445
  760    HB   ILE  25           HB       ILE  25  17.796  -1.897  10.303
  761   HG12  ILE  25          HG12      ILE  25  18.175  -4.663   9.132
  762   HG13  ILE  25          HG11      ILE  25  19.498  -3.504   9.256
  763   HG21  ILE  25          HG21      ILE  25  16.151  -3.815  10.719
  764   HG22  ILE  25          HG22      ILE  25  15.801  -3.757   8.991
  765   HG23  ILE  25          HG23      ILE  25  15.469  -2.354  10.006
  766   HD11  ILE  25          HD11      ILE  25  19.235  -3.373  11.665
  767   HD12  ILE  25          HD12      ILE  25  19.360  -5.074  11.213
  768   HD13  ILE  25          HD13      ILE  25  17.786  -4.377  11.600
  769    H    GLY  26           HN       GLY  26  17.415   0.313   9.057
  770    HA2  GLY  26           HA2      GLY  26  14.631   0.749   8.822
  771    HA3  GLY  26           HA1      GLY  26  15.849   2.007   9.009
  772    H    HIS  27           HN       HIS  27  17.344   1.540   6.691
  773    HA   HIS  27           HA       HIS  27  15.912   3.020   4.767
  774    HB2  HIS  27           HB2      HIS  27  18.289   3.130   4.701
  775    HB3  HIS  27           HB1      HIS  27  18.438   1.376   4.588
  776    HD2  HIS  27           HD2      HIS  27  18.314   0.365   1.996
  777    HE1  HIS  27           HE1      HIS  27  17.263   3.962   0.052
  778    HE2  HIS  27           HE2      HIS  27  17.932   1.538  -0.305
  779    H    LEU  28           HN       LEU  28  16.577  -0.452   5.051
  780    HA   LEU  28           HA       LEU  28  15.284  -1.098   2.571
  781    HB2  LEU  28           HB2      LEU  28  17.064  -2.405   4.141
  782    HB3  LEU  28           HB1      LEU  28  15.570  -3.202   4.629
  783    HG   LEU  28           HG       LEU  28  16.431  -4.455   2.780
  784   HD11  LEU  28          HD11      LEU  28  14.390  -2.638   1.490
  785   HD12  LEU  28          HD12      LEU  28  13.950  -3.760   2.777
  786   HD13  LEU  28          HD13      LEU  28  14.616  -4.371   1.263
  787   HD21  LEU  28          HD21      LEU  28  17.926  -2.526   2.016
  788   HD22  LEU  28          HD22      LEU  28  16.528  -1.914   1.134
  789   HD23  LEU  28          HD23      LEU  28  17.202  -3.491   0.732
  790    H    ASN  29           HN       ASN  29  13.166  -1.076   2.252
  791    HA   ASN  29           HA       ASN  29  11.386  -1.706   4.532
  792    HB2  ASN  29           HB2      ASN  29  10.895   0.189   2.222
  793    HB3  ASN  29           HB1      ASN  29   9.720  -0.218   3.472
  794   HD21  ASN  29          HD21      ASN  29  11.191   2.414   2.811
  795   HD22  ASN  29          HD22      ASN  29  11.860   2.885   4.298
  796    H    GLN  30           HN       GLN  30  10.178  -3.463   4.273
  797    HA   GLN  30           HA       GLN  30   9.639  -4.408   1.520
  798    HB2  GLN  30           HB2      GLN  30  10.225  -6.042   4.001
  799    HB3  GLN  30           HB1      GLN  30   9.687  -6.716   2.462
  800    HG2  GLN  30           HG2      GLN  30  11.664  -5.781   1.342
  801    HG3  GLN  30           HG1      GLN  30  12.200  -5.068   2.862
  802   HE21  GLN  30          HE21      GLN  30  14.063  -6.318   3.304
  803   HE22  GLN  30          HE22      GLN  30  14.046  -8.008   3.456
  804    H    ILE  31           HN       ILE  31   7.559  -4.718   1.022
  805    HA   ILE  31           HA       ILE  31   5.606  -5.010   3.213
  806    HB   ILE  31           HB       ILE  31   4.074  -3.489   2.010
  807   HG12  ILE  31          HG12      ILE  31   6.467  -2.805   0.280
  808   HG13  ILE  31          HG11      ILE  31   5.183  -3.893  -0.246
  809   HG21  ILE  31          HG21      ILE  31   5.567  -2.633   3.801
  810   HG22  ILE  31          HG22      ILE  31   5.240  -1.407   2.576
  811   HG23  ILE  31          HG23      ILE  31   6.785  -2.256   2.584
  812   HD11  ILE  31          HD11      ILE  31   4.634  -1.698  -1.071
  813   HD12  ILE  31          HD12      ILE  31   4.911  -0.975   0.513
  814   HD13  ILE  31          HD13      ILE  31   3.532  -2.046   0.261
  815    H    LYS  32           HN       LYS  32   3.669  -6.109   2.641
  816    HA   LYS  32           HA       LYS  32   4.004  -7.873   0.304
  817    HB2  LYS  32           HB2      LYS  32   2.931  -8.217   3.010
  818    HB3  LYS  32           HB1      LYS  32   1.889  -8.882   1.750
  819    HG2  LYS  32           HG2      LYS  32   4.839  -9.420   1.636
  820    HG3  LYS  32           HG1      LYS  32   3.838 -10.351   2.752
  821    HD2  LYS  32           HD2      LYS  32   2.509 -11.236   1.002
  822    HD3  LYS  32           HD1      LYS  32   3.074 -10.026  -0.150
  823    HE2  LYS  32           HE2      LYS  32   4.168 -12.170  -0.602
  824    HE3  LYS  32           HE1      LYS  32   5.358 -11.004  -0.022
  825    HZ1  LYS  32           HZ1      LYS  32   5.219 -11.947   2.166
  826    HZ2  LYS  32           HZ2      LYS  32   5.550 -13.188   1.053
  827    HZ3  LYS  32           HZ3      LYS  32   3.984 -13.006   1.686
  828    H    ARG  33           HN       ARG  33   2.692  -7.698  -1.402
  829    HA   ARG  33           HA       ARG  33   0.460  -5.794  -1.248
  830    HB2  ARG  33           HB2      ARG  33   1.587  -7.120  -3.717
  831    HB3  ARG  33           HB1      ARG  33   0.585  -5.670  -3.629
  832    HG2  ARG  33           HG2      ARG  33   2.447  -4.609  -2.259
  833    HG3  ARG  33           HG1      ARG  33   3.445  -5.996  -2.699
  834    HD2  ARG  33           HD2      ARG  33   3.929  -4.308  -4.318
  835    HD3  ARG  33           HD1      ARG  33   2.886  -5.474  -5.127
  836    HE   ARG  33           HE       ARG  33   1.370  -3.358  -3.932
  837   HH11  ARG  33          HH11      ARG  33   3.365  -4.199  -6.661
  838   HH12  ARG  33          HH12      ARG  33   2.631  -3.036  -7.709
  839   HH21  ARG  33          HH21      ARG  33   0.431  -1.842  -5.320
  840   HH22  ARG  33          HH22      ARG  33   0.981  -1.708  -6.958
  841    H1   MET   1           HT1      MET   1  57.251   3.403   1.687
  842    H2   MET   1           HT2      MET   1  57.255   5.067   1.343
  843    H3   MET   1           HT3      MET   1  56.563   3.970   0.245
  844    HA   MET   1           HA       MET   1  55.306   3.563   2.693
  845    HB2  MET   1           HB2      MET   1  55.805   6.435   1.961
  846    HB3  MET   1           HB1      MET   1  54.280   5.979   2.724
  847    HG2  MET   1           HG2      MET   1  55.517   4.938   4.587
  848    HG3  MET   1           HG1      MET   1  57.044   5.387   3.827
  849    HE1  MET   1           HE1      MET   1  53.938   8.001   5.891
  850    HE2  MET   1           HE2      MET   1  53.894   6.279   5.526
  851    HE3  MET   1           HE3      MET   1  53.569   7.450   4.251
  852    H    PHE   2           HN       PHE   2  54.335   2.176   1.119
  853    HA   PHE   2           HA       PHE   2  53.083   3.082  -1.245
  854    HB2  PHE   2           HB2      PHE   2  52.820   0.643   0.478
  855    HB3  PHE   2           HB1      PHE   2  51.650   0.928  -0.811
  856    HD1  PHE   2           HD1      PHE   2  55.062  -0.043  -0.007
  857    HD2  PHE   2           HD2      PHE   2  52.438   1.195  -3.173
  858    HE1  PHE   2           HE1      PHE   2  56.689  -0.877  -1.682
  859    HE2  PHE   2           HE2      PHE   2  54.064   0.362  -4.849
  860    HZ   PHE   2           HZ       PHE   2  56.190  -0.674  -4.103
  861    H    GLU   3           HN       GLU   3  51.873   2.645   2.064
  862    HA   GLU   3           HA       GLU   3  49.188   3.355   1.398
  863    HB2  GLU   3           HB2      GLU   3  48.805   3.378   3.805
  864    HB3  GLU   3           HB1      GLU   3  49.772   1.969   3.366
  865    HG2  GLU   3           HG2      GLU   3  51.830   3.215   3.981
  866    HG3  GLU   3           HG1      GLU   3  50.835   4.582   4.478
  867    HA   PRO   4           HA       PRO   4  49.578   7.762   1.534
  868    HB2  PRO   4           HB2      PRO   4  47.049   8.492   2.235
  869    HB3  PRO   4           HB1      PRO   4  47.461   7.846   0.635
  870    HG2  PRO   4           HG2      PRO   4  46.160   6.506   2.941
  871    HG3  PRO   4           HG1      PRO   4  45.880   6.301   1.204
  872    HD2  PRO   4           HD2      PRO   4  47.377   4.560   2.772
  873    HD3  PRO   4           HD1      PRO   4  47.517   4.702   1.007
  874    H    PHE   5           HN       PHE   5  47.947   6.304   4.328
  875    HA   PHE   5           HA       PHE   5  49.535   7.964   6.132
  876    HB2  PHE   5           HB2      PHE   5  46.760   8.495   5.549
  877    HB3  PHE   5           HB1      PHE   5  46.941   8.024   7.238
  878    HD1  PHE   5           HD1      PHE   5  47.555  10.601   4.763
  879    HD2  PHE   5           HD2      PHE   5  48.608   9.227   8.695
  880    HE1  PHE   5           HE1      PHE   5  48.482  12.839   5.296
  881    HE2  PHE   5           HE2      PHE   5  49.535  11.465   9.227
  882    HZ   PHE   5           HZ       PHE   5  49.472  13.271   7.528
  883    H    GLN   6           HN       GLN   6  46.566   6.052   6.617
  884    HA   GLN   6           HA       GLN   6  48.106   3.907   7.872
  885    HB2  GLN   6           HB2      GLN   6  46.169   5.714   9.305
  886    HB3  GLN   6           HB1      GLN   6  46.428   4.054   9.842
  887    HG2  GLN   6           HG2      GLN   6  48.650   6.075   9.447
  888    HG3  GLN   6           HG1      GLN   6  47.904   5.717  11.001
  889   HE21  GLN   6          HE21      GLN   6  48.137   3.446  11.817
  890   HE22  GLN   6          HE22      GLN   6  49.463   2.517  11.312
  891    H    ILE   7           HN       ILE   7  46.720   2.042   8.406
  892    HA   ILE   7           HA       ILE   7  45.061   1.298   6.274
  893    HB   ILE   7           HB       ILE   7  44.411  -0.617   7.722
  894   HG12  ILE   7          HG12      ILE   7  46.073   0.861   9.793
  895   HG13  ILE   7          HG11      ILE   7  44.329   0.615   9.864
  896   HG21  ILE   7          HG21      ILE   7  47.366   0.026   7.917
  897   HG22  ILE   7          HG22      ILE   7  46.582  -0.505   6.428
  898   HG23  ILE   7          HG23      ILE   7  46.623  -1.571   7.832
  899   HD11  ILE   7          HD11      ILE   7  45.304  -1.094  11.232
  900   HD12  ILE   7          HD12      ILE   7  46.491  -1.494   9.991
  901   HD13  ILE   7          HD13      ILE   7  44.788  -1.881   9.741
  902    H    LEU   8           HN       LEU   8  44.349   2.813   9.337
  903    HA   LEU   8           HA       LEU   8  41.503   2.470   9.229
  904    HB2  LEU   8           HB2      LEU   8  43.295   4.318  10.816
  905    HB3  LEU   8           HB1      LEU   8  41.541   4.279  11.005
  906    HG   LEU   8           HG       LEU   8  43.169   1.747  11.189
  907   HD11  LEU   8          HD11      LEU   8  42.599   3.766  13.376
  908   HD12  LEU   8          HD12      LEU   8  44.181   3.210  12.829
  909   HD13  LEU   8          HD13      LEU   8  43.106   2.105  13.685
  910   HD21  LEU   8          HD21      LEU   8  40.590   2.556  12.556
  911   HD22  LEU   8          HD22      LEU   8  41.254   0.931  12.384
  912   HD23  LEU   8          HD23      LEU   8  40.624   1.780  10.974
  913    H    SER   9           HN       SER   9  43.767   4.850   8.066
  914    HA   SER   9           HA       SER   9  41.838   6.891   7.468
  915    HB2  SER   9           HB2      SER   9  44.223   7.414   7.815
  916    HB3  SER   9           HB1      SER   9  44.630   6.491   6.371
  917    HG   SER   9           HG       SER   9  42.954   8.780   6.527
  918    H    ILE  10           HN       ILE  10  43.426   4.327   5.593
  919    HA   ILE  10           HA       ILE  10  42.249   5.100   3.101
  920    HB   ILE  10           HB       ILE  10  43.085   2.934   2.286
  921   HG12  ILE  10          HG12      ILE  10  43.766   2.462   5.197
  922   HG13  ILE  10          HG11      ILE  10  42.534   1.593   4.291
  923   HG21  ILE  10          HG21      ILE  10  45.428   3.359   2.662
  924   HG22  ILE  10          HG22      ILE  10  45.087   4.185   4.183
  925   HG23  ILE  10          HG23      ILE  10  44.612   4.922   2.654
  926   HD11  ILE  10          HD11      ILE  10  44.395   0.947   2.660
  927   HD12  ILE  10          HD12      ILE  10  44.444   0.180   4.248
  928   HD13  ILE  10          HD13      ILE  10  45.523   1.527   3.884
  929    H    CYS  11           HN       CYS  11  41.333   2.887   5.717
  930    HA   CYS  11           HA       CYS  11  39.252   1.568   4.324
  931    HB2  CYS  11           HB2      CYS  11  39.785   2.065   7.252
  932    HB3  CYS  11           HB1      CYS  11  38.395   1.140   6.685
  933    HG   CYS  11           HG       CYS  11  41.244   0.120   6.791
  934    H    SER  12           HN       SER  12  39.160   4.319   6.630
  935    HA   SER  12           HA       SER  12  36.403   4.797   6.355
  936    HB2  SER  12           HB2      SER  12  36.842   6.938   7.385
  937    HB3  SER  12           HB1      SER  12  37.856   5.725   8.159
  938    HG   SER  12           HG       SER  12  38.570   7.943   6.829
  939    H    PHE  13           HN       PHE  13  39.169   5.816   4.442
  940    HA   PHE  13           HA       PHE  13  37.953   7.876   2.973
  941    HB2  PHE  13           HB2      PHE  13  40.338   7.546   2.863
  942    HB3  PHE  13           HB1      PHE  13  40.130   5.921   2.210
  943    HD1  PHE  13           HD1      PHE  13  39.032   9.440   1.483
  944    HD2  PHE  13           HD2      PHE  13  40.300   5.650  -0.094
  945    HE1  PHE  13           HE1      PHE  13  38.964  10.373  -0.814
  946    HE2  PHE  13           HE2      PHE  13  40.231   6.583  -2.390
  947    HZ   PHE  13           HZ       PHE  13  39.564   8.945  -2.750
  948    H    ILE  14           HN       ILE  14  38.246   4.396   2.206
  949    HA   ILE  14           HA       ILE  14  36.742   4.558  -0.201
  950    HB   ILE  14           HB       ILE  14  37.328   2.217   1.623
  951   HG12  ILE  14          HG12      ILE  14  39.205   3.531   0.406
  952   HG13  ILE  14          HG11      ILE  14  39.168   1.781   0.200
  953   HG21  ILE  14          HG21      ILE  14  35.445   1.538   0.360
  954   HG22  ILE  14          HG22      ILE  14  36.817   0.932  -0.565
  955   HG23  ILE  14          HG23      ILE  14  35.986   2.400  -1.081
  956   HD11  ILE  14          HD11      ILE  14  37.725   3.579  -1.747
  957   HD12  ILE  14          HD12      ILE  14  38.311   1.934  -1.986
  958   HD13  ILE  14          HD13      ILE  14  39.453   3.274  -1.914
  959    H    LEU  15           HN       LEU  15  35.880   3.664   3.112
  960    HA   LEU  15           HA       LEU  15  33.180   2.986   2.602
  961    HB2  LEU  15           HB2      LEU  15  34.829   3.607   4.986
  962    HB3  LEU  15           HB1      LEU  15  33.091   3.836   5.169
  963    HG   LEU  15           HG       LEU  15  33.950   1.515   5.755
  964   HD11  LEU  15          HD11      LEU  15  31.572   2.122   5.075
  965   HD12  LEU  15          HD12      LEU  15  32.026   0.435   4.839
  966   HD13  LEU  15          HD13      LEU  15  31.975   1.534   3.463
  967   HD21  LEU  15          HD21      LEU  15  35.535   1.537   3.712
  968   HD22  LEU  15          HD22      LEU  15  34.109   1.124   2.759
  969   HD23  LEU  15          HD23      LEU  15  34.660   0.042   4.037
  970    H    SER  16           HN       SER  16  34.806   6.019   2.976
  971    HA   SER  16           HA       SER  16  32.451   7.585   3.502
  972    HB2  SER  16           HB2      SER  16  34.650   8.366   4.223
  973    HB3  SER  16           HB1      SER  16  35.196   8.411   2.550
  974    HG   SER  16           HG       SER  16  33.547   9.947   2.149
  975    H    ALA  17           HN       ALA  17  34.480   6.911   0.664
  976    HA   ALA  17           HA       ALA  17  33.148   8.576  -1.163
  977    HB1  ALA  17           HB1      ALA  17  34.034   6.928  -2.884
  978    HB2  ALA  17           HB2      ALA  17  34.668   5.992  -1.530
  979    HB3  ALA  17           HB3      ALA  17  35.242   7.636  -1.811
  980    H    LEU  18           HN       LEU  18  32.596   5.140  -0.354
  981    HA   LEU  18           HA       LEU  18  30.367   4.908  -2.143
  982    HB2  LEU  18           HB2      LEU  18  31.064   3.141   0.204
  983    HB3  LEU  18           HB1      LEU  18  30.088   2.716  -1.203
  984    HG   LEU  18           HG       LEU  18  33.026   3.453  -1.249
  985   HD11  LEU  18          HD11      LEU  18  32.468   1.202  -0.299
  986   HD12  LEU  18          HD12      LEU  18  33.404   1.125  -1.791
  987   HD13  LEU  18          HD13      LEU  18  31.670   0.809  -1.822
  988   HD21  LEU  18          HD21      LEU  18  31.087   2.658  -3.439
  989   HD22  LEU  18          HD22      LEU  18  32.838   2.693  -3.643
  990   HD23  LEU  18          HD23      LEU  18  31.964   4.183  -3.299
  991    H    HIS  19           HN       HIS  19  30.837   5.999   1.100
  992    HA   HIS  19           HA       HIS  19  28.207   5.567   2.080
  993    HB2  HIS  19           HB2      HIS  19  29.762   5.991   3.759
  994    HB3  HIS  19           HB1      HIS  19  30.491   7.331   2.880
  995    HD2  HIS  19           HD2      HIS  19  29.441   9.808   3.492
  996    HE1  HIS  19           HE1      HIS  19  26.079   8.482   5.676
  997    HE2  HIS  19           HE2      HIS  19  27.406  10.527   4.962
  998    H    PHE  20           HN       PHE  20  29.788   8.427   0.671
  999    HA   PHE  20           HA       PHE  20  27.359   9.963   0.698
 1000    HB2  PHE  20           HB2      PHE  20  30.134  10.451   0.234
 1001    HB3  PHE  20           HB1      PHE  20  29.226  11.049  -1.154
 1002    HD1  PHE  20           HD1      PHE  20  30.322  11.821   2.119
 1003    HD2  PHE  20           HD2      PHE  20  27.001  12.363  -0.551
 1004    HE1  PHE  20           HE1      PHE  20  29.572  13.777   3.448
 1005    HE2  PHE  20           HE2      PHE  20  26.252  14.319   0.777
 1006    HZ   PHE  20           HZ       PHE  20  27.534  15.024   2.783
 1007    H    MET  21           HN       MET  21  28.857   7.716  -1.485
 1008    HA   MET  21           HA       MET  21  27.583   8.624  -3.874
 1009    HB2  MET  21           HB2      MET  21  28.960   6.105  -3.016
 1010    HB3  MET  21           HB1      MET  21  28.106   6.170  -4.555
 1011    HG2  MET  21           HG2      MET  21  30.097   8.299  -3.782
 1012    HG3  MET  21           HG1      MET  21  30.613   6.806  -4.566
 1013    HE1  MET  21           HE1      MET  21  31.666   8.465  -6.242
 1014    HE2  MET  21           HE2      MET  21  30.878   9.931  -5.668
 1015    HE3  MET  21           HE3      MET  21  30.778   9.497  -7.372
 1016    H    ALA  22           HN       ALA  22  26.961   5.741  -1.868
 1017    HA   ALA  22           HA       ALA  22  24.495   5.124  -3.118
 1018    HB1  ALA  22           HB1      ALA  22  24.169   3.795  -0.889
 1019    HB2  ALA  22           HB2      ALA  22  25.847   4.253  -0.593
 1020    HB3  ALA  22           HB3      ALA  22  25.430   3.306  -2.021
 1021    H    TRP  23           HN       TRP  23  25.286   6.933  -0.170
 1022    HA   TRP  23           HA       TRP  23  22.638   7.261   0.748
 1023    HB2  TRP  23           HB2      TRP  23  24.752   7.699   2.054
 1024    HB3  TRP  23           HB1      TRP  23  24.916   9.207   1.153
 1025    HD1  TRP  23           HD1      TRP  23  22.843   7.500   3.829
 1026    HE1  TRP  23           HE1      TRP  23  21.318   9.241   4.960
 1027    HE3  TRP  23           HE3      TRP  23  23.634  11.502   0.752
 1028    HZ2  TRP  23           HZ2      TRP  23  20.535  11.966   4.610
 1029    HZ3  TRP  23           HZ3      TRP  23  22.484  13.657   1.175
 1030    HH2  TRP  23           HH2      TRP  23  20.936  13.894   3.098
 1031    H    THR  24           HN       THR  24  24.637   9.193  -1.452
 1032    HA   THR  24           HA       THR  24  22.806  11.347  -1.747
 1033    HB   THR  24           HB       THR  24  25.062  10.329  -3.468
 1034    HG1  THR  24           HG1      THR  24  24.742  12.694  -1.946
 1035   HG21  THR  24          HG21      THR  24  23.181  12.653  -3.893
 1036   HG22  THR  24          HG22      THR  24  23.604  11.372  -5.029
 1037   HG23  THR  24          HG23      THR  24  24.793  12.605  -4.607
 1038    H    ILE  25           HN       ILE  25  23.329   8.354  -3.587
 1039    HA   ILE  25           HA       ILE  25  21.492   8.879  -5.656
 1040    HB   ILE  25           HB       ILE  25  22.444   6.276  -4.448
 1041   HG12  ILE  25          HG12      ILE  25  23.138   7.550  -7.105
 1042   HG13  ILE  25          HG11      ILE  25  24.061   7.872  -5.638
 1043   HG21  ILE  25          HG21      ILE  25  21.617   5.349  -6.687
 1044   HG22  ILE  25          HG22      ILE  25  20.704   6.848  -6.857
 1045   HG23  ILE  25          HG23      ILE  25  20.368   5.758  -5.511
 1046   HD11  ILE  25          HD11      ILE  25  24.601   5.521  -5.391
 1047   HD12  ILE  25          HD12      ILE  25  25.016   6.014  -7.033
 1048   HD13  ILE  25          HD13      ILE  25  23.541   5.095  -6.735
 1049    H    GLY  26           HN       GLY  26  21.085   7.272  -2.515
 1050    HA2  GLY  26           HA2      GLY  26  18.379   6.527  -2.834
 1051    HA3  GLY  26           HA1      GLY  26  19.201   6.753  -1.293
 1052    H    HIS  27           HN       HIS  27  19.893   9.452  -1.529
 1053    HA   HIS  27           HA       HIS  27  17.553  10.736  -0.632
 1054    HB2  HIS  27           HB2      HIS  27  19.646  11.618   0.083
 1055    HB3  HIS  27           HB1      HIS  27  20.215  11.804  -1.576
 1056    HD2  HIS  27           HD2      HIS  27  19.502  14.210  -2.785
 1057    HE1  HIS  27           HE1      HIS  27  16.930  15.612   0.256
 1058    HE2  HIS  27           HE2      HIS  27  18.065  16.218  -1.933
 1059    H    LEU  28           HN       LEU  28  19.188  10.764  -3.779
 1060    HA   LEU  28           HA       LEU  28  17.356  12.649  -4.931
 1061    HB2  LEU  28           HB2      LEU  28  19.844  11.813  -5.607
 1062    HB3  LEU  28           HB1      LEU  28  18.876  10.852  -6.723
 1063    HG   LEU  28           HG       LEU  28  19.367  12.907  -7.851
 1064   HD11  LEU  28          HD11      LEU  28  16.601  13.381  -6.728
 1065   HD12  LEU  28          HD12      LEU  28  16.940  12.039  -7.822
 1066   HD13  LEU  28          HD13      LEU  28  17.195  13.699  -8.358
 1067   HD21  LEU  28          HD21      LEU  28  19.938  14.107  -5.665
 1068   HD22  LEU  28          HD22      LEU  28  18.214  14.442  -5.507
 1069   HD23  LEU  28          HD23      LEU  28  19.112  15.078  -6.883
 1070    H    ASN  29           HN       ASN  29  15.335  12.217  -5.484
 1071    HA   ASN  29           HA       ASN  29  14.666   9.472  -6.370
 1072    HB2  ASN  29           HB2      ASN  29  12.934  11.439  -4.853
 1073    HB3  ASN  29           HB1      ASN  29  12.406   9.866  -5.451
 1074   HD21  ASN  29          HD21      ASN  29  12.801  10.951  -2.589
 1075   HD22  ASN  29          HD22      ASN  29  13.780   9.780  -1.846
 1076    H    GLN  30           HN       GLN  30  13.961   9.328  -8.395
 1077    HA   GLN  30           HA       GLN  30  12.802  11.738  -9.660
 1078    HB2  GLN  30           HB2      GLN  30  14.609   9.641 -10.887
 1079    HB3  GLN  30           HB1      GLN  30  13.784  10.908 -11.797
 1080    HG2  GLN  30           HG2      GLN  30  14.936  12.630 -10.475
 1081    HG3  GLN  30           HG1      GLN  30  15.741  11.378  -9.529
 1082   HE21  GLN  30          HE21      GLN  30  17.908  11.625 -10.215
 1083   HE22  GLN  30          HE22      GLN  30  18.401  11.504 -11.836
 1084    H    ILE  31           HN       ILE  31  10.841  11.492 -10.531
 1085    HA   ILE  31           HA       ILE  31   9.896   8.766 -11.146
 1086    HB   ILE  31           HB       ILE  31   7.699   9.340 -10.172
 1087   HG12  ILE  31          HG12      ILE  31   9.089  11.779  -9.031
 1088   HG13  ILE  31          HG11      ILE  31   8.047  11.848 -10.451
 1089   HG21  ILE  31          HG21      ILE  31   9.418   8.162  -8.822
 1090   HG22  ILE  31          HG22      ILE  31   8.380   9.179  -7.822
 1091   HG23  ILE  31          HG23      ILE  31  10.006   9.720  -8.239
 1092   HD11  ILE  31          HD11      ILE  31   6.681  12.395  -8.545
 1093   HD12  ILE  31          HD12      ILE  31   7.270  10.993  -7.652
 1094   HD13  ILE  31          HD13      ILE  31   6.232  10.769  -9.060
 1095    H    LYS  32           HN       LYS  32   8.250   8.653 -12.749
 1096    HA   LYS  32           HA       LYS  32   8.240  10.990 -14.544
 1097    HB2  LYS  32           HB2      LYS  32   8.278   8.086 -14.942
 1098    HB3  LYS  32           HB1      LYS  32   7.093   8.919 -15.949
 1099    HG2  LYS  32           HG2      LYS  32   9.860  10.056 -15.713
 1100    HG3  LYS  32           HG1      LYS  32   9.585   8.678 -16.780
 1101    HD2  LYS  32           HD2      LYS  32   8.035   9.875 -18.114
 1102    HD3  LYS  32           HD1      LYS  32   7.830  11.131 -16.894
 1103    HE2  LYS  32           HE2      LYS  32   9.242  11.969 -18.709
 1104    HE3  LYS  32           HE1      LYS  32  10.197  11.815 -17.235
 1105    HZ1  LYS  32           HZ1      LYS  32  11.061   9.730 -18.010
 1106    HZ2  LYS  32           HZ2      LYS  32  11.321  10.910 -19.205
 1107    HZ3  LYS  32           HZ3      LYS  32  10.071   9.774 -19.387
 1108    H    ARG  33           HN       ARG  33   6.436  12.135 -14.847
 1109    HA   ARG  33           HA       ARG  33   3.961  11.187 -13.578
 1110    HB2  ARG  33           HB2      ARG  33   4.501  13.915 -14.759
 1111    HB3  ARG  33           HB1      ARG  33   3.238  13.462 -13.613
 1112    HG2  ARG  33           HG2      ARG  33   5.095  12.804 -12.004
 1113    HG3  ARG  33           HG1      ARG  33   6.219  13.583 -13.117
 1114    HD2  ARG  33           HD2      ARG  33   5.656  15.242 -11.493
 1115    HD3  ARG  33           HD1      ARG  33   4.757  15.661 -12.948
 1116    HE   ARG  33           HE       ARG  33   3.221  13.980 -11.211
 1117   HH11  ARG  33          HH11      ARG  33   4.329  17.244 -11.715
 1118   HH12  ARG  33          HH12      ARG  33   3.002  17.954 -10.865
 1119   HH21  ARG  33          HH21      ARG  33   1.498  14.934 -10.101
 1120   HH22  ARG  33          HH22      ARG  33   1.407  16.657  -9.957
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1  52.059  25.672  11.026
    2    H2   MET   1           HT2      MET   1  52.212  26.990   9.965
    3    H3   MET   1           HT3      MET   1  50.826  26.007   9.910
    4    HA   MET   1           HA       MET   1  50.625  26.735  12.408
    5    HB2  MET   1           HB2      MET   1  52.681  28.447  11.258
    6    HB3  MET   1           HB1      MET   1  51.318  29.387  11.866
    7    HG2  MET   1           HG2      MET   1  51.467  28.086  14.012
    8    HG3  MET   1           HG1      MET   1  52.944  27.341  13.400
    9    HE1  MET   1           HE1      MET   1  55.013  28.233  13.094
   10    HE2  MET   1           HE2      MET   1  55.603  29.864  13.401
   11    HE3  MET   1           HE3      MET   1  54.655  29.537  11.953
   12    H    PHE   2           HN       PHE   2  50.381  27.761   9.086
   13    HA   PHE   2           HA       PHE   2  48.208  29.552   9.330
   14    HB2  PHE   2           HB2      PHE   2  49.058  27.783   7.026
   15    HB3  PHE   2           HB1      PHE   2  47.842  29.056   6.912
   16    HD1  PHE   2           HD1      PHE   2  51.400  28.293   7.127
   17    HD2  PHE   2           HD2      PHE   2  48.479  31.437   7.300
   18    HE1  PHE   2           HE1      PHE   2  53.193  29.975   6.816
   19    HE2  PHE   2           HE2      PHE   2  50.273  33.121   6.988
   20    HZ   PHE   2           HZ       PHE   2  52.631  32.391   6.746
   21    H    GLU   3           HN       GLU   3  48.384  26.043   8.917
   22    HA   GLU   3           HA       GLU   3  45.490  25.836   8.800
   23    HB2  GLU   3           HB2      GLU   3  47.654  23.725   8.776
   24    HB3  GLU   3           HB1      GLU   3  45.931  23.385   8.620
   25    HG2  GLU   3           HG2      GLU   3  46.670  23.500   6.385
   26    HG3  GLU   3           HG1      GLU   3  45.976  25.094   6.673
   27    HA   PRO   4           HA       PRO   4  44.914  25.133  13.125
   28    HB2  PRO   4           HB2      PRO   4  42.770  23.432  13.116
   29    HB3  PRO   4           HB1      PRO   4  42.643  25.164  12.754
   30    HG2  PRO   4           HG2      PRO   4  42.697  22.840  10.899
   31    HG3  PRO   4           HG1      PRO   4  41.753  24.338  10.812
   32    HD2  PRO   4           HD2      PRO   4  44.018  23.902   9.322
   33    HD3  PRO   4           HD1      PRO   4  43.466  25.519   9.814
   34    H    PHE   5           HN       PHE   5  44.693  22.142  11.190
   35    HA   PHE   5           HA       PHE   5  46.472  20.813  13.120
   36    HB2  PHE   5           HB2      PHE   5  43.679  20.025  12.420
   37    HB3  PHE   5           HB1      PHE   5  44.872  18.745  12.641
   38    HD1  PHE   5           HD1      PHE   5  43.417  21.771  14.272
   39    HD2  PHE   5           HD2      PHE   5  45.573  18.095  14.801
   40    HE1  PHE   5           HE1      PHE   5  43.237  22.020  16.733
   41    HE2  PHE   5           HE2      PHE   5  45.393  18.343  17.262
   42    HZ   PHE   5           HZ       PHE   5  44.228  20.305  18.227
   43    H    GLN   6           HN       GLN   6  44.552  19.834  10.283
   44    HA   GLN   6           HA       GLN   6  46.883  19.645   8.604
   45    HB2  GLN   6           HB2      GLN   6  46.507  17.152   8.206
   46    HB3  GLN   6           HB1      GLN   6  47.295  17.592   9.722
   47    HG2  GLN   6           HG2      GLN   6  45.187  17.391  10.926
   48    HG3  GLN   6           HG1      GLN   6  44.325  17.075   9.425
   49   HE21  GLN   6          HE21      GLN   6  45.641  15.513  12.067
   50   HE22  GLN   6          HE22      GLN   6  45.911  13.988  11.370
   51    H    ILE   7           HN       ILE   7  46.314  18.792   6.442
   52    HA   ILE   7           HA       ILE   7  44.131  20.080   5.330
   53    HB   ILE   7           HB       ILE   7  44.445  18.528   3.377
   54   HG12  ILE   7          HG12      ILE   7  46.852  17.274   4.036
   55   HG13  ILE   7          HG11      ILE   7  45.832  16.979   5.439
   56   HG21  ILE   7          HG21      ILE   7  46.718  19.315   2.881
   57   HG22  ILE   7          HG22      ILE   7  46.974  19.684   4.587
   58   HG23  ILE   7          HG23      ILE   7  45.780  20.591   3.657
   59   HD11  ILE   7          HD11      ILE   7  44.005  16.287   3.771
   60   HD12  ILE   7          HD12      ILE   7  45.366  15.181   3.960
   61   HD13  ILE   7          HD13      ILE   7  45.287  16.251   2.561
   62    H    LEU   8           HN       LEU   8  44.353  16.820   6.651
   63    HA   LEU   8           HA       LEU   8  41.863  15.864   5.716
   64    HB2  LEU   8           HB2      LEU   8  43.867  14.593   6.795
   65    HB3  LEU   8           HB1      LEU   8  43.078  14.988   8.321
   66    HG   LEU   8           HG       LEU   8  41.265  13.924   6.248
   67   HD11  LEU   8          HD11      LEU   8  43.331  12.119   7.545
   68   HD12  LEU   8          HD12      LEU   8  43.336  12.587   5.844
   69   HD13  LEU   8          HD13      LEU   8  42.015  11.612   6.486
   70   HD21  LEU   8          HD21      LEU   8  40.306  12.802   8.136
   71   HD22  LEU   8          HD22      LEU   8  40.775  14.402   8.710
   72   HD23  LEU   8          HD23      LEU   8  41.777  13.001   9.087
   73    H    SER   9           HN       SER   9  42.814  17.746   8.506
   74    HA   SER   9           HA       SER   9  40.332  17.531   9.912
   75    HB2  SER   9           HB2      SER   9  42.635  19.473  10.123
   76    HB3  SER   9           HB1      SER   9  41.221  19.538  11.171
   77    HG   SER   9           HG       SER   9  43.365  17.936  11.311
   78    H    ILE  10           HN       ILE  10  41.716  19.870   7.642
   79    HA   ILE  10           HA       ILE  10  39.689  21.824   7.832
   80    HB   ILE  10           HB       ILE  10  41.563  21.078   5.581
   81   HG12  ILE  10          HG12      ILE  10  41.557  23.523   7.363
   82   HG13  ILE  10          HG11      ILE  10  42.413  22.045   7.803
   83   HG21  ILE  10          HG21      ILE  10  39.678  22.148   4.541
   84   HG22  ILE  10          HG22      ILE  10  40.938  23.372   4.697
   85   HG23  ILE  10          HG23      ILE  10  39.582  23.356   5.824
   86   HD11  ILE  10          HD11      ILE  10  43.777  22.167   5.807
   87   HD12  ILE  10          HD12      ILE  10  43.851  23.734   6.611
   88   HD13  ILE  10          HD13      ILE  10  42.831  23.520   5.188
   89    H    CYS  11           HN       CYS  11  40.086  19.091   5.570
   90    HA   CYS  11           HA       CYS  11  37.716  19.560   4.106
   91    HB2  CYS  11           HB2      CYS  11  39.301  17.037   4.608
   92    HB3  CYS  11           HB1      CYS  11  37.921  17.111   3.511
   93    HG   CYS  11           HG       CYS  11  39.588  19.291   2.575
   94    H    SER  12           HN       SER  12  38.345  17.312   6.802
   95    HA   SER  12           HA       SER  12  35.811  16.239   7.054
   96    HB2  SER  12           HB2      SER  12  37.773  15.454   8.332
   97    HB3  SER  12           HB1      SER  12  37.723  16.922   9.304
   98    HG   SER  12           HG       SER  12  36.587  15.390  10.414
   99    H    PHE  13           HN       PHE  13  37.092  19.224   8.482
  100    HA   PHE  13           HA       PHE  13  34.877  19.916  10.036
  101    HB2  PHE  13           HB2      PHE  13  36.919  21.129  10.318
  102    HB3  PHE  13           HB1      PHE  13  36.939  21.615   8.623
  103    HD1  PHE  13           HD1      PHE  13  35.093  22.006  11.836
  104    HD2  PHE  13           HD2      PHE  13  35.726  23.512   7.863
  105    HE1  PHE  13           HE1      PHE  13  33.760  24.024  12.388
  106    HE2  PHE  13           HE2      PHE  13  34.394  25.529   8.415
  107    HZ   PHE  13           HZ       PHE  13  33.412  25.785  10.677
  108    H    ILE  14           HN       ILE  14  35.648  20.812   6.669
  109    HA   ILE  14           HA       ILE  14  33.334  22.368   6.234
  110    HB   ILE  14           HB       ILE  14  35.065  20.831   4.284
  111   HG12  ILE  14          HG12      ILE  14  36.059  22.715   5.726
  112   HG13  ILE  14          HG11      ILE  14  36.254  22.869   3.983
  113   HG21  ILE  14          HG21      ILE  14  34.065  22.560   2.656
  114   HG22  ILE  14          HG22      ILE  14  32.816  22.811   3.876
  115   HG23  ILE  14          HG23      ILE  14  33.025  21.222   3.142
  116   HD11  ILE  14          HD11      ILE  14  33.920  24.138   5.424
  117   HD12  ILE  14          HD12      ILE  14  34.562  24.520   3.828
  118   HD13  ILE  14          HD13      ILE  14  35.472  24.958   5.272
  119    H    LEU  15           HN       LEU  15  34.001  18.947   5.613
  120    HA   LEU  15           HA       LEU  15  31.546  18.333   4.363
  121    HB2  LEU  15           HB2      LEU  15  33.492  16.609   5.912
  122    HB3  LEU  15           HB1      LEU  15  32.107  15.967   5.028
  123    HG   LEU  15           HG       LEU  15  34.226  17.714   3.750
  124   HD11  LEU  15          HD11      LEU  15  33.973  14.690   3.776
  125   HD12  LEU  15          HD12      LEU  15  35.251  15.628   4.551
  126   HD13  LEU  15          HD13      LEU  15  35.115  15.606   2.793
  127   HD21  LEU  15          HD21      LEU  15  33.243  16.560   1.678
  128   HD22  LEU  15          HD22      LEU  15  32.207  17.745   2.472
  129   HD23  LEU  15          HD23      LEU  15  31.932  16.022   2.728
  130    H    SER  16           HN       SER  16  32.509  18.532   7.714
  131    HA   SER  16           HA       SER  16  30.170  17.260   8.787
  132    HB2  SER  16           HB2      SER  16  32.234  19.069  10.047
  133    HB3  SER  16           HB1      SER  16  30.942  18.272  10.941
  134    HG   SER  16           HG       SER  16  31.781  16.290  10.302
  135    H    ALA  17           HN       ALA  17  31.216  20.655   8.500
  136    HA   ALA  17           HA       ALA  17  28.900  21.803   9.615
  137    HB1  ALA  17           HB1      ALA  17  30.646  23.317   9.440
  138    HB2  ALA  17           HB2      ALA  17  29.657  23.795   8.062
  139    HB3  ALA  17           HB3      ALA  17  31.085  22.789   7.817
  140    H    LEU  18           HN       LEU  18  29.709  20.912   6.281
  141    HA   LEU  18           HA       LEU  18  27.349  22.012   5.135
  142    HB2  LEU  18           HB2      LEU  18  29.563  20.251   4.255
  143    HB3  LEU  18           HB1      LEU  18  28.050  20.119   3.358
  144    HG   LEU  18           HG       LEU  18  28.059  22.451   2.821
  145   HD11  LEU  18          HD11      LEU  18  28.755  23.525   4.810
  146   HD12  LEU  18          HD12      LEU  18  30.058  23.863   3.674
  147   HD13  LEU  18          HD13      LEU  18  30.254  22.603   4.892
  148   HD21  LEU  18          HD21      LEU  18  30.789  21.170   2.544
  149   HD22  LEU  18          HD22      LEU  18  30.365  22.691   1.758
  150   HD23  LEU  18          HD23      LEU  18  29.489  21.215   1.352
  151    H    HIS  19           HN       HIS  19  28.199  18.776   6.318
  152    HA   HIS  19           HA       HIS  19  25.924  17.424   5.429
  153    HB2  HIS  19           HB2      HIS  19  27.954  16.347   6.355
  154    HB3  HIS  19           HB1      HIS  19  27.508  16.927   7.960
  155    HD2  HIS  19           HD2      HIS  19  26.008  14.475   5.231
  156    HE1  HIS  19           HE1      HIS  19  24.371  13.503   8.997
  157    HE2  HIS  19           HE2      HIS  19  24.488  12.817   6.554
  158    H    PHE  20           HN       PHE  20  26.508  19.217   8.417
  159    HA   PHE  20           HA       PHE  20  23.933  18.598   9.536
  160    HB2  PHE  20           HB2      PHE  20  26.357  19.860  10.410
  161    HB3  PHE  20           HB1      PHE  20  24.990  20.917  10.766
  162    HD1  PHE  20           HD1      PHE  20  26.437  17.549  11.326
  163    HD2  PHE  20           HD2      PHE  20  23.289  20.287  12.352
  164    HE1  PHE  20           HE1      PHE  20  25.801  16.104  13.240
  165    HE2  PHE  20           HE2      PHE  20  22.654  18.842  14.264
  166    HZ   PHE  20           HZ       PHE  20  23.905  16.747  14.716
  167    H    MET  21           HN       MET  21  25.294  21.205   7.614
  168    HA   MET  21           HA       MET  21  23.132  23.029   8.015
  169    HB2  MET  21           HB2      MET  21  25.441  22.846   6.112
  170    HB3  MET  21           HB1      MET  21  24.163  24.035   5.845
  171    HG2  MET  21           HG2      MET  21  24.478  24.870   8.159
  172    HG3  MET  21           HG1      MET  21  25.795  23.719   8.380
  173    HE1  MET  21           HE1      MET  21  26.742  27.612   7.971
  174    HE2  MET  21           HE2      MET  21  27.533  26.308   8.854
  175    HE3  MET  21           HE3      MET  21  25.788  26.512   8.976
  176    H    ALA  22           HN       ALA  22  24.053  21.007   5.253
  177    HA   ALA  22           HA       ALA  22  21.839  21.590   3.643
  178    HB1  ALA  22           HB1      ALA  22  22.442  19.580   2.388
  179    HB2  ALA  22           HB2      ALA  22  23.450  19.030   3.727
  180    HB3  ALA  22           HB3      ALA  22  23.896  20.479   2.826
  181    H    TRP  23           HN       TRP  23  22.385  18.967   5.999
  182    HA   TRP  23           HA       TRP  23  19.838  17.810   5.491
  183    HB2  TRP  23           HB2      TRP  23  21.865  17.428   7.668
  184    HB3  TRP  23           HB1      TRP  23  20.291  16.641   7.739
  185    HD1  TRP  23           HD1      TRP  23  23.517  15.648   6.913
  186    HE1  TRP  23           HE1      TRP  23  23.625  13.912   5.012
  187    HE3  TRP  23           HE3      TRP  23  18.866  16.262   4.869
  188    HZ2  TRP  23           HZ2      TRP  23  21.967  12.919   2.899
  189    HZ3  TRP  23           HZ3      TRP  23  18.166  14.929   2.907
  190    HH2  TRP  23           HH2      TRP  23  19.706  13.247   1.925
  191    H    THR  24           HN       THR  24  20.966  20.316   7.611
  192    HA   THR  24           HA       THR  24  18.773  20.352   9.402
  193    HB   THR  24           HB       THR  24  20.894  22.273   8.572
  194    HG1  THR  24           HG1      THR  24  21.548  21.853  10.537
  195   HG21  THR  24          HG21      THR  24  19.083  23.802   8.633
  196   HG22  THR  24          HG22      THR  24  19.824  23.907  10.229
  197   HG23  THR  24          HG23      THR  24  18.336  22.987  10.008
  198    H    ILE  25           HN       ILE  25  19.436  22.364   6.535
  199    HA   ILE  25           HA       ILE  25  16.950  23.692   6.502
  200    HB   ILE  25           HB       ILE  25  18.924  23.099   4.292
  201   HG12  ILE  25          HG12      ILE  25  18.282  25.728   5.640
  202   HG13  ILE  25          HG11      ILE  25  19.495  24.625   6.293
  203   HG21  ILE  25          HG21      ILE  25  17.669  24.996   3.127
  204   HG22  ILE  25          HG22      ILE  25  16.380  24.737   4.302
  205   HG23  ILE  25          HG23      ILE  25  16.830  23.445   3.189
  206   HD11  ILE  25          HD11      ILE  25  20.647  26.191   4.867
  207   HD12  ILE  25          HD12      ILE  25  19.490  25.935   3.561
  208   HD13  ILE  25          HD13      ILE  25  20.602  24.646   4.019
  209    H    GLY  26           HN       GLY  26  18.033  20.712   4.944
  210    HA2  GLY  26           HA2      GLY  26  15.725  20.213   3.390
  211    HA3  GLY  26           HA1      GLY  26  16.878  18.995   3.926
  212    H    HIS  27           HN       HIS  27  16.577  19.361   6.710
  213    HA   HIS  27           HA       HIS  27  14.338  17.692   7.234
  214    HB2  HIS  27           HB2      HIS  27  16.170  17.467   8.710
  215    HB3  HIS  27           HB1      HIS  27  16.243  19.203   9.012
  216    HD2  HIS  27           HD2      HIS  27  14.853  19.964  11.263
  217    HE1  HIS  27           HE1      HIS  27  12.377  16.564  11.628
  218    HE2  HIS  27           HE2      HIS  27  13.028  18.772  12.701
  219    H    LEU  28           HN       LEU  28  14.924  21.154   7.642
  220    HA   LEU  28           HA       LEU  28  12.575  21.764   9.084
  221    HB2  LEU  28           HB2      LEU  28  14.714  23.202   8.505
  222    HB3  LEU  28           HB1      LEU  28  13.727  23.718   7.137
  223    HG   LEU  28           HG       LEU  28  11.868  24.070   8.946
  224   HD11  LEU  28          HD11      LEU  28  12.887  24.766  11.136
  225   HD12  LEU  28          HD12      LEU  28  14.420  24.090  10.584
  226   HD13  LEU  28          HD13      LEU  28  13.022  23.038  10.813
  227   HD21  LEU  28          HD21      LEU  28  12.577  26.371   9.211
  228   HD22  LEU  28          HD22      LEU  28  13.067  25.838   7.603
  229   HD23  LEU  28          HD23      LEU  28  14.259  25.936   8.899
  230    H    ASN  29           HN       ASN  29  10.543  22.406   8.438
  231    HA   ASN  29           HA       ASN  29   9.710  21.513   5.796
  232    HB2  ASN  29           HB2      ASN  29   8.261  22.448   8.265
  233    HB3  ASN  29           HB1      ASN  29   7.418  22.234   6.732
  234   HD21  ASN  29          HD21      ASN  29   8.823  20.555   9.454
  235   HD22  ASN  29          HD22      ASN  29   8.465  18.985   8.918
  236    H    GLN  30           HN       GLN  30   9.694  22.832   4.104
  237    HA   GLN  30           HA       GLN  30   9.265  25.724   4.573
  238    HB2  GLN  30           HB2      GLN  30  11.582  24.974   3.761
  239    HB3  GLN  30           HB1      GLN  30  10.789  24.573   2.239
  240    HG2  GLN  30           HG2      GLN  30  11.513  26.788   1.902
  241    HG3  GLN  30           HG1      GLN  30   9.821  26.978   2.357
  242   HE21  GLN  30          HE21      GLN  30  11.257  29.214   2.837
  243   HE22  GLN  30          HE22      GLN  30  11.655  29.373   4.479
  244    H    ILE  31           HN       ILE  31   7.359  26.374   3.821
  245    HA   ILE  31           HA       ILE  31   6.270  25.039   1.413
  246    HB   ILE  31           HB       ILE  31   4.729  26.208   3.746
  247   HG12  ILE  31          HG12      ILE  31   4.996  23.319   2.861
  248   HG13  ILE  31          HG11      ILE  31   5.945  24.027   4.169
  249   HG21  ILE  31          HG21      ILE  31   2.792  25.145   2.573
  250   HG22  ILE  31          HG22      ILE  31   3.859  24.772   1.218
  251   HG23  ILE  31          HG23      ILE  31   3.522  26.451   1.641
  252   HD11  ILE  31          HD11      ILE  31   2.915  23.936   4.064
  253   HD12  ILE  31          HD12      ILE  31   3.885  24.597   5.381
  254   HD13  ILE  31          HD13      ILE  31   3.931  22.868   5.033
  255    H    LYS  32           HN       LYS  32   6.131  26.352  -0.286
  256    HA   LYS  32           HA       LYS  32   6.584  29.175  -0.060
  257    HB2  LYS  32           HB2      LYS  32   6.935  27.367  -2.057
  258    HB3  LYS  32           HB1      LYS  32   5.433  28.132  -2.576
  259    HG2  LYS  32           HG2      LYS  32   7.189  29.436  -3.536
  260    HG3  LYS  32           HG1      LYS  32   6.593  30.372  -2.165
  261    HD2  LYS  32           HD2      LYS  32   8.799  30.464  -1.591
  262    HD3  LYS  32           HD1      LYS  32   8.493  28.852  -0.941
  263    HE2  LYS  32           HE2      LYS  32  10.352  28.464  -2.300
  264    HE3  LYS  32           HE1      LYS  32   9.023  28.064  -3.388
  265    HZ1  LYS  32           HZ1      LYS  32   9.176  30.166  -4.422
  266    HZ2  LYS  32           HZ2      LYS  32  10.764  29.568  -4.330
  267    HZ3  LYS  32           HZ3      LYS  32  10.238  30.762  -3.242
  268    H    ARG  33           HN       ARG  33   4.965  30.130   1.133
  269    HA   ARG  33           HA       ARG  33   2.174  29.681   0.456
  270    HB2  ARG  33           HB2      ARG  33   3.537  30.481   2.759
  271    HB3  ARG  33           HB1      ARG  33   2.673  31.925   2.227
  272    HG2  ARG  33           HG2      ARG  33   0.569  30.785   2.242
  273    HG3  ARG  33           HG1      ARG  33   1.348  29.213   2.429
  274    HD2  ARG  33           HD2      ARG  33   0.382  30.079   4.565
  275    HD3  ARG  33           HD1      ARG  33   2.120  29.805   4.653
  276    HE   ARG  33           HE       ARG  33   2.419  32.088   4.919
  277   HH11  ARG  33          HH11      ARG  33  -0.790  31.429   3.739
  278   HH12  ARG  33          HH12      ARG  33  -1.326  33.063   3.935
  279   HH21  ARG  33          HH21      ARG  33   1.696  34.208   5.170
  280   HH22  ARG  33          HH22      ARG  33   0.071  34.629   4.741
  281    H1   MET   1           HT1      MET   1  45.663  17.487  31.015
  282    H2   MET   1           HT2      MET   1  45.102  18.579  32.188
  283    H3   MET   1           HT3      MET   1  44.097  18.128  30.895
  284    HA   MET   1           HA       MET   1  44.512  15.735  31.850
  285    HB2  MET   1           HB2      MET   1  45.536  17.573  33.864
  286    HB3  MET   1           HB1      MET   1  44.234  16.567  34.504
  287    HG2  MET   1           HG2      MET   1  45.414  14.559  33.555
  288    HG3  MET   1           HG1      MET   1  46.762  15.613  33.132
  289    HE1  MET   1           HE1      MET   1  48.298  16.633  34.466
  290    HE2  MET   1           HE2      MET   1  48.480  16.598  36.218
  291    HE3  MET   1           HE3      MET   1  47.249  17.626  35.487
  292    H    PHE   2           HN       PHE   2  42.948  18.808  32.366
  293    HA   PHE   2           HA       PHE   2  40.560  17.897  33.576
  294    HB2  PHE   2           HB2      PHE   2  41.083  20.293  31.803
  295    HB3  PHE   2           HB1      PHE   2  39.594  20.028  32.711
  296    HD1  PHE   2           HD1      PHE   2  43.098  21.012  32.888
  297    HD2  PHE   2           HD2      PHE   2  39.639  19.958  35.203
  298    HE1  PHE   2           HE1      PHE   2  44.162  21.971  34.912
  299    HE2  PHE   2           HE2      PHE   2  40.702  20.917  37.229
  300    HZ   PHE   2           HZ       PHE   2  42.963  21.924  37.082
  301    H    GLU   3           HN       GLU   3  41.556  18.231  30.197
  302    HA   GLU   3           HA       GLU   3  38.952  17.348  29.264
  303    HB2  GLU   3           HB2      GLU   3  41.490  18.039  27.772
  304    HB3  GLU   3           HB1      GLU   3  39.972  17.587  26.997
  305    HG2  GLU   3           HG2      GLU   3  39.897  19.941  27.015
  306    HG3  GLU   3           HG1      GLU   3  38.919  19.488  28.409
  307    HA   PRO   4           HA       PRO   4  40.004  13.065  28.980
  308    HB2  PRO   4           HB2      PRO   4  38.527  12.288  26.811
  309    HB3  PRO   4           HB1      PRO   4  37.819  12.641  28.398
  310    HG2  PRO   4           HG2      PRO   4  37.919  14.326  25.950
  311    HG3  PRO   4           HG1      PRO   4  36.620  14.136  27.140
  312    HD2  PRO   4           HD2      PRO   4  38.319  16.293  27.104
  313    HD3  PRO   4           HD1      PRO   4  37.528  15.695  28.579
  314    H    PHE   5           HN       PHE   5  40.013  14.707  25.810
  315    HA   PHE   5           HA       PHE   5  42.608  13.457  25.218
  316    HB2  PHE   5           HB2      PHE   5  40.071  13.138  23.679
  317    HB3  PHE   5           HB1      PHE   5  41.576  13.294  22.773
  318    HD1  PHE   5           HD1      PHE   5  39.940  11.368  25.521
  319    HD2  PHE   5           HD2      PHE   5  43.079  11.478  22.591
  320    HE1  PHE   5           HE1      PHE   5  40.488   8.999  26.018
  321    HE2  PHE   5           HE2      PHE   5  43.626   9.111  23.088
  322    HZ   PHE   5           HZ       PHE   5  42.331   7.872  24.801
  323    H    GLN   6           HN       GLN   6  40.234  15.432  23.454
  324    HA   GLN   6           HA       GLN   6  41.861  17.805  23.638
  325    HB2  GLN   6           HB2      GLN   6  42.081  17.966  21.101
  326    HB3  GLN   6           HB1      GLN   6  43.158  16.826  21.907
  327    HG2  GLN   6           HG2      GLN   6  41.685  14.969  21.339
  328    HG3  GLN   6           HG1      GLN   6  40.513  16.076  20.635
  329   HE21  GLN   6          HE21      GLN   6  42.985  13.993  19.790
  330   HE22  GLN   6          HE22      GLN   6  43.425  14.689  18.306
  331    H    ILE   7           HN       ILE   7  40.890  19.615  22.405
  332    HA   ILE   7           HA       ILE   7  38.199  19.954  22.967
  333    HB   ILE   7           HB       ILE   7  38.290  21.848  21.315
  334   HG12  ILE   7          HG12      ILE   7  41.030  22.007  20.794
  335   HG13  ILE   7          HG11      ILE   7  40.631  20.332  20.429
  336   HG21  ILE   7          HG21      ILE   7  39.975  23.115  22.575
  337   HG22  ILE   7          HG22      ILE   7  40.649  21.611  23.204
  338   HG23  ILE   7          HG23      ILE   7  39.020  22.107  23.663
  339   HD11  ILE   7          HD11      ILE   7  38.638  21.257  19.100
  340   HD12  ILE   7          HD12      ILE   7  40.239  21.504  18.402
  341   HD13  ILE   7          HD13      ILE   7  39.426  22.829  19.236
  342    H    LEU   8           HN       LEU   8  39.724  18.681  20.062
  343    HA   LEU   8           HA       LEU   8  37.433  18.683  18.400
  344    HB2  LEU   8           HB2      LEU   8  39.948  18.312  17.812
  345    HB3  LEU   8           HB1      LEU   8  39.610  16.622  18.183
  346    HG   LEU   8           HG       LEU   8  37.598  17.918  16.455
  347   HD11  LEU   8          HD11      LEU   8  40.383  17.342  15.395
  348   HD12  LEU   8          HD12      LEU   8  39.716  18.957  15.635
  349   HD13  LEU   8          HD13      LEU   8  38.993  17.872  14.449
  350   HD21  LEU   8          HD21      LEU   8  37.639  15.781  15.371
  351   HD22  LEU   8          HD22      LEU   8  37.805  15.453  17.095
  352   HD23  LEU   8          HD23      LEU   8  39.221  15.393  16.046
  353    H    SER   9           HN       SER   9  38.660  16.456  20.796
  354    HA   SER   9           HA       SER   9  36.925  14.274  20.140
  355    HB2  SER   9           HB2      SER   9  38.544  14.923  22.605
  356    HB3  SER   9           HB1      SER   9  37.577  13.460  22.445
  357    HG   SER   9           HG       SER   9  40.008  14.003  21.459
  358    H    ILE  10           HN       ILE  10  36.807  16.959  22.445
  359    HA   ILE  10           HA       ILE  10  34.492  16.149  23.845
  360    HB   ILE  10           HB       ILE  10  35.679  18.879  23.317
  361   HG12  ILE  10          HG12      ILE  10  35.565  17.284  25.885
  362   HG13  ILE  10          HG11      ILE  10  36.890  17.111  24.733
  363   HG21  ILE  10          HG21      ILE  10  33.342  19.248  23.747
  364   HG22  ILE  10          HG22      ILE  10  34.197  19.571  25.256
  365   HG23  ILE  10          HG23      ILE  10  33.331  18.049  25.041
  366   HD11  ILE  10          HD11      ILE  10  37.460  19.455  24.940
  367   HD12  ILE  10          HD12      ILE  10  37.349  18.776  26.565
  368   HD13  ILE  10          HD13      ILE  10  36.031  19.760  25.929
  369    H    CYS  11           HN       CYS  11  34.886  18.322  21.039
  370    HA   CYS  11           HA       CYS  11  32.141  18.906  20.719
  371    HB2  CYS  11           HB2      CYS  11  34.435  18.891  18.754
  372    HB3  CYS  11           HB1      CYS  11  32.814  19.453  18.344
  373    HG   CYS  11           HG       CYS  11  33.422  20.973  20.737
  374    H    SER  12           HN       SER  12  34.190  16.513  19.048
  375    HA   SER  12           HA       SER  12  32.268  15.378  17.419
  376    HB2  SER  12           HB2      SER  12  34.673  14.823  17.310
  377    HB3  SER  12           HB1      SER  12  34.533  13.938  18.827
  378    HG   SER  12           HG       SER  12  34.278  12.456  17.215
  379    H    PHE  13           HN       PHE  13  33.056  14.582  20.783
  380    HA   PHE  13           HA       PHE  13  31.362  12.379  21.087
  381    HB2  PHE  13           HB2      PHE  13  32.967  12.849  22.795
  382    HB3  PHE  13           HB1      PHE  13  32.309  14.464  23.058
  383    HD1  PHE  13           HD1      PHE  13  31.552  10.829  23.372
  384    HD2  PHE  13           HD2      PHE  13  30.442  14.827  24.482
  385    HE1  PHE  13           HE1      PHE  13  29.961   9.924  25.046
  386    HE2  PHE  13           HE2      PHE  13  28.852  13.922  26.156
  387    HZ   PHE  13           HZ       PHE  13  28.612  11.470  26.438
  388    H    ILE  14           HN       ILE  14  30.735  15.838  21.717
  389    HA   ILE  14           HA       ILE  14  28.070  15.505  22.589
  390    HB   ILE  14           HB       ILE  14  29.441  17.876  21.301
  391   HG12  ILE  14          HG12      ILE  14  30.285  16.923  23.536
  392   HG13  ILE  14          HG11      ILE  14  29.860  18.631  23.516
  393   HG21  ILE  14          HG21      ILE  14  27.540  19.122  22.511
  394   HG22  ILE  14          HG22      ILE  14  26.727  17.558  22.594
  395   HG23  ILE  14          HG23      ILE  14  27.121  18.267  21.028
  396   HD11  ILE  14          HD11      ILE  14  27.854  16.525  24.333
  397   HD12  ILE  14          HD12      ILE  14  27.825  18.254  24.665
  398   HD13  ILE  14          HD13      ILE  14  28.990  17.219  25.488
  399    H    LEU  15           HN       LEU  15  29.422  16.204  19.391
  400    HA   LEU  15           HA       LEU  15  26.967  16.523  18.033
  401    HB2  LEU  15           HB2      LEU  15  29.702  15.675  17.056
  402    HB3  LEU  15           HB1      LEU  15  28.343  16.013  15.984
  403    HG   LEU  15           HG       LEU  15  29.373  17.992  18.033
  404   HD11  LEU  15          HD11      LEU  15  29.986  17.782  15.069
  405   HD12  LEU  15          HD12      LEU  15  31.133  17.519  16.383
  406   HD13  LEU  15          HD13      LEU  15  30.455  19.125  16.112
  407   HD21  LEU  15          HD21      LEU  15  28.139  19.565  16.422
  408   HD22  LEU  15          HD22      LEU  15  27.126  18.506  17.401
  409   HD23  LEU  15          HD23      LEU  15  27.434  18.114  15.709
  410    H    SER  16           HN       SER  16  28.846  13.712  18.894
  411    HA   SER  16           HA       SER  16  27.427  11.863  17.211
  412    HB2  SER  16           HB2      SER  16  29.201  11.441  19.618
  413    HB3  SER  16           HB1      SER  16  28.534  10.135  18.641
  414    HG   SER  16           HG       SER  16  29.638  10.955  16.867
  415    H    ALA  17           HN       ALA  17  27.340  12.609  20.695
  416    HA   ALA  17           HA       ALA  17  25.284  10.800  21.359
  417    HB1  ALA  17           HB1      ALA  17  26.392  11.608  23.227
  418    HB2  ALA  17           HB2      ALA  17  24.924  12.581  23.268
  419    HB3  ALA  17           HB3      ALA  17  26.419  13.266  22.628
  420    H    LEU  18           HN       LEU  18  25.200  14.181  20.291
  421    HA   LEU  18           HA       LEU  18  22.391  14.489  20.621
  422    HB2  LEU  18           HB2      LEU  18  24.605  16.011  19.371
  423    HB3  LEU  18           HB1      LEU  18  22.983  16.336  18.756
  424    HG   LEU  18           HG       LEU  18  22.176  16.920  20.933
  425   HD11  LEU  18          HD11      LEU  18  23.145  15.322  22.384
  426   HD12  LEU  18          HD12      LEU  18  23.871  16.845  22.892
  427   HD13  LEU  18          HD13      LEU  18  24.785  15.727  21.882
  428   HD21  LEU  18          HD21      LEU  18  24.917  18.067  20.349
  429   HD22  LEU  18          HD22      LEU  18  23.861  18.711  21.605
  430   HD23  LEU  18          HD23      LEU  18  23.346  18.746  19.920
  431    H    HIS  19           HN       HIS  19  24.433  13.558  17.871
  432    HA   HIS  19           HA       HIS  19  22.459  13.576  15.895
  433    HB2  HIS  19           HB2      HIS  19  24.893  13.364  15.480
  434    HB3  HIS  19           HB1      HIS  19  24.841  11.722  16.125
  435    HD2  HIS  19           HD2      HIS  19  23.289  13.697  13.058
  436    HE1  HIS  19           HE1      HIS  19  23.272   9.567  12.185
  437    HE2  HIS  19           HE2      HIS  19  22.790  11.879  11.251
  438    H    PHE  20           HN       PHE  20  23.439  11.033  18.141
  439    HA   PHE  20           HA       PHE  20  21.640   9.078  17.035
  440    HB2  PHE  20           HB2      PHE  20  23.768   9.124  18.959
  441    HB3  PHE  20           HB1      PHE  20  22.351   8.359  19.676
  442    HD1  PHE  20           HD1      PHE  20  24.771   8.219  16.873
  443    HD2  PHE  20           HD2      PHE  20  21.490   6.266  18.843
  444    HE1  PHE  20           HE1      PHE  20  25.205   6.160  15.558
  445    HE2  PHE  20           HE2      PHE  20  21.925   4.209  17.528
  446    HZ   PHE  20           HZ       PHE  20  23.783   4.152  15.882
  447    H    MET  21           HN       MET  21  21.537  11.439  19.635
  448    HA   MET  21           HA       MET  21  19.205  10.381  20.903
  449    HB2  MET  21           HB2      MET  21  20.744  12.948  21.067
  450    HB3  MET  21           HB1      MET  21  19.172  12.804  21.858
  451    HG2  MET  21           HG2      MET  21  19.965  10.763  23.024
  452    HG3  MET  21           HG1      MET  21  21.548  10.968  22.275
  453    HE1  MET  21           HE1      MET  21  21.202  11.799  26.200
  454    HE2  MET  21           HE2      MET  21  22.558  11.198  25.253
  455    HE3  MET  21           HE3      MET  21  20.959  10.495  25.030
  456    H    ALA  22           HN       ALA  22  19.719  13.224  18.847
  457    HA   ALA  22           HA       ALA  22  17.039  14.003  18.657
  458    HB1  ALA  22           HB1      ALA  22  17.745  15.321  16.721
  459    HB2  ALA  22           HB2      ALA  22  19.236  14.386  16.610
  460    HB3  ALA  22           HB3      ALA  22  18.954  15.434  18.000
  461    H    TRP  23           HN       TRP  23  19.008  11.886  16.569
  462    HA   TRP  23           HA       TRP  23  16.856  11.458  14.759
  463    HB2  TRP  23           HB2      TRP  23  19.494  10.091  15.164
  464    HB3  TRP  23           HB1      TRP  23  18.307   9.464  14.024
  465    HD1  TRP  23           HD1      TRP  23  21.244  11.302  13.772
  466    HE1  TRP  23           HE1      TRP  23  21.215  13.070  11.897
  467    HE3  TRP  23           HE3      TRP  23  16.205  11.667  12.956
  468    HZ2  TRP  23           HZ2      TRP  23  19.312  14.463  10.273
  469    HZ3  TRP  23           HZ3      TRP  23  15.312  13.234  11.265
  470    HH2  TRP  23           HH2      TRP  23  16.863  14.623   9.907
  471    H    THR  24           HN       THR  24  17.855   9.945  17.713
  472    HA   THR  24           HA       THR  24  16.436   7.507  17.419
  473    HB   THR  24           HB       THR  24  17.563   9.069  19.690
  474    HG1  THR  24           HG1      THR  24  18.900   7.431  19.693
  475   HG21  THR  24          HG21      THR  24  15.519   8.445  20.715
  476   HG22  THR  24          HG22      THR  24  16.670   7.199  21.197
  477   HG23  THR  24          HG23      THR  24  15.505   6.873  19.914
  478    H    ILE  25           HN       ILE  25  15.562  10.502  19.157
  479    HA   ILE  25           HA       ILE  25  12.935   9.717  19.813
  480    HB   ILE  25           HB       ILE  25  14.184  12.447  19.462
  481   HG12  ILE  25          HG12      ILE  25  13.306  11.048  21.994
  482   HG13  ILE  25          HG11      ILE  25  14.918  10.812  21.318
  483   HG21  ILE  25          HG21      ILE  25  12.151  13.177  20.829
  484   HG22  ILE  25          HG22      ILE  25  11.428  11.626  20.404
  485   HG23  ILE  25          HG23      ILE  25  11.839  12.783  19.138
  486   HD11  ILE  25          HD11      ILE  25  15.076  12.595  22.933
  487   HD12  ILE  25          HD12      ILE  25  13.680  13.420  22.238
  488   HD13  ILE  25          HD13      ILE  25  15.192  13.326  21.333
  489    H    GLY  26           HN       GLY  26  14.242  11.457  17.028
  490    HA2  GLY  26           HA2      GLY  26  11.792  12.111  15.781
  491    HA3  GLY  26           HA1      GLY  26  13.346  11.961  14.966
  492    H    HIS  27           HN       HIS  27  13.854   9.254  15.595
  493    HA   HIS  27           HA       HIS  27  12.456   7.944  13.491
  494    HB2  HIS  27           HB2      HIS  27  14.651   7.174  13.910
  495    HB3  HIS  27           HB1      HIS  27  14.338   6.972  15.634
  496    HD2  HIS  27           HD2      HIS  27  13.582   4.409  16.300
  497    HE1  HIS  27           HE1      HIS  27  12.389   3.110  12.464
  498    HE2  HIS  27           HE2      HIS  27  12.714   2.398  14.880
  499    H    LEU  28           HN       LEU  28  12.155   7.885  17.012
  500    HA   LEU  28           HA       LEU  28  10.325   5.738  17.190
  501    HB2  LEU  28           HB2      LEU  28  11.682   7.058  19.033
  502    HB3  LEU  28           HB1      LEU  28  10.209   8.024  19.114
  503    HG   LEU  28           HG       LEU  28   9.002   5.703  19.214
  504   HD11  LEU  28          HD11      LEU  28  10.432   4.014  20.405
  505   HD12  LEU  28          HD12      LEU  28  11.833   5.033  20.070
  506   HD13  LEU  28          HD13      LEU  28  10.930   4.308  18.740
  507   HD21  LEU  28          HD21      LEU  28   9.096   5.771  21.633
  508   HD22  LEU  28          HD22      LEU  28   9.174   7.431  21.044
  509   HD23  LEU  28          HD23      LEU  28  10.641   6.621  21.595
  510    H    ASN  29           HN       ASN  29   8.099   5.675  17.225
  511    HA   ASN  29           HA       ASN  29   6.748   7.845  15.831
  512    HB2  ASN  29           HB2      ASN  29   5.963   5.062  16.674
  513    HB3  ASN  29           HB1      ASN  29   4.769   6.209  16.069
  514   HD21  ASN  29          HD21      ASN  29   7.371   4.074  15.142
  515   HD22  ASN  29          HD22      ASN  29   7.311   4.405  13.478
  516    H    GLN  30           HN       GLN  30   5.829   9.473  16.885
  517    HA   GLN  30           HA       GLN  30   4.793   8.982  19.615
  518    HB2  GLN  30           HB2      GLN  30   6.843  10.508  19.370
  519    HB3  GLN  30           HB1      GLN  30   5.748  11.656  18.599
  520    HG2  GLN  30           HG2      GLN  30   5.688  12.292  20.865
  521    HG3  GLN  30           HG1      GLN  30   4.245  11.295  20.682
  522   HE21  GLN  30          HE21      GLN  30   5.081  11.405  23.247
  523   HE22  GLN  30          HE22      GLN  30   5.921  10.002  23.702
  524    H    ILE  31           HN       ILE  31   2.644   9.055  19.664
  525    HA   ILE  31           HA       ILE  31   1.258  10.908  17.819
  526    HB   ILE  31           HB       ILE  31   0.281   8.229  18.846
  527   HG12  ILE  31          HG12      ILE  31   1.037   9.057  16.027
  528   HG13  ILE  31          HG11      ILE  31   2.120   8.175  17.104
  529   HG21  ILE  31          HG21      ILE  31  -1.557   8.638  17.199
  530   HG22  ILE  31          HG22      ILE  31  -0.917  10.260  16.937
  531   HG23  ILE  31          HG23      ILE  31  -1.551   9.806  18.519
  532   HD11  ILE  31          HD11      ILE  31  -0.635   7.238  16.252
  533   HD12  ILE  31          HD12      ILE  31   0.482   6.353  17.292
  534   HD13  ILE  31          HD13      ILE  31   0.889   6.638  15.599
  535    H    LYS  32           HN       LYS  32   0.227  12.500  18.836
  536    HA   LYS  32           HA       LYS  32  -0.068  12.533  21.687
  537    HB2  LYS  32           HB2      LYS  32   0.112  14.471  19.792
  538    HB3  LYS  32           HB1      LYS  32  -1.627  14.471  20.088
  539    HG2  LYS  32           HG2      LYS  32  -0.702  16.014  21.660
  540    HG3  LYS  32           HG1      LYS  32  -1.064  14.553  22.580
  541    HD2  LYS  32           HD2      LYS  32   1.094  14.770  23.290
  542    HD3  LYS  32           HD1      LYS  32   1.469  14.002  21.747
  543    HE2  LYS  32           HE2      LYS  32   2.828  15.899  21.667
  544    HE3  LYS  32           HE1      LYS  32   1.387  16.457  20.817
  545    HZ1  LYS  32           HZ1      LYS  32   0.616  17.549  22.747
  546    HZ2  LYS  32           HZ2      LYS  32   2.249  17.982  22.580
  547    HZ3  LYS  32           HZ3      LYS  32   1.790  16.820  23.730
  548    H    ARG  33           HN       ARG  33  -1.420  10.893  22.351
  549    HA   ARG  33           HA       ARG  33  -4.042  10.565  21.142
  550    HB2  ARG  33           HB2      ARG  33  -2.293   8.891  22.534
  551    HB3  ARG  33           HB1      ARG  33  -3.645   9.144  23.639
  552    HG2  ARG  33           HG2      ARG  33  -5.234   8.377  22.022
  553    HG3  ARG  33           HG1      ARG  33  -4.034   8.414  20.729
  554    HD2  ARG  33           HD2      ARG  33  -4.467   6.106  21.584
  555    HD3  ARG  33           HD1      ARG  33  -2.787   6.606  21.765
  556    HE   ARG  33           HE       ARG  33  -3.061   6.533  24.066
  557   HH11  ARG  33          HH11      ARG  33  -6.166   6.529  22.486
  558   HH12  ARG  33          HH12      ARG  33  -7.040   6.216  23.947
  559   HH21  ARG  33          HH21      ARG  33  -4.224   6.120  25.953
  560   HH22  ARG  33          HH22      ARG  33  -5.950   5.985  25.898
  561    H1   MET   1           HT1      MET   1  48.609  -3.462  24.134
  562    H2   MET   1           HT2      MET   1  48.181  -4.779  25.118
  563    H3   MET   1           HT3      MET   1  46.980  -3.908  24.290
  564    HA   MET   1           HA       MET   1  48.386  -4.612  22.205
  565    HB2  MET   1           HB2      MET   1  49.433  -6.179  24.425
  566    HB3  MET   1           HB1      MET   1  48.787  -7.212  23.148
  567    HG2  MET   1           HG2      MET   1  50.118  -5.872  21.487
  568    HG3  MET   1           HG1      MET   1  50.865  -5.027  22.843
  569    HE1  MET   1           HE1      MET   1  52.380  -5.763  24.371
  570    HE2  MET   1           HE2      MET   1  53.146  -7.340  24.541
  571    HE3  MET   1           HE3      MET   1  51.494  -7.106  25.105
  572    H    PHE   2           HN       PHE   2  46.248  -5.699  24.734
  573    HA   PHE   2           HA       PHE   2  44.796  -7.647  23.287
  574    HB2  PHE   2           HB2      PHE   2  43.951  -5.851  25.571
  575    HB3  PHE   2           HB1      PHE   2  43.008  -7.215  24.969
  576    HD1  PHE   2           HD1      PHE   2  45.903  -6.180  26.926
  577    HD2  PHE   2           HD2      PHE   2  43.910  -9.534  25.130
  578    HE1  PHE   2           HE1      PHE   2  47.251  -7.726  28.319
  579    HE2  PHE   2           HE2      PHE   2  45.257 -11.081  26.524
  580    HZ   PHE   2           HZ       PHE   2  46.928 -10.177  28.119
  581    H    GLU   3           HN       GLU   3  44.443  -4.140  23.601
  582    HA   GLU   3           HA       GLU   3  42.067  -4.154  21.933
  583    HB2  GLU   3           HB2      GLU   3  43.623  -1.887  23.189
  584    HB3  GLU   3           HB1      GLU   3  42.139  -1.680  22.258
  585    HG2  GLU   3           HG2      GLU   3  41.377  -1.771  24.485
  586    HG3  GLU   3           HG1      GLU   3  41.112  -3.408  23.892
  587    HA   PRO   4           HA       PRO   4  44.187  -3.437  18.122
  588    HB2  PRO   4           HB2      PRO   4  42.367  -1.904  16.770
  589    HB3  PRO   4           HB1      PRO   4  42.166  -3.645  17.041
  590    HG2  PRO   4           HG2      PRO   4  40.924  -1.349  18.468
  591    HG3  PRO   4           HG1      PRO   4  40.225  -2.914  18.017
  592    HD2  PRO   4           HD2      PRO   4  41.086  -2.331  20.558
  593    HD3  PRO   4           HD1      PRO   4  41.059  -3.977  19.890
  594    H    PHE   5           HN       PHE   5  42.633  -0.496  19.417
  595    HA   PHE   5           HA       PHE   5  45.123   0.986  18.916
  596    HB2  PHE   5           HB2      PHE   5  42.434   1.555  17.753
  597    HB3  PHE   5           HB1      PHE   5  43.428   2.922  18.252
  598    HD1  PHE   5           HD1      PHE   5  43.465  -0.186  16.185
  599    HD2  PHE   5           HD2      PHE   5  45.249   3.650  16.930
  600    HE1  PHE   5           HE1      PHE   5  44.820  -0.414  14.121
  601    HE2  PHE   5           HE2      PHE   5  46.605   3.421  14.865
  602    HZ   PHE   5           HZ       PHE   5  46.389   1.387  13.454
  603    H    GLN   6           HN       GLN   6  41.810   1.778  19.978
  604    HA   GLN   6           HA       GLN   6  42.630   2.120  22.715
  605    HB2  GLN   6           HB2      GLN   6  41.921   4.572  22.716
  606    HB3  GLN   6           HB1      GLN   6  43.494   4.214  22.004
  607    HG2  GLN   6           HG2      GLN   6  42.539   4.271  19.762
  608    HG3  GLN   6           HG1      GLN   6  40.925   4.501  20.425
  609   HE21  GLN   6          HE21      GLN   6  43.463   6.194  19.066
  610   HE22  GLN   6          HE22      GLN   6  43.150   7.724  19.729
  611    H    ILE   7           HN       ILE   7  40.814   2.897  24.059
  612    HA   ILE   7           HA       ILE   7  38.495   1.436  23.668
  613    HB   ILE   7           HB       ILE   7  37.453   2.980  25.356
  614   HG12  ILE   7          HG12      ILE   7  39.675   4.420  26.246
  615   HG13  ILE   7          HG11      ILE   7  39.695   4.657  24.502
  616   HG21  ILE   7          HG21      ILE   7  39.007   2.359  27.156
  617   HG22  ILE   7          HG22      ILE   7  40.269   2.034  25.966
  618   HG23  ILE   7          HG23      ILE   7  38.821   1.027  26.015
  619   HD11  ILE   7          HD11      ILE   7  37.190   5.185  24.699
  620   HD12  ILE   7          HD12      ILE   7  38.306   6.393  25.335
  621   HD13  ILE   7          HD13      ILE   7  37.470   5.302  26.437
  622    H    LEU   8           HN       LEU   8  39.249   4.718  22.637
  623    HA   LEU   8           HA       LEU   8  36.643   5.471  21.840
  624    HB2  LEU   8           HB2      LEU   8  38.799   6.906  22.151
  625    HB3  LEU   8           HB1      LEU   8  39.126   6.473  20.472
  626    HG   LEU   8           HG       LEU   8  36.359   7.367  20.987
  627   HD11  LEU   8          HD11      LEU   8  38.660   9.342  21.144
  628   HD12  LEU   8          HD12      LEU   8  37.664   8.851  22.515
  629   HD13  LEU   8          HD13      LEU   8  36.940   9.733  21.171
  630   HD21  LEU   8          HD21      LEU   8  36.666   8.440  18.866
  631   HD22  LEU   8          HD22      LEU   8  37.496   6.888  18.749
  632   HD23  LEU   8          HD23      LEU   8  38.422   8.366  19.008
  633    H    SER   9           HN       SER   9  39.218   3.708  20.260
  634    HA   SER   9           HA       SER   9  38.090   3.752  17.635
  635    HB2  SER   9           HB2      SER   9  40.173   1.992  18.929
  636    HB3  SER   9           HB1      SER   9  39.692   1.835  17.241
  637    HG   SER   9           HG       SER   9  41.369   3.594  18.372
  638    H    ILE  10           HN       ILE  10  37.973   1.490  20.356
  639    HA   ILE  10           HA       ILE  10  36.611  -0.606  19.049
  640    HB   ILE  10           HB       ILE  10  36.679   0.249  21.948
  641   HG12  ILE  10          HG12      ILE  10  37.921  -2.165  20.612
  642   HG13  ILE  10          HG11      ILE  10  38.766  -0.620  20.729
  643   HG21  ILE  10          HG21      ILE  10  34.629  -0.976  21.669
  644   HG22  ILE  10          HG22      ILE  10  35.805  -2.099  22.351
  645   HG23  ILE  10          HG23      ILE  10  35.414  -2.168  20.633
  646   HD11  ILE  10          HD11      ILE  10  38.649  -0.666  23.146
  647   HD12  ILE  10          HD12      ILE  10  39.297  -2.214  22.606
  648   HD13  ILE  10          HD13      ILE  10  37.612  -2.092  23.113
  649    H    CYS  11           HN       CYS  11  35.370   2.117  20.990
  650    HA   CYS  11           HA       CYS  11  32.636   1.452  20.738
  651    HB2  CYS  11           HB2      CYS  11  34.023   4.093  21.210
  652    HB3  CYS  11           HB1      CYS  11  32.270   3.901  21.249
  653    HG   CYS  11           HG       CYS  11  33.166   1.841  23.080
  654    H    SER  12           HN       SER  12  34.615   3.774  18.897
  655    HA   SER  12           HA       SER  12  32.685   4.660  17.124
  656    HB2  SER  12           HB2      SER  12  34.962   5.608  17.269
  657    HB3  SER  12           HB1      SER  12  35.612   4.154  16.518
  658    HG   SER  12           HG       SER  12  35.280   5.607  14.891
  659    H    PHE  13           HN       PHE  13  34.773   1.800  16.864
  660    HA   PHE  13           HA       PHE  13  34.006   0.964  14.315
  661    HB2  PHE  13           HB2      PHE  13  35.878  -0.086  15.370
  662    HB3  PHE  13           HB1      PHE  13  34.897  -0.593  16.746
  663    HD1  PHE  13           HD1      PHE  13  35.411  -1.079  13.088
  664    HD2  PHE  13           HD2      PHE  13  33.605  -2.586  16.683
  665    HE1  PHE  13           HE1      PHE  13  34.827  -3.184  11.914
  666    HE2  PHE  13           HE2      PHE  13  33.023  -4.691  15.509
  667    HZ   PHE  13           HZ       PHE  13  33.634  -4.991  13.124
  668    H    ILE  14           HN       ILE  14  32.640   0.079  17.489
  669    HA   ILE  14           HA       ILE  14  30.644  -1.650  16.491
  670    HB   ILE  14           HB       ILE  14  30.729  -0.014  19.035
  671   HG12  ILE  14          HG12      ILE  14  32.521  -1.796  18.556
  672   HG13  ILE  14          HG11      ILE  14  31.630  -1.958  20.066
  673   HG21  ILE  14          HG21      ILE  14  29.069  -1.835  19.784
  674   HG22  ILE  14          HG22      ILE  14  28.837  -2.164  18.067
  675   HG23  ILE  14          HG23      ILE  14  28.447  -0.573  18.722
  676   HD11  ILE  14          HD11      ILE  14  30.739  -3.382  17.553
  677   HD12  ILE  14          HD12      ILE  14  30.307  -3.735  19.224
  678   HD13  ILE  14          HD13      ILE  14  31.933  -4.083  18.641
  679    H    LEU  15           HN       LEU  15  30.566   1.802  17.265
  680    HA   LEU  15           HA       LEU  15  27.819   2.213  16.754
  681    HB2  LEU  15           HB2      LEU  15  30.182   4.098  16.640
  682    HB3  LEU  15           HB1      LEU  15  28.506   4.623  16.482
  683    HG   LEU  15           HG       LEU  15  29.529   3.023  18.843
  684   HD11  LEU  15          HD11      LEU  15  29.137   6.020  18.562
  685   HD12  LEU  15          HD12      LEU  15  30.683   5.193  18.752
  686   HD13  LEU  15          HD13      LEU  15  29.508   5.180  20.068
  687   HD21  LEU  15          HD21      LEU  15  27.414   4.073  19.853
  688   HD22  LEU  15          HD22      LEU  15  27.156   2.823  18.638
  689   HD23  LEU  15          HD23      LEU  15  26.976   4.523  18.206
  690    H    SER  16           HN       SER  16  30.628   2.134  14.679
  691    HA   SER  16           HA       SER  16  29.338   3.240  12.366
  692    HB2  SER  16           HB2      SER  16  31.860   1.608  12.676
  693    HB3  SER  16           HB1      SER  16  31.324   2.317  11.155
  694    HG   SER  16           HG       SER  16  31.467   4.347  12.102
  695    H    ALA  17           HN       ALA  17  30.228  -0.071  13.342
  696    HA   ALA  17           HA       ALA  17  29.143  -1.375  11.096
  697    HB1  ALA  17           HB1      ALA  17  30.525  -2.756  12.345
  698    HB2  ALA  17           HB2      ALA  17  28.937  -3.325  12.858
  699    HB3  ALA  17           HB3      ALA  17  29.851  -2.218  13.884
  700    H    LEU  18           HN       LEU  18  27.706  -0.475  14.206
  701    HA   LEU  18           HA       LEU  18  25.213  -1.763  13.729
  702    HB2  LEU  18           HB2      LEU  18  26.313   0.148  15.707
  703    HB3  LEU  18           HB1      LEU  18  24.561   0.153  15.501
  704    HG   LEU  18           HG       LEU  18  24.404  -2.180  16.012
  705   HD11  LEU  18          HD11      LEU  18  26.234  -3.170  14.888
  706   HD12  LEU  18          HD12      LEU  18  26.601  -3.426  16.593
  707   HD13  LEU  18          HD13      LEU  18  27.408  -2.138  15.701
  708   HD21  LEU  18          HD21      LEU  18  26.311  -0.703  17.842
  709   HD22  LEU  18          HD22      LEU  18  25.601  -2.262  18.262
  710   HD23  LEU  18          HD23      LEU  18  24.562  -0.861  18.003
  711    H    HIS  19           HN       HIS  19  26.383   1.543  13.188
  712    HA   HIS  19           HA       HIS  19  23.949   2.709  12.472
  713    HB2  HIS  19           HB2      HIS  19  26.045   3.949  12.925
  714    HB3  HIS  19           HB1      HIS  19  26.705   3.356  11.399
  715    HD2  HIS  19           HD2      HIS  19  23.693   5.652  12.576
  716    HE1  HIS  19           HE1      HIS  19  24.615   6.548   8.555
  717    HE2  HIS  19           HE2      HIS  19  23.179   7.208  10.543
  718    H    PHE  20           HN       PHE  20  26.346   1.009  10.509
  719    HA   PHE  20           HA       PHE  20  24.941   1.445   8.040
  720    HB2  PHE  20           HB2      PHE  20  27.478   0.382   8.856
  721    HB3  PHE  20           HB1      PHE  20  26.683  -0.769   7.782
  722    HD1  PHE  20           HD1      PHE  20  27.941   2.706   8.096
  723    HD2  PHE  20           HD2      PHE  20  26.257  -0.246   5.466
  724    HE1  PHE  20           HE1      PHE  20  28.505   4.122   6.140
  725    HE2  PHE  20           HE2      PHE  20  26.821   1.173   3.512
  726    HZ   PHE  20           HZ       PHE  20  27.951   3.362   3.836
  727    H    MET  21           HN       MET  21  25.037  -1.083  10.481
  728    HA   MET  21           HA       MET  21  23.688  -3.056   8.919
  729    HB2  MET  21           HB2      MET  21  24.351  -2.725  11.824
  730    HB3  MET  21           HB1      MET  21  23.259  -4.011  11.303
  731    HG2  MET  21           HG2      MET  21  24.970  -4.787   9.684
  732    HG3  MET  21           HG1      MET  21  26.067  -3.537  10.267
  733    HE1  MET  21           HE1      MET  21  26.839  -7.352  11.300
  734    HE2  MET  21           HE2      MET  21  27.909  -5.979  11.031
  735    HE3  MET  21           HE3      MET  21  26.614  -6.316   9.884
  736    H    ALA  22           HN       ALA  22  22.608  -1.011  11.600
  737    HA   ALA  22           HA       ALA  22  19.915  -1.779  11.564
  738    HB1  ALA  22           HB1      ALA  22  19.497   0.254  12.857
  739    HB2  ALA  22           HB2      ALA  22  21.069   0.898  12.382
  740    HB3  ALA  22           HB3      ALA  22  20.974  -0.525  13.420
  741    H    TRP  23           HN       TRP  23  21.597   0.909   9.929
  742    HA   TRP  23           HA       TRP  23  19.193   1.865   8.750
  743    HB2  TRP  23           HB2      TRP  23  22.093   2.428   8.234
  744    HB3  TRP  23           HB1      TRP  23  20.834   3.095   7.197
  745    HD1  TRP  23           HD1      TRP  23  22.823   4.316   9.771
  746    HE1  TRP  23           HE1      TRP  23  21.637   6.030  11.289
  747    HE3  TRP  23           HE3      TRP  23  17.940   3.325   8.602
  748    HZ2  TRP  23           HZ2      TRP  23  18.974   6.865  11.931
  749    HZ3  TRP  23           HZ3      TRP  23  16.105   4.574   9.694
  750    HH2  TRP  23           HH2      TRP  23  16.616   6.354  11.349
  751    H    THR  24           HN       THR  24  21.545  -0.518   7.833
  752    HA   THR  24           HA       THR  24  20.893  -0.697   5.084
  753    HB   THR  24           HB       THR  24  22.200  -2.464   7.095
  754    HG1  THR  24           HG1      THR  24  23.882  -1.970   5.915
  755   HG21  THR  24          HG21      THR  24  20.909  -4.124   6.001
  756   HG22  THR  24          HG22      THR  24  22.471  -4.150   5.186
  757   HG23  THR  24          HG23      THR  24  21.096  -3.348   4.428
  758    H    ILE  25           HN       ILE  25  19.821  -2.694   7.833
  759    HA   ILE  25           HA       ILE  25  17.918  -4.204   6.402
  760    HB   ILE  25           HB       ILE  25  18.102  -3.495   9.334
  761   HG12  ILE  25          HG12      ILE  25  18.591  -6.146   7.964
  762   HG13  ILE  25          HG11      ILE  25  19.871  -4.946   8.142
  763   HG21  ILE  25          HG21      ILE  25  16.532  -5.498   9.566
  764   HG22  ILE  25          HG22      ILE  25  16.206  -5.321   7.842
  765   HG23  ILE  25          HG23      ILE  25  15.798  -4.015   8.955
  766   HD11  ILE  25          HD11      ILE  25  20.027  -6.442  10.028
  767   HD12  ILE  25          HD12      ILE  25  18.301  -6.291  10.356
  768   HD13  ILE  25          HD13      ILE  25  19.372  -4.916  10.621
  769    H    GLY  26           HN       GLY  26  17.631  -1.175   8.190
  770    HA2  GLY  26           HA2      GLY  26  14.825  -0.869   8.014
  771    HA3  GLY  26           HA1      GLY  26  15.981   0.439   8.242
  772    H    HIS  27           HN       HIS  27  17.454   0.090   5.860
  773    HA   HIS  27           HA       HIS  27  15.883   1.591   4.028
  774    HB2  HIS  27           HB2      HIS  27  18.214   1.974   3.955
  775    HB3  HIS  27           HB1      HIS  27  18.574   0.252   3.820
  776    HD2  HIS  27           HD2      HIS  27  18.890  -0.582   1.216
  777    HE1  HIS  27           HE1      HIS  27  16.916   2.625  -0.693
  778    HE2  HIS  27           HE2      HIS  27  18.234   0.487  -1.073
  779    H    LEU  28           HN       LEU  28  16.835  -1.810   4.177
  780    HA   LEU  28           HA       LEU  28  15.887  -2.577   1.631
  781    HB2  LEU  28           HB2      LEU  28  17.329  -3.857   3.438
  782    HB3  LEU  28           HB1      LEU  28  15.753  -4.466   3.946
  783    HG   LEU  28           HG       LEU  28  15.401  -4.933   1.395
  784   HD11  LEU  28          HD11      LEU  28  17.581  -5.517   0.293
  785   HD12  LEU  28          HD12      LEU  28  18.416  -4.738   1.636
  786   HD13  LEU  28          HD13      LEU  28  17.376  -3.788   0.574
  787   HD21  LEU  28          HD21      LEU  28  16.282  -7.169   1.695
  788   HD22  LEU  28          HD22      LEU  28  15.659  -6.623   3.252
  789   HD23  LEU  28          HD23      LEU  28  17.396  -6.612   2.944
  790    H    ASN  29           HN       ASN  29  13.930  -3.382   0.937
  791    HA   ASN  29           HA       ASN  29  11.607  -2.589   2.502
  792    HB2  ASN  29           HB2      ASN  29  12.021  -3.597  -0.305
  793    HB3  ASN  29           HB1      ASN  29  10.408  -3.467   0.396
  794   HD21  ASN  29          HD21      ASN  29  13.056  -1.651  -0.977
  795   HD22  ASN  29          HD22      ASN  29  12.341  -0.120  -0.823
  796    H    GLN  30           HN       GLN  30  10.659  -3.929   3.885
  797    HA   GLN  30           HA       GLN  30  10.801  -6.838   3.353
  798    HB2  GLN  30           HB2      GLN  30  12.093  -5.926   5.375
  799    HB3  GLN  30           HB1      GLN  30  10.513  -5.608   6.091
  800    HG2  GLN  30           HG2      GLN  30  11.034  -7.765   6.875
  801    HG3  GLN  30           HG1      GLN  30   9.984  -8.077   5.494
  802   HE21  GLN  30          HE21      GLN  30  11.564 -10.192   6.060
  803   HE22  GLN  30          HE22      GLN  30  12.888 -10.297   5.003
  804    H    ILE  31           HN       ILE  31   8.879  -7.640   2.819
  805    HA   ILE  31           HA       ILE  31   6.465  -6.425   4.027
  806    HB   ILE  31           HB       ILE  31   6.739  -7.675   1.280
  807   HG12  ILE  31          HG12      ILE  31   6.215  -4.786   2.045
  808   HG13  ILE  31          HG11      ILE  31   7.808  -5.402   1.605
  809   HG21  ILE  31          HG21      ILE  31   4.419  -6.779   1.003
  810   HG22  ILE  31          HG22      ILE  31   4.418  -6.343   2.712
  811   HG23  ILE  31          HG23      ILE  31   4.523  -8.038   2.233
  812   HD11  ILE  31          HD11      ILE  31   5.338  -5.543  -0.150
  813   HD12  ILE  31          HD12      ILE  31   6.950  -6.109  -0.587
  814   HD13  ILE  31          HD13      ILE  31   6.657  -4.388  -0.343
  815    H    LYS  32           HN       LYS  32   5.413  -7.768   5.339
  816    HA   LYS  32           HA       LYS  32   6.103 -10.544   5.532
  817    HB2  LYS  32           HB2      LYS  32   5.046  -8.743   7.270
  818    HB3  LYS  32           HB1      LYS  32   3.594  -9.626   6.799
  819    HG2  LYS  32           HG2      LYS  32   4.492 -10.807   8.672
  820    HG3  LYS  32           HG1      LYS  32   4.915 -11.767   7.253
  821    HD2  LYS  32           HD2      LYS  32   7.017 -11.684   8.137
  822    HD3  LYS  32           HD1      LYS  32   7.059 -10.092   7.379
  823    HE2  LYS  32           HE2      LYS  32   7.680  -9.582   9.571
  824    HE3  LYS  32           HE1      LYS  32   5.940  -9.299   9.618
  825    HZ1  LYS  32           HZ1      LYS  32   5.579 -11.397  10.607
  826    HZ2  LYS  32           HZ2      LYS  32   6.852 -10.681  11.473
  827    HZ3  LYS  32           HZ3      LYS  32   7.177 -11.896  10.331
  828    H    ARG  33           HN       ARG  33   5.610 -11.604   3.637
  829    HA   ARG  33           HA       ARG  33   2.957 -11.376   2.471
  830    HB2  ARG  33           HB2      ARG  33   5.488 -12.040   1.493
  831    HB3  ARG  33           HB1      ARG  33   4.580 -13.551   1.443
  832    HG2  ARG  33           HG2      ARG  33   2.844 -12.573   0.117
  833    HG3  ARG  33           HG1      ARG  33   3.466 -10.945   0.384
  834    HD2  ARG  33           HD2      ARG  33   4.055 -11.851  -1.868
  835    HD3  ARG  33           HD1      ARG  33   5.467 -11.446  -0.895
  836    HE   ARG  33           HE       ARG  33   6.022 -13.696  -0.845
  837   HH11  ARG  33          HH11      ARG  33   2.718 -13.297  -1.874
  838   HH12  ARG  33          HH12      ARG  33   2.526 -14.964  -2.298
  839   HH21  ARG  33          HH21      ARG  33   5.746 -15.861  -1.409
  840   HH22  ARG  33          HH22      ARG  33   4.227 -16.409  -2.037
  841    H1   MET   1           HT1      MET   1  55.247   4.366   3.471
  842    H2   MET   1           HT2      MET   1  55.553   3.278   2.203
  843    H3   MET   1           HT3      MET   1  53.954   3.636   2.653
  844    HA   MET   1           HA       MET   1  54.703   6.075   2.100
  845    HB2  MET   1           HB2      MET   1  56.827   4.355   1.093
  846    HB3  MET   1           HB1      MET   1  56.091   5.303  -0.200
  847    HG2  MET   1           HG2      MET   1  56.360   7.347   1.240
  848    HG3  MET   1           HG1      MET   1  57.264   6.359   2.387
  849    HE1  MET   1           HE1      MET   1  59.348   5.463   2.224
  850    HE2  MET   1           HE2      MET   1  60.524   5.558   0.916
  851    HE3  MET   1           HE3      MET   1  59.166   4.442   0.789
  852    H    PHE   2           HN       PHE   2  53.934   2.935   0.793
  853    HA   PHE   2           HA       PHE   2  52.664   3.744  -1.599
  854    HB2  PHE   2           HB2      PHE   2  52.191   1.333   0.167
  855    HB3  PHE   2           HB1      PHE   2  51.508   1.540  -1.446
  856    HD1  PHE   2           HD1      PHE   2  54.498   0.758   0.484
  857    HD2  PHE   2           HD2      PHE   2  53.006   1.681  -3.435
  858    HE1  PHE   2           HE1      PHE   2  56.606  -0.084  -0.515
  859    HE2  PHE   2           HE2      PHE   2  55.112   0.839  -4.437
  860    HZ   PHE   2           HZ       PHE   2  56.912  -0.043  -2.977
  861    H    GLU   3           HN       GLU   3  51.500   3.371   1.722
  862    HA   GLU   3           HA       GLU   3  48.797   4.082   0.934
  863    HB2  GLU   3           HB2      GLU   3  50.009   3.493   3.641
  864    HB3  GLU   3           HB1      GLU   3  48.300   3.838   3.367
  865    HG2  GLU   3           HG2      GLU   3  48.396   1.483   3.335
  866    HG3  GLU   3           HG1      GLU   3  48.401   1.920   1.628
  867    HA   PRO   4           HA       PRO   4  49.216   8.408   1.736
  868    HB2  PRO   4           HB2      PRO   4  46.700   9.041   2.611
  869    HB3  PRO   4           HB1      PRO   4  47.085   8.693   0.915
  870    HG2  PRO   4           HG2      PRO   4  45.829   6.948   2.971
  871    HG3  PRO   4           HG1      PRO   4  45.470   7.098   1.242
  872    HD2  PRO   4           HD2      PRO   4  46.950   5.041   2.295
  873    HD3  PRO   4           HD1      PRO   4  47.145   5.632   0.630
  874    H    PHE   5           HN       PHE   5  47.457   6.681   4.320
  875    HA   PHE   5           HA       PHE   5  49.125   8.058   6.313
  876    HB2  PHE   5           HB2      PHE   5  46.153   8.191   6.061
  877    HB3  PHE   5           HB1      PHE   5  46.846   8.096   7.681
  878    HD1  PHE   5           HD1      PHE   5  47.024  10.002   4.476
  879    HD2  PHE   5           HD2      PHE   5  47.838   9.987   8.693
  880    HE1  PHE   5           HE1      PHE   5  47.610  12.410   4.370
  881    HE2  PHE   5           HE2      PHE   5  48.425  12.395   8.588
  882    HZ   PHE   5           HZ       PHE   5  48.311  13.606   6.427
  883    H    GLN   6           HN       GLN   6  46.293   5.902   6.366
  884    HA   GLN   6           HA       GLN   6  47.865   3.636   7.199
  885    HB2  GLN   6           HB2      GLN   6  46.559   3.414   9.380
  886    HB3  GLN   6           HB1      GLN   6  47.831   4.637   9.350
  887    HG2  GLN   6           HG2      GLN   6  46.194   6.390   8.922
  888    HG3  GLN   6           HG1      GLN   6  44.903   5.199   8.814
  889   HE21  GLN   6          HE21      GLN   6  46.269   7.396  10.927
  890   HE22  GLN   6          HE22      GLN   6  45.795   6.686  12.395
  891    H    ILE   7           HN       ILE   7  46.470   1.739   7.642
  892    HA   ILE   7           HA       ILE   7  44.652   1.261   5.612
  893    HB   ILE   7           HB       ILE   7  43.868  -0.665   7.024
  894   HG12  ILE   7          HG12      ILE   7  45.777  -0.683   9.062
  895   HG13  ILE   7          HG11      ILE   7  45.140   0.956   9.104
  896   HG21  ILE   7          HG21      ILE   7  46.048  -1.798   7.018
  897   HG22  ILE   7          HG22      ILE   7  46.868  -0.242   6.891
  898   HG23  ILE   7          HG23      ILE   7  45.858  -0.818   5.564
  899   HD11  ILE   7          HD11      ILE   7  42.807  -0.113   9.009
  900   HD12  ILE   7          HD12      ILE   7  43.699  -0.294  10.520
  901   HD13  ILE   7          HD13      ILE   7  43.618  -1.636   9.379
  902    H    LEU   8           HN       LEU   8  44.082   2.532   8.853
  903    HA   LEU   8           HA       LEU   8  41.264   2.363   8.833
  904    HB2  LEU   8           HB2      LEU   8  42.920   2.859  10.784
  905    HB3  LEU   8           HB1      LEU   8  42.764   4.538  10.266
  906    HG   LEU   8           HG       LEU   8  40.204   3.085  10.494
  907   HD11  LEU   8          HD11      LEU   8  41.792   3.785  12.983
  908   HD12  LEU   8          HD12      LEU   8  41.495   2.143  12.413
  909   HD13  LEU   8          HD13      LEU   8  40.146   3.153  12.935
  910   HD21  LEU   8          HD21      LEU   8  39.469   5.190  11.371
  911   HD22  LEU   8          HD22      LEU   8  40.598   5.573  10.071
  912   HD23  LEU   8          HD23      LEU   8  41.119   5.683  11.752
  913    H    SER   9           HN       SER   9  43.527   4.734   7.607
  914    HA   SER   9           HA       SER   9  41.606   6.783   7.081
  915    HB2  SER   9           HB2      SER   9  44.400   6.294   6.050
  916    HB3  SER   9           HB1      SER   9  43.437   7.697   5.593
  917    HG   SER   9           HG       SER   9  44.852   7.263   7.828
  918    H    ILE  10           HN       ILE  10  43.035   4.164   5.177
  919    HA   ILE  10           HA       ILE  10  41.941   4.877   2.674
  920    HB   ILE  10           HB       ILE  10  42.755   2.204   3.829
  921   HG12  ILE  10          HG12      ILE  10  44.076   3.863   1.670
  922   HG13  ILE  10          HG11      ILE  10  44.456   4.077   3.380
  923   HG21  ILE  10          HG21      ILE  10  41.147   1.718   2.109
  924   HG22  ILE  10          HG22      ILE  10  42.744   1.485   1.396
  925   HG23  ILE  10          HG23      ILE  10  41.826   2.949   1.044
  926   HD11  ILE  10          HD11      ILE  10  45.183   1.776   3.571
  927   HD12  ILE  10          HD12      ILE  10  46.006   2.490   2.184
  928   HD13  ILE  10          HD13      ILE  10  44.627   1.416   1.936
  929    H    CYS  11           HN       CYS  11  40.736   2.651   5.200
  930    HA   CYS  11           HA       CYS  11  38.375   1.910   3.844
  931    HB2  CYS  11           HB2      CYS  11  39.065   1.998   6.784
  932    HB3  CYS  11           HB1      CYS  11  37.552   1.335   6.166
  933    HG   CYS  11           HG       CYS  11  39.544  -0.082   4.608
  934    H    SER  12           HN       SER  12  38.895   4.361   6.380
  935    HA   SER  12           HA       SER  12  36.319   5.345   6.550
  936    HB2  SER  12           HB2      SER  12  38.159   6.034   8.046
  937    HB3  SER  12           HB1      SER  12  38.884   6.950   6.728
  938    HG   SER  12           HG       SER  12  37.636   8.369   7.866
  939    H    PHE  13           HN       PHE  13  38.888   6.290   4.292
  940    HA   PHE  13           HA       PHE  13  37.559   8.390   3.018
  941    HB2  PHE  13           HB2      PHE  13  39.888   8.058   2.589
  942    HB3  PHE  13           HB1      PHE  13  39.611   6.416   2.007
  943    HD1  PHE  13           HD1      PHE  13  38.963  10.010   1.268
  944    HD2  PHE  13           HD2      PHE  13  38.967   5.988  -0.240
  945    HE1  PHE  13           HE1      PHE  13  38.611  10.871  -1.032
  946    HE2  PHE  13           HE2      PHE  13  38.615   6.849  -2.539
  947    HZ   PHE  13           HZ       PHE  13  38.438   9.290  -2.935
  948    H    ILE  14           HN       ILE  14  37.644   4.922   2.175
  949    HA   ILE  14           HA       ILE  14  35.984   5.124  -0.099
  950    HB   ILE  14           HB       ILE  14  36.479   2.800   1.776
  951   HG12  ILE  14          HG12      ILE  14  38.414   3.863   0.454
  952   HG13  ILE  14          HG11      ILE  14  38.169   2.132   0.240
  953   HG21  ILE  14          HG21      ILE  14  35.735   1.483  -0.309
  954   HG22  ILE  14          HG22      ILE  14  35.031   3.000  -0.872
  955   HG23  ILE  14          HG23      ILE  14  34.470   2.272   0.633
  956   HD11  ILE  14          HD11      ILE  14  36.898   4.141  -1.625
  957   HD12  ILE  14          HD12      ILE  14  37.176   2.422  -1.891
  958   HD13  ILE  14          HD13      ILE  14  38.535   3.544  -1.883
  959    H    LEU  15           HN       LEU  15  35.232   4.409   3.290
  960    HA   LEU  15           HA       LEU  15  32.477   3.921   2.942
  961    HB2  LEU  15           HB2      LEU  15  34.054   4.897   5.333
  962    HB3  LEU  15           HB1      LEU  15  32.348   4.453   5.402
  963    HG   LEU  15           HG       LEU  15  34.507   2.593   4.376
  964   HD11  LEU  15          HD11      LEU  15  33.245   2.754   7.131
  965   HD12  LEU  15          HD12      LEU  15  34.927   3.118   6.741
  966   HD13  LEU  15          HD13      LEU  15  34.319   1.469   6.579
  967   HD21  LEU  15          HD21      LEU  15  32.663   0.907   4.969
  968   HD22  LEU  15          HD22      LEU  15  32.355   1.933   3.570
  969   HD23  LEU  15          HD23      LEU  15  31.585   2.295   5.113
  970    H    SER  16           HN       SER  16  34.323   6.863   3.346
  971    HA   SER  16           HA       SER  16  32.074   8.577   3.830
  972    HB2  SER  16           HB2      SER  16  34.894   9.163   2.924
  973    HB3  SER  16           HB1      SER  16  33.703  10.403   3.306
  974    HG   SER  16           HG       SER  16  33.599   9.601   5.398
  975    H    ALA  17           HN       ALA  17  34.107   7.935   0.973
  976    HA   ALA  17           HA       ALA  17  32.724   9.631  -0.795
  977    HB1  ALA  17           HB1      ALA  17  34.766   8.940  -1.645
  978    HB2  ALA  17           HB2      ALA  17  33.666   7.887  -2.532
  979    HB3  ALA  17           HB3      ALA  17  34.537   7.270  -1.128
  980    H    LEU  18           HN       LEU  18  32.235   6.221   0.053
  981    HA   LEU  18           HA       LEU  18  30.185   5.766  -1.865
  982    HB2  LEU  18           HB2      LEU  18  31.327   4.336   0.467
  983    HB3  LEU  18           HB1      LEU  18  29.678   3.906   0.011
  984    HG   LEU  18           HG       LEU  18  30.344   3.337  -2.216
  985   HD11  LEU  18          HD11      LEU  18  31.880   5.026  -2.836
  986   HD12  LEU  18          HD12      LEU  18  32.859   3.562  -2.803
  987   HD13  LEU  18          HD13      LEU  18  32.932   4.701  -1.460
  988   HD21  LEU  18          HD21      LEU  18  32.281   2.331  -0.118
  989   HD22  LEU  18          HD22      LEU  18  32.209   1.663  -1.749
  990   HD23  LEU  18          HD23      LEU  18  30.804   1.554  -0.688
  991    H    HIS  19           HN       HIS  19  30.153   6.725   1.556
  992    HA   HIS  19           HA       HIS  19  27.404   6.547   1.988
  993    HB2  HIS  19           HB2      HIS  19  29.108   6.890   3.753
  994    HB3  HIS  19           HB1      HIS  19  29.342   8.543   3.181
  995    HD2  HIS  19           HD2      HIS  19  26.409   6.399   4.767
  996    HE1  HIS  19           HE1      HIS  19  25.628  10.496   5.421
  997    HE2  HIS  19           HE2      HIS  19  24.831   8.135   5.914
  998    H    PHE  20           HN       PHE  20  29.357   9.217   0.739
  999    HA   PHE  20           HA       PHE  20  27.133  11.025   0.535
 1000    HB2  PHE  20           HB2      PHE  20  29.983  11.150   0.233
 1001    HB3  PHE  20           HB1      PHE  20  29.216  11.855  -1.191
 1002    HD1  PHE  20           HD1      PHE  20  29.512  12.055   2.499
 1003    HD2  PHE  20           HD2      PHE  20  27.904  13.872  -1.047
 1004    HE1  PHE  20           HE1      PHE  20  28.975  14.105   3.790
 1005    HE2  PHE  20           HE2      PHE  20  27.367  15.919   0.244
 1006    HZ   PHE  20           HZ       PHE  20  27.911  16.044   2.663
 1007    H    MET  21           HN       MET  21  28.730   8.738  -1.601
 1008    HA   MET  21           HA       MET  21  27.531   9.693  -4.009
 1009    HB2  MET  21           HB2      MET  21  29.025   7.223  -3.207
 1010    HB3  MET  21           HB1      MET  21  28.212   7.299  -4.773
 1011    HG2  MET  21           HG2      MET  21  29.411   9.413  -5.273
 1012    HG3  MET  21           HG1      MET  21  30.261   9.279  -3.734
 1013    HE1  MET  21           HE1      MET  21  32.342   8.538  -7.101
 1014    HE2  MET  21           HE2      MET  21  32.840   9.189  -5.542
 1015    HE3  MET  21           HE3      MET  21  31.376   9.794  -6.313
 1016    H    ALA  22           HN       ALA  22  26.906   6.827  -2.015
 1017    HA   ALA  22           HA       ALA  22  24.683   5.896  -3.436
 1018    HB1  ALA  22           HB1      ALA  22  24.193   4.568  -1.441
 1019    HB2  ALA  22           HB2      ALA  22  25.273   5.581  -0.482
 1020    HB3  ALA  22           HB3      ALA  22  25.927   4.558  -1.760
 1021    H    TRP  23           HN       TRP  23  24.907   8.059  -0.604
 1022    HA   TRP  23           HA       TRP  23  22.085   8.316  -0.418
 1023    HB2  TRP  23           HB2      TRP  23  24.367   9.840   0.791
 1024    HB3  TRP  23           HB1      TRP  23  22.700  10.370   1.005
 1025    HD1  TRP  23           HD1      TRP  23  25.032   8.692   2.959
 1026    HE1  TRP  23           HE1      TRP  23  24.013   6.877   4.479
 1027    HE3  TRP  23           HE3      TRP  23  20.510   8.026   0.656
 1028    HZ2  TRP  23           HZ2      TRP  23  21.606   5.338   4.687
 1029    HZ3  TRP  23           HZ3      TRP  23  18.891   6.367   1.515
 1030    HH2  TRP  23           HH2      TRP  23  19.424   5.030   3.540
 1031    H    THR  24           HN       THR  24  24.539   9.981  -2.221
 1032    HA   THR  24           HA       THR  24  23.067  12.314  -2.858
 1033    HB   THR  24           HB       THR  24  25.408  10.877  -4.013
 1034    HG1  THR  24           HG1      THR  24  26.386  12.588  -3.246
 1035   HG21  THR  24          HG21      THR  24  24.324  11.415  -6.051
 1036   HG22  THR  24          HG22      THR  24  25.460  12.734  -5.777
 1037   HG23  THR  24          HG23      THR  24  23.746  12.961  -5.430
 1038    H    ILE  25           HN       ILE  25  23.577   9.333  -4.746
 1039    HA   ILE  25           HA       ILE  25  21.792   9.975  -6.831
 1040    HB   ILE  25           HB       ILE  25  22.761   7.311  -5.781
 1041   HG12  ILE  25          HG12      ILE  25  23.456   8.729  -8.361
 1042   HG13  ILE  25          HG11      ILE  25  24.343   9.035  -6.868
 1043   HG21  ILE  25          HG21      ILE  25  21.970   6.506  -8.075
 1044   HG22  ILE  25          HG22      ILE  25  21.041   8.002  -8.174
 1045   HG23  ILE  25          HG23      ILE  25  20.700   6.836  -6.896
 1046   HD11  ILE  25          HD11      ILE  25  25.530   7.308  -8.063
 1047   HD12  ILE  25          HD12      ILE  25  24.046   6.389  -8.312
 1048   HD13  ILE  25          HD13      ILE  25  24.727   6.542  -6.693
 1049    H    GLY  26           HN       GLY  26  21.312   8.236  -3.789
 1050    HA2  GLY  26           HA2      GLY  26  18.646   7.411  -4.221
 1051    HA3  GLY  26           HA1      GLY  26  19.408   7.627  -2.647
 1052    H    HIS  27           HN       HIS  27  20.019  10.374  -2.866
 1053    HA   HIS  27           HA       HIS  27  17.575  11.544  -2.021
 1054    HB2  HIS  27           HB2      HIS  27  19.544  12.448  -1.079
 1055    HB3  HIS  27           HB1      HIS  27  20.291  12.679  -2.661
 1056    HD2  HIS  27           HD2      HIS  27  19.917  15.214  -3.668
 1057    HE1  HIS  27           HE1      HIS  27  16.619  16.337  -1.283
 1058    HE2  HIS  27           HE2      HIS  27  18.258  17.133  -3.053
 1059    H    LEU  28           HN       LEU  28  19.410  11.700  -5.040
 1060    HA   LEU  28           HA       LEU  28  17.899  13.728  -6.292
 1061    HB2  LEU  28           HB2      LEU  28  20.158  12.538  -6.968
 1062    HB3  LEU  28           HB1      LEU  28  19.078  11.491  -7.889
 1063    HG   LEU  28           HG       LEU  28  18.019  13.742  -8.706
 1064   HD11  LEU  28          HD11      LEU  28  19.768  15.542  -8.846
 1065   HD12  LEU  28          HD12      LEU  28  20.764  14.597  -7.740
 1066   HD13  LEU  28          HD13      LEU  28  19.208  15.231  -7.202
 1067   HD21  LEU  28          HD21      LEU  28  19.524  13.747 -10.605
 1068   HD22  LEU  28          HD22      LEU  28  19.342  12.079 -10.064
 1069   HD23  LEU  28          HD23      LEU  28  20.798  12.984  -9.654
 1070    H    ASN  29           HN       ASN  29  16.120  13.666  -7.629
 1071    HA   ASN  29           HA       ASN  29  14.345  11.385  -7.273
 1072    HB2  ASN  29           HB2      ASN  29  14.037  14.143  -8.447
 1073    HB3  ASN  29           HB1      ASN  29  12.789  12.914  -8.649
 1074   HD21  ASN  29          HD21      ASN  29  14.208  15.166  -6.390
 1075   HD22  ASN  29          HD22      ASN  29  13.199  14.787  -5.079
 1076    H    GLN  30           HN       GLN  30  14.327   9.738  -8.649
 1077    HA   GLN  30           HA       GLN  30  15.059  10.253 -11.472
 1078    HB2  GLN  30           HB2      GLN  30  16.662   8.833 -10.054
 1079    HB3  GLN  30           HB1      GLN  30  15.396   7.606 -10.063
 1080    HG2  GLN  30           HG2      GLN  30  16.719   7.031 -11.923
 1081    HG3  GLN  30           HG1      GLN  30  15.389   7.940 -12.637
 1082   HE21  GLN  30          HE21      GLN  30  17.580   7.946 -14.214
 1083   HE22  GLN  30          HE22      GLN  30  18.441   9.404 -14.101
 1084    H    ILE  31           HN       ILE  31  13.378  10.035 -12.793
 1085    HA   ILE  31           HA       ILE  31  11.276   8.074 -12.083
 1086    HB   ILE  31           HB       ILE  31  10.928  10.722 -13.516
 1087   HG12  ILE  31          HG12      ILE  31   9.932   9.860 -10.784
 1088   HG13  ILE  31          HG11      ILE  31  11.384  10.831 -11.026
 1089   HG21  ILE  31          HG21      ILE  31   8.502  10.167 -13.261
 1090   HG22  ILE  31          HG22      ILE  31   8.963   8.575 -12.658
 1091   HG23  ILE  31          HG23      ILE  31   9.355   9.038 -14.314
 1092   HD11  ILE  31          HD11      ILE  31   8.602  11.588 -11.969
 1093   HD12  ILE  31          HD12      ILE  31  10.059  12.562 -12.163
 1094   HD13  ILE  31          HD13      ILE  31   9.412  12.255 -10.551
 1095    H    LYS  32           HN       LYS  32  11.139   6.455 -13.493
 1096    HA   LYS  32           HA       LYS  32  12.580   6.485 -15.972
 1097    HB2  LYS  32           HB2      LYS  32  11.729   4.510 -14.313
 1098    HB3  LYS  32           HB1      LYS  32  10.503   4.419 -15.577
 1099    HG2  LYS  32           HG2      LYS  32  12.269   2.974 -16.284
 1100    HG3  LYS  32           HG1      LYS  32  12.428   4.437 -17.257
 1101    HD2  LYS  32           HD2      LYS  32  14.598   4.364 -16.556
 1102    HD3  LYS  32           HD1      LYS  32  13.944   5.108 -15.097
 1103    HE2  LYS  32           HE2      LYS  32  15.112   3.289 -14.212
 1104    HE3  LYS  32           HE1      LYS  32  13.485   2.628 -14.368
 1105    HZ1  LYS  32           HZ1      LYS  32  14.066   1.549 -16.371
 1106    HZ2  LYS  32           HZ2      LYS  32  15.311   1.203 -15.269
 1107    HZ3  LYS  32           HZ3      LYS  32  15.546   2.369 -16.481
 1108    H    ARG  33           HN       ARG  33  11.780   8.065 -17.321
 1109    HA   ARG  33           HA       ARG  33   8.933   8.212 -17.891
 1110    HB2  ARG  33           HB2      ARG  33  11.060  10.020 -18.005
 1111    HB3  ARG  33           HB1      ARG  33  10.636   9.722 -19.692
 1112    HG2  ARG  33           HG2      ARG  33   8.356  10.354 -19.328
 1113    HG3  ARG  33           HG1      ARG  33   8.565  10.348 -17.576
 1114    HD2  ARG  33           HD2      ARG  33   8.576  12.651 -18.547
 1115    HD3  ARG  33           HD1      ARG  33  10.068  12.250 -17.699
 1116    HE   ARG  33           HE       ARG  33  11.196  12.372 -19.721
 1117   HH11  ARG  33          HH11      ARG  33   7.763  12.159 -20.273
 1118   HH12  ARG  33          HH12      ARG  33   7.899  12.463 -21.971
 1119   HH21  ARG  33          HH21      ARG  33  11.343  12.771 -21.935
 1120   HH22  ARG  33          HH22      ARG  33   9.911  12.808 -22.908
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  54.519  25.491  10.936
    2    H2   MET   1           HT2      MET   1  53.833  26.837  11.715
    3    H3   MET   1           HT3      MET   1  53.985  26.817  10.023
    4    HA   MET   1           HA       MET   1  52.460  24.872   9.969
    5    HB2  MET   1           HB2      MET   1  52.591  25.459  12.888
    6    HB3  MET   1           HB1      MET   1  51.016  25.009  12.231
    7    HG2  MET   1           HG2      MET   1  52.001  22.976  11.245
    8    HG3  MET   1           HG1      MET   1  53.579  23.422  11.895
    9    HE1  MET   1           HE1      MET   1  49.843  21.996  14.094
   10    HE2  MET   1           HE2      MET   1  50.058  22.376  12.387
   11    HE3  MET   1           HE3      MET   1  49.900  23.681  13.559
   12    H    PHE   2           HN       PHE   2  51.580  26.272   8.462
   13    HA   PHE   2           HA       PHE   2  50.241  28.706   9.317
   14    HB2  PHE   2           HB2      PHE   2  50.405  27.388   6.594
   15    HB3  PHE   2           HB1      PHE   2  49.752  28.994   6.921
   16    HD1  PHE   2           HD1      PHE   2  52.705  27.099   6.208
   17    HD2  PHE   2           HD2      PHE   2  51.310  30.692   8.103
   18    HE1  PHE   2           HE1      PHE   2  54.992  28.049   6.087
   19    HE2  PHE   2           HE2      PHE   2  53.598  31.643   7.981
   20    HZ   PHE   2           HZ       PHE   2  55.439  30.321   6.974
   21    H    GLU   3           HN       GLU   3  49.445  25.410   8.523
   22    HA   GLU   3           HA       GLU   3  46.643  25.913   8.124
   23    HB2  GLU   3           HB2      GLU   3  46.436  23.461   8.111
   24    HB3  GLU   3           HB1      GLU   3  47.743  23.997   7.057
   25    HG2  GLU   3           HG2      GLU   3  48.875  23.676   9.632
   26    HG3  GLU   3           HG1      GLU   3  47.872  22.254   9.350
   27    HA   PRO   4           HA       PRO   4  45.348  25.810  12.365
   28    HB2  PRO   4           HB2      PRO   4  42.842  24.739  12.118
   29    HB3  PRO   4           HB1      PRO   4  43.243  26.399  11.635
   30    HG2  PRO   4           HG2      PRO   4  42.911  23.967   9.956
   31    HG3  PRO   4           HG1      PRO   4  42.431  25.640   9.632
   32    HD2  PRO   4           HD2      PRO   4  44.674  24.484   8.555
   33    HD3  PRO   4           HD1      PRO   4  44.513  26.228   8.840
   34    H    PHE   5           HN       PHE   5  44.628  22.824  10.560
   35    HA   PHE   5           HA       PHE   5  45.724  21.253  12.780
   36    HB2  PHE   5           HB2      PHE   5  42.897  21.348  12.025
   37    HB3  PHE   5           HB1      PHE   5  43.556  19.714  11.991
   38    HD1  PHE   5           HD1      PHE   5  42.731  22.593  14.095
   39    HD2  PHE   5           HD2      PHE   5  44.525  18.694  14.002
   40    HE1  PHE   5           HE1      PHE   5  42.630  22.490  16.570
   41    HE2  PHE   5           HE2      PHE   5  44.427  18.588  16.476
   42    HZ   PHE   5           HZ       PHE   5  43.478  20.485  17.762
   43    H    GLN   6           HN       GLN   6  43.809  20.097  10.042
   44    HA   GLN   6           HA       GLN   6  46.180  19.373   8.522
   45    HB2  GLN   6           HB2      GLN   6  44.313  17.290   9.677
   46    HB3  GLN   6           HB1      GLN   6  45.544  16.970   8.455
   47    HG2  GLN   6           HG2      GLN   6  47.257  17.892  10.064
   48    HG3  GLN   6           HG1      GLN   6  45.988  17.949  11.287
   49   HE21  GLN   6          HE21      GLN   6  45.504  16.014  12.388
   50   HE22  GLN   6          HE22      GLN   6  46.180  14.508  11.991
   51    H    ILE   7           HN       ILE   7  45.617  18.462   6.423
   52    HA   ILE   7           HA       ILE   7  43.586  19.892   5.127
   53    HB   ILE   7           HB       ILE   7  44.073  18.486   3.192
   54   HG12  ILE   7          HG12      ILE   7  45.527  16.733   5.203
   55   HG13  ILE   7          HG11      ILE   7  44.083  16.298   4.288
   56   HG21  ILE   7          HG21      ILE   7  45.755  20.209   4.074
   57   HG22  ILE   7          HG22      ILE   7  46.394  18.984   2.979
   58   HG23  ILE   7          HG23      ILE   7  46.662  18.841   4.717
   59   HD11  ILE   7          HD11      ILE   7  46.861  16.802   3.210
   60   HD12  ILE   7          HD12      ILE   7  45.436  16.714   2.174
   61   HD13  ILE   7          HD13      ILE   7  45.925  15.312   3.124
   62    H    LEU   8           HN       LEU   8  43.618  16.691   6.561
   63    HA   LEU   8           HA       LEU   8  41.078  15.862   5.526
   64    HB2  LEU   8           HB2      LEU   8  42.762  14.845   7.827
   65    HB3  LEU   8           HB1      LEU   8  41.262  14.082   7.297
   66    HG   LEU   8           HG       LEU   8  43.599  14.606   5.440
   67   HD11  LEU   8          HD11      LEU   8  42.887  12.152   7.068
   68   HD12  LEU   8          HD12      LEU   8  44.398  13.060   7.101
   69   HD13  LEU   8          HD13      LEU   8  43.973  12.109   5.678
   70   HD21  LEU   8          HD21      LEU   8  42.370  12.746   4.160
   71   HD22  LEU   8          HD22      LEU   8  41.574  14.318   4.203
   72   HD23  LEU   8          HD23      LEU   8  41.024  13.022   5.265
   73    H    SER   9           HN       SER   9  42.180  17.532   8.384
   74    HA   SER   9           HA       SER   9  39.719  17.361   9.837
   75    HB2  SER   9           HB2      SER   9  41.851  17.805  10.974
   76    HB3  SER   9           HB1      SER   9  42.000  19.334  10.111
   77    HG   SER   9           HG       SER   9  40.675  20.184  11.497
   78    H    ILE  10           HN       ILE  10  41.189  19.812   7.731
   79    HA   ILE  10           HA       ILE  10  39.178  21.777   8.041
   80    HB   ILE  10           HB       ILE  10  41.117  21.228   5.789
   81   HG12  ILE  10          HG12      ILE  10  41.107  23.462   7.829
   82   HG13  ILE  10          HG11      ILE  10  41.919  21.924   8.129
   83   HG21  ILE  10          HG21      ILE  10  40.559  23.652   5.190
   84   HG22  ILE  10          HG22      ILE  10  39.143  23.481   6.227
   85   HG23  ILE  10          HG23      ILE  10  39.319  22.459   4.801
   86   HD11  ILE  10          HD11      ILE  10  43.365  23.783   7.128
   87   HD12  ILE  10          HD12      ILE  10  42.443  23.568   5.645
   88   HD13  ILE  10          HD13      ILE  10  43.403  22.235   6.288
   89    H    CYS  11           HN       CYS  11  39.632  19.225   5.599
   90    HA   CYS  11           HA       CYS  11  37.403  19.838   4.002
   91    HB2  CYS  11           HB2      CYS  11  39.261  18.207   3.463
   92    HB3  CYS  11           HB1      CYS  11  38.467  17.061   4.542
   93    HG   CYS  11           HG       CYS  11  36.800  18.245   2.194
   94    H    SER  12           HN       SER  12  37.692  17.490   6.692
   95    HA   SER  12           HA       SER  12  35.002  16.697   6.682
   96    HB2  SER  12           HB2      SER  12  35.422  15.929   8.980
   97    HB3  SER  12           HB1      SER  12  36.745  15.482   7.905
   98    HG   SER  12           HG       SER  12  37.644  16.399   9.714
   99    H    PHE  13           HN       PHE  13  36.635  19.383   8.359
  100    HA   PHE  13           HA       PHE  13  34.572  20.182  10.041
  101    HB2  PHE  13           HB2      PHE  13  36.737  21.180  10.255
  102    HB3  PHE  13           HB1      PHE  13  36.692  21.773   8.595
  103    HD1  PHE  13           HD1      PHE  13  35.010  22.074  11.911
  104    HD2  PHE  13           HD2      PHE  13  35.720  23.866   8.073
  105    HE1  PHE  13           HE1      PHE  13  33.918  24.162  12.683
  106    HE2  PHE  13           HE2      PHE  13  34.629  25.956   8.845
  107    HZ   PHE  13           HZ       PHE  13  33.727  26.103  11.150
  108    H    ILE  14           HN       ILE  14  35.307  21.487   6.798
  109    HA   ILE  14           HA       ILE  14  32.976  23.084   6.643
  110    HB   ILE  14           HB       ILE  14  34.910  23.514   5.225
  111   HG12  ILE  14          HG12      ILE  14  33.701  23.548   2.957
  112   HG13  ILE  14          HG11      ILE  14  32.341  22.809   3.787
  113   HG21  ILE  14          HG21      ILE  14  35.587  21.148   4.914
  114   HG22  ILE  14          HG22      ILE  14  35.520  22.029   3.396
  115   HG23  ILE  14          HG23      ILE  14  34.226  20.918   3.818
  116   HD11  ILE  14          HD11      ILE  14  33.644  25.461   4.439
  117   HD12  ILE  14          HD12      ILE  14  32.419  24.698   5.448
  118   HD13  ILE  14          HD13      ILE  14  32.016  25.207   3.811
  119    H    LEU  15           HN       LEU  15  33.681  19.793   5.582
  120    HA   LEU  15           HA       LEU  15  31.263  19.358   4.185
  121    HB2  LEU  15           HB2      LEU  15  33.371  17.597   5.378
  122    HB3  LEU  15           HB1      LEU  15  31.856  16.873   4.838
  123    HG   LEU  15           HG       LEU  15  33.399  18.754   3.050
  124   HD11  LEU  15          HD11      LEU  15  34.556  16.859   2.081
  125   HD12  LEU  15          HD12      LEU  15  33.693  15.738   3.134
  126   HD13  LEU  15          HD13      LEU  15  34.876  16.853   3.816
  127   HD21  LEU  15          HD21      LEU  15  31.503  16.445   2.508
  128   HD22  LEU  15          HD22      LEU  15  32.177  17.540   1.302
  129   HD23  LEU  15          HD23      LEU  15  31.041  18.147   2.504
  130    H    SER  16           HN       SER  16  32.083  19.294   7.547
  131    HA   SER  16           HA       SER  16  29.780  17.829   8.420
  132    HB2  SER  16           HB2      SER  16  31.691  19.620   9.916
  133    HB3  SER  16           HB1      SER  16  30.437  18.639  10.670
  134    HG   SER  16           HG       SER  16  32.112  17.292  10.680
  135    H    ALA  17           HN       ALA  17  30.681  21.265   8.310
  136    HA   ALA  17           HA       ALA  17  28.378  22.300   9.514
  137    HB1  ALA  17           HB1      ALA  17  29.061  24.388   8.710
  138    HB2  ALA  17           HB2      ALA  17  29.715  23.708   7.219
  139    HB3  ALA  17           HB3      ALA  17  30.574  23.483   8.743
  140    H    LEU  18           HN       LEU  18  29.065  21.812   6.037
  141    HA   LEU  18           HA       LEU  18  26.447  22.567   5.205
  142    HB2  LEU  18           HB2      LEU  18  28.652  22.462   3.839
  143    HB3  LEU  18           HB1      LEU  18  28.244  20.760   3.616
  144    HG   LEU  18           HG       LEU  18  25.970  22.565   3.171
  145   HD11  LEU  18          HD11      LEU  18  26.745  23.524   1.102
  146   HD12  LEU  18          HD12      LEU  18  28.264  22.634   1.195
  147   HD13  LEU  18          HD13      LEU  18  27.933  23.935   2.338
  148   HD21  LEU  18          HD21      LEU  18  25.706  21.125   1.211
  149   HD22  LEU  18          HD22      LEU  18  26.051  20.136   2.630
  150   HD23  LEU  18          HD23      LEU  18  27.323  20.464   1.454
  151    H    HIS  19           HN       HIS  19  27.864  19.638   6.364
  152    HA   HIS  19           HA       HIS  19  26.039  17.775   5.269
  153    HB2  HIS  19           HB2      HIS  19  27.893  16.737   6.169
  154    HB3  HIS  19           HB1      HIS  19  27.909  17.768   7.591
  155    HD2  HIS  19           HD2      HIS  19  26.150  16.966   9.678
  156    HE1  HIS  19           HE1      HIS  19  25.042  13.302   7.895
  157    HE2  HIS  19           HE2      HIS  19  24.928  14.684  10.022
  158    H    PHE  20           HN       PHE  20  26.100  19.355   8.458
  159    HA   PHE  20           HA       PHE  20  23.541  18.299   9.197
  160    HB2  PHE  20           HB2      PHE  20  25.656  19.756  10.463
  161    HB3  PHE  20           HB1      PHE  20  24.136  20.606  10.738
  162    HD1  PHE  20           HD1      PHE  20  26.200  17.935  11.833
  163    HD2  PHE  20           HD2      PHE  20  22.084  19.082  11.390
  164    HE1  PHE  20           HE1      PHE  20  25.543  16.236  13.519
  165    HE2  PHE  20           HE2      PHE  20  21.429  17.385  13.073
  166    HZ   PHE  20           HZ       PHE  20  23.155  15.965  14.139
  167    H    MET  21           HN       MET  21  24.633  21.032   7.376
  168    HA   MET  21           HA       MET  21  22.368  22.712   7.794
  169    HB2  MET  21           HB2      MET  21  24.815  22.859   6.448
  170    HB3  MET  21           HB1      MET  21  23.588  23.025   5.195
  171    HG2  MET  21           HG2      MET  21  24.000  25.233   6.036
  172    HG3  MET  21           HG1      MET  21  22.448  24.725   6.701
  173    HE1  MET  21           HE1      MET  21  21.938  25.624   8.758
  174    HE2  MET  21           HE2      MET  21  23.061  26.920   8.356
  175    HE3  MET  21           HE3      MET  21  23.075  26.223   9.973
  176    H    ALA  22           HN       ALA  22  23.296  20.674   5.021
  177    HA   ALA  22           HA       ALA  22  20.820  20.954   3.670
  178    HB1  ALA  22           HB1      ALA  22  21.684  19.532   2.086
  179    HB2  ALA  22           HB2      ALA  22  22.474  18.504   3.281
  180    HB3  ALA  22           HB3      ALA  22  23.175  20.066   2.859
  181    H    TRP  23           HN       TRP  23  22.042  18.519   5.939
  182    HA   TRP  23           HA       TRP  23  19.935  16.670   5.673
  183    HB2  TRP  23           HB2      TRP  23  22.215  16.472   6.905
  184    HB3  TRP  23           HB1      TRP  23  21.350  17.159   8.278
  185    HD1  TRP  23           HD1      TRP  23  21.799  14.005   6.314
  186    HE1  TRP  23           HE1      TRP  23  20.341  12.133   7.323
  187    HE3  TRP  23           HE3      TRP  23  18.959  16.746   9.557
  188    HZ2  TRP  23           HZ2      TRP  23  18.246  11.838   9.247
  189    HZ3  TRP  23           HZ3      TRP  23  17.239  15.646  10.962
  190    HH2  TRP  23           HH2      TRP  23  16.879  13.197  10.810
  191    H    THR  24           HN       THR  24  20.331  19.502   7.786
  192    HA   THR  24           HA       THR  24  17.936  19.089   9.272
  193    HB   THR  24           HB       THR  24  18.226  21.570   9.797
  194    HG1  THR  24           HG1      THR  24  19.350  22.231   8.018
  195   HG21  THR  24          HG21      THR  24  20.331  19.469  10.298
  196   HG22  THR  24          HG22      THR  24  19.093  20.079  11.396
  197   HG23  THR  24          HG23      THR  24  20.481  21.086  10.987
  198    H    ILE  25           HN       ILE  25  18.701  20.859   6.308
  199    HA   ILE  25           HA       ILE  25  16.234  22.205   6.036
  200    HB   ILE  25           HB       ILE  25  18.266  21.287   3.999
  201   HG12  ILE  25          HG12      ILE  25  17.585  24.074   4.963
  202   HG13  ILE  25          HG11      ILE  25  18.814  23.080   5.743
  203   HG21  ILE  25          HG21      ILE  25  15.755  22.949   3.673
  204   HG22  ILE  25          HG22      ILE  25  16.176  21.465   2.818
  205   HG23  ILE  25          HG23      ILE  25  17.072  22.950   2.502
  206   HD11  ILE  25          HD11      ILE  25  18.781  24.028   2.866
  207   HD12  ILE  25          HD12      ILE  25  19.918  22.831   3.483
  208   HD13  ILE  25          HD13      ILE  25  19.935  24.473   4.123
  209    H    GLY  26           HN       GLY  26  17.342  19.047   4.825
  210    HA2  GLY  26           HA2      GLY  26  14.994  18.395   3.390
  211    HA3  GLY  26           HA1      GLY  26  16.175  17.237   3.993
  212    H    HIS  27           HN       HIS  27  15.984  17.769   6.737
  213    HA   HIS  27           HA       HIS  27  13.809  16.151   7.489
  214    HB2  HIS  27           HB2      HIS  27  15.685  16.236   8.947
  215    HB3  HIS  27           HB1      HIS  27  15.605  17.994   9.068
  216    HD2  HIS  27           HD2      HIS  27  14.120  18.871  11.217
  217    HE1  HIS  27           HE1      HIS  27  12.019  15.293  12.000
  218    HE2  HIS  27           HE2      HIS  27  12.431  17.667  12.804
  219    H    LEU  28           HN       LEU  28  14.234  19.671   7.551
  220    HA   LEU  28           HA       LEU  28  11.555  20.070   8.615
  221    HB2  LEU  28           HB2      LEU  28  13.654  22.043   7.683
  222    HB3  LEU  28           HB1      LEU  28  12.137  22.470   8.475
  223    HG   LEU  28           HG       LEU  28  14.227  20.644   9.697
  224   HD11  LEU  28          HD11      LEU  28  13.636  23.532  10.400
  225   HD12  LEU  28          HD12      LEU  28  14.971  23.046   9.355
  226   HD13  LEU  28          HD13      LEU  28  14.931  22.517  11.037
  227   HD21  LEU  28          HD21      LEU  28  11.667  21.922  10.691
  228   HD22  LEU  28          HD22      LEU  28  12.885  21.270  11.787
  229   HD23  LEU  28          HD23      LEU  28  12.071  20.206  10.642
  230    H    ASN  29           HN       ASN  29   9.785  20.638   7.471
  231    HA   ASN  29           HA       ASN  29   9.929  20.461   4.575
  232    HB2  ASN  29           HB2      ASN  29   8.112  19.364   5.868
  233    HB3  ASN  29           HB1      ASN  29   7.537  20.958   6.357
  234   HD21  ASN  29          HD21      ASN  29   5.595  21.118   5.165
  235   HD22  ASN  29          HD22      ASN  29   5.514  20.990   3.475
  236    H    GLN  30           HN       GLN  30  10.395  22.187   3.387
  237    HA   GLN  30           HA       GLN  30   9.864  24.866   4.439
  238    HB2  GLN  30           HB2      GLN  30  11.369  23.923   1.986
  239    HB3  GLN  30           HB1      GLN  30  11.184  25.613   2.458
  240    HG2  GLN  30           HG2      GLN  30  12.313  25.175   4.584
  241    HG3  GLN  30           HG1      GLN  30  12.440  23.461   4.185
  242   HE21  GLN  30          HE21      GLN  30  14.589  25.630   4.582
  243   HE22  GLN  30          HE22      GLN  30  15.541  25.520   3.182
  244    H    ILE  31           HN       ILE  31   8.499  26.333   3.480
  245    HA   ILE  31           HA       ILE  31   6.887  25.369   1.201
  246    HB   ILE  31           HB       ILE  31   4.891  26.361   2.264
  247   HG12  ILE  31          HG12      ILE  31   6.635  26.645   4.729
  248   HG13  ILE  31          HG11      ILE  31   6.234  27.995   3.670
  249   HG21  ILE  31          HG21      ILE  31   6.261  24.421   4.144
  250   HG22  ILE  31          HG22      ILE  31   5.573  23.942   2.592
  251   HG23  ILE  31          HG23      ILE  31   4.529  24.594   3.855
  252   HD11  ILE  31          HD11      ILE  31   4.696  27.824   5.629
  253   HD12  ILE  31          HD12      ILE  31   4.188  26.237   5.052
  254   HD13  ILE  31          HD13      ILE  31   3.854  27.674   4.086
  255    H    LYS  32           HN       LYS  32   5.932  27.045  -0.092
  256    HA   LYS  32           HA       LYS  32   7.612  29.422  -0.225
  257    HB2  LYS  32           HB2      LYS  32   5.653  28.074  -2.031
  258    HB3  LYS  32           HB1      LYS  32   5.953  29.797  -2.261
  259    HG2  LYS  32           HG2      LYS  32   8.296  27.957  -1.936
  260    HG3  LYS  32           HG1      LYS  32   7.463  28.007  -3.491
  261    HD2  LYS  32           HD2      LYS  32   7.992  30.663  -2.337
  262    HD3  LYS  32           HD1      LYS  32   9.450  29.748  -2.728
  263    HE2  LYS  32           HE2      LYS  32   7.303  29.676  -4.772
  264    HE3  LYS  32           HE1      LYS  32   8.097  31.235  -4.550
  265    HZ1  LYS  32           HZ1      LYS  32   9.181  29.766  -6.208
  266    HZ2  LYS  32           HZ2      LYS  32   9.552  28.682  -4.953
  267    HZ3  LYS  32           HZ3      LYS  32  10.209  30.248  -4.948
  268    H    ARG  33           HN       ARG  33   7.043  30.872   1.322
  269    HA   ARG  33           HA       ARG  33   4.212  31.499   1.751
  270    HB2  ARG  33           HB2      ARG  33   6.753  32.272   3.186
  271    HB3  ARG  33           HB1      ARG  33   5.190  33.000   3.561
  272    HG2  ARG  33           HG2      ARG  33   4.253  30.886   4.187
  273    HG3  ARG  33           HG1      ARG  33   5.639  30.007   3.539
  274    HD2  ARG  33           HD2      ARG  33   5.766  30.172   5.998
  275    HD3  ARG  33           HD1      ARG  33   7.095  31.038   5.234
  276    HE   ARG  33           HE       ARG  33   6.214  33.022   6.053
  277   HH11  ARG  33          HH11      ARG  33   3.848  30.470   6.281
  278   HH12  ARG  33          HH12      ARG  33   2.746  31.412   7.217
  279   HH21  ARG  33          HH21      ARG  33   4.750  34.230   7.279
  280   HH22  ARG  33          HH22      ARG  33   3.249  33.527   7.780
  281    H1   MET   1           HT1      MET   1  47.868  18.260  32.268
  282    H2   MET   1           HT2      MET   1  47.136  17.263  33.432
  283    H3   MET   1           HT3      MET   1  46.716  18.906  33.332
  284    HA   MET   1           HA       MET   1  45.864  18.486  31.049
  285    HB2  MET   1           HB2      MET   1  46.786  15.771  31.861
  286    HB3  MET   1           HB1      MET   1  45.275  15.867  30.956
  287    HG2  MET   1           HG2      MET   1  46.401  17.175  29.197
  288    HG3  MET   1           HG1      MET   1  47.914  17.089  30.099
  289    HE1  MET   1           HE1      MET   1  45.677  13.786  27.884
  290    HE2  MET   1           HE2      MET   1  45.200  15.456  28.175
  291    HE3  MET   1           HE3      MET   1  45.080  14.273  29.475
  292    H    PHE   2           HN       PHE   2  44.178  19.570  32.041
  293    HA   PHE   2           HA       PHE   2  42.580  18.253  34.082
  294    HB2  PHE   2           HB2      PHE   2  42.190  20.902  32.665
  295    HB3  PHE   2           HB1      PHE   2  41.264  20.333  34.055
  296    HD1  PHE   2           HD1      PHE   2  44.214  22.052  32.979
  297    HD2  PHE   2           HD2      PHE   2  42.588  19.709  36.191
  298    HE1  PHE   2           HE1      PHE   2  45.972  22.917  34.500
  299    HE2  PHE   2           HE2      PHE   2  44.345  20.575  37.713
  300    HZ   PHE   2           HZ       PHE   2  46.036  22.180  36.867
  301    H    GLU   3           HN       GLU   3  42.517  18.808  30.647
  302    HA   GLU   3           HA       GLU   3  39.718  18.220  30.344
  303    HB2  GLU   3           HB2      GLU   3  40.211  18.224  27.932
  304    HB3  GLU   3           HB1      GLU   3  40.890  19.645  28.723
  305    HG2  GLU   3           HG2      GLU   3  42.853  17.615  28.908
  306    HG3  GLU   3           HG1      GLU   3  42.252  17.574  27.251
  307    HA   PRO   4           HA       PRO   4  39.990  13.798  30.203
  308    HB2  PRO   4           HB2      PRO   4  37.950  13.205  28.477
  309    HB3  PRO   4           HB1      PRO   4  37.688  13.751  30.144
  310    HG2  PRO   4           HG2      PRO   4  37.510  15.282  27.599
  311    HG3  PRO   4           HG1      PRO   4  36.502  15.379  29.053
  312    HD2  PRO   4           HD2      PRO   4  38.484  17.185  28.475
  313    HD3  PRO   4           HD1      PRO   4  37.950  16.814  30.126
  314    H    PHE   5           HN       PHE   5  39.573  15.320  27.010
  315    HA   PHE   5           HA       PHE   5  41.739  13.644  25.960
  316    HB2  PHE   5           HB2      PHE   5  38.916  13.392  25.232
  317    HB3  PHE   5           HB1      PHE   5  39.953  13.687  23.839
  318    HD1  PHE   5           HD1      PHE   5  39.108  11.359  26.534
  319    HD2  PHE   5           HD2      PHE   5  41.778  12.150  23.267
  320    HE1  PHE   5           HE1      PHE   5  39.867   8.999  26.586
  321    HE2  PHE   5           HE2      PHE   5  42.541   9.792  23.318
  322    HZ   PHE   5           HZ       PHE   5  41.585   8.215  24.976
  323    H    GLN   6           HN       GLN   6  39.429  15.593  24.136
  324    HA   GLN   6           HA       GLN   6  41.259  17.849  23.967
  325    HB2  GLN   6           HB2      GLN   6  40.541  16.179  21.547
  326    HB3  GLN   6           HB1      GLN   6  41.333  17.754  21.484
  327    HG2  GLN   6           HG2      GLN   6  43.154  16.799  22.952
  328    HG3  GLN   6           HG1      GLN   6  42.402  15.217  22.751
  329   HE21  GLN   6          HE21      GLN   6  42.876  14.068  20.842
  330   HE22  GLN   6          HE22      GLN   6  43.772  14.709  19.551
  331    H    ILE   7           HN       ILE   7  40.307  19.653  22.782
  332    HA   ILE   7           HA       ILE   7  37.649  20.147  23.518
  333    HB   ILE   7           HB       ILE   7  37.838  22.167  22.159
  334   HG12  ILE   7          HG12      ILE   7  40.307  20.814  21.017
  335   HG13  ILE   7          HG11      ILE   7  38.823  21.192  20.141
  336   HG21  ILE   7          HG21      ILE   7  39.164  21.865  24.333
  337   HG22  ILE   7          HG22      ILE   7  39.717  23.143  23.252
  338   HG23  ILE   7          HG23      ILE   7  40.577  21.603  23.312
  339   HD11  ILE   7          HD11      ILE   7  40.823  23.141  21.299
  340   HD12  ILE   7          HD12      ILE   7  39.219  23.629  20.751
  341   HD13  ILE   7          HD13      ILE   7  40.369  22.937  19.608
  342    H    LEU   8           HN       LEU   8  39.046  18.889  20.559
  343    HA   LEU   8           HA       LEU   8  36.646  19.021  18.999
  344    HB2  LEU   8           HB2      LEU   8  39.212  17.454  18.646
  345    HB3  LEU   8           HB1      LEU   8  37.899  17.462  17.469
  346    HG   LEU   8           HG       LEU   8  39.238  19.989  18.468
  347   HD11  LEU   8          HD11      LEU   8  39.822  18.275  16.039
  348   HD12  LEU   8          HD12      LEU   8  40.942  18.733  17.322
  349   HD13  LEU   8          HD13      LEU   8  40.352  19.950  16.190
  350   HD21  LEU   8          HD21      LEU   8  38.225  20.818  16.256
  351   HD22  LEU   8          HD22      LEU   8  37.084  20.470  17.553
  352   HD23  LEU   8          HD23      LEU   8  37.303  19.315  16.238
  353    H    SER   9           HN       SER   9  38.119  16.672  21.111
  354    HA   SER   9           HA       SER   9  36.435  14.469  20.384
  355    HB2  SER   9           HB2      SER   9  38.609  14.110  21.467
  356    HB3  SER   9           HB1      SER   9  38.035  14.938  22.912
  357    HG   SER   9           HG       SER   9  37.067  13.165  23.475
  358    H    ILE  10           HN       ILE  10  36.376  16.894  22.976
  359    HA   ILE  10           HA       ILE  10  34.122  15.866  24.347
  360    HB   ILE  10           HB       ILE  10  35.273  18.656  24.181
  361   HG12  ILE  10          HG12      ILE  10  35.320  16.676  26.468
  362   HG13  ILE  10          HG11      ILE  10  36.581  16.714  25.235
  363   HG21  ILE  10          HG21      ILE  10  33.895  18.970  26.313
  364   HG22  ILE  10          HG22      ILE  10  33.011  17.518  25.842
  365   HG23  ILE  10          HG23      ILE  10  32.981  18.946  24.805
  366   HD11  ILE  10          HD11      ILE  10  37.027  18.096  27.343
  367   HD12  ILE  10          HD12      ILE  10  35.762  19.182  26.780
  368   HD13  ILE  10          HD13      ILE  10  37.215  18.940  25.808
  369    H    CYS  11           HN       CYS  11  34.429  18.380  21.839
  370    HA   CYS  11           HA       CYS  11  31.719  19.108  21.713
  371    HB2  CYS  11           HB2      CYS  11  33.670  20.286  20.611
  372    HB3  CYS  11           HB1      CYS  11  33.632  19.030  19.373
  373    HG   CYS  11           HG       CYS  11  31.018  20.642  19.889
  374    H    SER  12           HN       SER  12  33.529  16.736  19.728
  375    HA   SER  12           HA       SER  12  31.325  15.849  18.241
  376    HB2  SER  12           HB2      SER  12  32.684  13.851  17.787
  377    HB3  SER  12           HB1      SER  12  33.642  15.323  17.635
  378    HG   SER  12           HG       SER  12  34.792  13.890  18.890
  379    H    PHE  13           HN       PHE  13  32.599  14.769  21.384
  380    HA   PHE  13           HA       PHE  13  31.082  12.460  21.716
  381    HB2  PHE  13           HB2      PHE  13  32.825  12.971  23.274
  382    HB3  PHE  13           HB1      PHE  13  32.067  14.502  23.711
  383    HD1  PHE  13           HD1      PHE  13  31.568  10.805  23.786
  384    HD2  PHE  13           HD2      PHE  13  30.434  14.611  25.420
  385    HE1  PHE  13           HE1      PHE  13  30.258   9.657  25.550
  386    HE2  PHE  13           HE2      PHE  13  29.123  13.464  27.185
  387    HZ   PHE  13           HZ       PHE  13  29.036  10.986  27.251
  388    H    ILE  14           HN       ILE  14  30.300  15.732  22.924
  389    HA   ILE  14           HA       ILE  14  27.705  15.042  23.822
  390    HB   ILE  14           HB       ILE  14  28.856  17.022  24.654
  391   HG12  ILE  14          HG12      ILE  14  27.003  18.743  24.196
  392   HG13  ILE  14          HG11      ILE  14  26.258  17.518  23.179
  393   HG21  ILE  14          HG21      ILE  14  30.022  17.604  22.544
  394   HG22  ILE  14          HG22      ILE  14  29.208  18.986  23.260
  395   HG23  ILE  14          HG23      ILE  14  28.495  18.175  21.873
  396   HD11  ILE  14          HD11      ILE  14  26.908  17.290  26.126
  397   HD12  ILE  14          HD12      ILE  14  26.362  15.937  25.139
  398   HD13  ILE  14          HD13      ILE  14  25.305  17.324  25.393
  399    H    LEU  15           HN       LEU  15  28.902  16.365  20.774
  400    HA   LEU  15           HA       LEU  15  26.381  16.863  19.604
  401    HB2  LEU  15           HB2      LEU  15  29.166  16.500  18.568
  402    HB3  LEU  15           HB1      LEU  15  27.823  16.513  17.425
  403    HG   LEU  15           HG       LEU  15  28.097  18.670  19.521
  404   HD11  LEU  15          HD11      LEU  15  29.348  20.020  17.945
  405   HD12  LEU  15          HD12      LEU  15  29.233  18.765  16.710
  406   HD13  LEU  15          HD13      LEU  15  30.214  18.497  18.151
  407   HD21  LEU  15          HD21      LEU  15  26.854  18.594  16.751
  408   HD22  LEU  15          HD22      LEU  15  26.756  19.931  17.897
  409   HD23  LEU  15          HD23      LEU  15  25.961  18.401  18.259
  410    H    SER  16           HN       SER  16  28.254  13.983  20.010
  411    HA   SER  16           HA       SER  16  26.881  12.416  18.041
  412    HB2  SER  16           HB2      SER  16  28.598  11.612  20.386
  413    HB3  SER  16           HB1      SER  16  27.994  10.503  19.156
  414    HG   SER  16           HG       SER  16  29.881  11.096  18.318
  415    H    ALA  17           HN       ALA  17  26.695  12.750  21.574
  416    HA   ALA  17           HA       ALA  17  24.735  10.804  22.036
  417    HB1  ALA  17           HB1      ALA  17  24.502  11.742  24.166
  418    HB2  ALA  17           HB2      ALA  17  24.786  13.382  23.579
  419    HB3  ALA  17           HB3      ALA  17  26.128  12.246  23.708
  420    H    LEU  18           HN       LEU  18  24.332  14.324  21.493
  421    HA   LEU  18           HA       LEU  18  21.489  14.193  21.452
  422    HB2  LEU  18           HB2      LEU  18  23.052  16.229  21.842
  423    HB3  LEU  18           HB1      LEU  18  23.083  16.338  20.082
  424    HG   LEU  18           HG       LEU  18  20.385  15.943  21.172
  425   HD11  LEU  18          HD11      LEU  18  20.127  18.128  22.153
  426   HD12  LEU  18          HD12      LEU  18  21.775  18.578  21.717
  427   HD13  LEU  18          HD13      LEU  18  21.493  17.357  22.958
  428   HD21  LEU  18          HD21      LEU  18  19.896  17.729  19.574
  429   HD22  LEU  18          HD22      LEU  18  20.958  16.538  18.822
  430   HD23  LEU  18          HD23      LEU  18  21.618  18.070  19.397
  431    H    HIS  19           HN       HIS  19  23.967  13.655  19.106
  432    HA   HIS  19           HA       HIS  19  22.479  14.111  16.746
  433    HB2  HIS  19           HB2      HIS  19  24.739  13.919  16.318
  434    HB3  HIS  19           HB1      HIS  19  24.936  12.562  17.416
  435    HD2  HIS  19           HD2      HIS  19  24.269  10.021  16.325
  436    HE1  HIS  19           HE1      HIS  19  23.698  11.407  12.378
  437    HE2  HIS  19           HE2      HIS  19  23.918   9.335  13.831
  438    H    PHE  20           HN       PHE  20  23.154  11.094  18.515
  439    HA   PHE  20           HA       PHE  20  21.389   9.554  16.863
  440    HB2  PHE  20           HB2      PHE  20  23.311   9.044  18.927
  441    HB3  PHE  20           HB1      PHE  20  21.794   8.248  19.349
  442    HD1  PHE  20           HD1      PHE  20  24.767   7.984  17.426
  443    HD2  PHE  20           HD2      PHE  20  20.591   6.973  17.375
  444    HE1  PHE  20           HE1      PHE  20  25.211   6.229  15.728
  445    HE2  PHE  20           HE2      PHE  20  21.035   5.221  15.679
  446    HZ   PHE  20           HZ       PHE  20  23.343   4.849  14.841
  447    H    MET  21           HN       MET  21  21.004  11.577  19.647
  448    HA   MET  21           HA       MET  21  18.637  10.370  20.681
  449    HB2  MET  21           HB2      MET  21  20.351  12.464  21.385
  450    HB3  MET  21           HB1      MET  21  18.783  13.219  21.120
  451    HG2  MET  21           HG2      MET  21  18.817  12.515  23.412
  452    HG3  MET  21           HG1      MET  21  17.783  11.375  22.554
  453    HE1  MET  21           HE1      MET  21  17.755   9.246  23.426
  454    HE2  MET  21           HE2      MET  21  18.272   9.969  24.948
  455    HE3  MET  21           HE3      MET  21  19.016   8.471  24.394
  456    H    ALA  22           HN       ALA  22  19.113  13.349  18.774
  457    HA   ALA  22           HA       ALA  22  16.358  13.762  18.275
  458    HB1  ALA  22           HB1      ALA  22  17.003  15.581  17.028
  459    HB2  ALA  22           HB2      ALA  22  18.403  14.752  16.345
  460    HB3  ALA  22           HB3      ALA  22  18.454  15.348  18.003
  461    H    TRP  23           HN       TRP  23  18.893  12.106  16.434
  462    HA   TRP  23           HA       TRP  23  17.423  11.687  14.067
  463    HB2  TRP  23           HB2      TRP  23  19.942  11.303  14.583
  464    HB3  TRP  23           HB1      TRP  23  19.425   9.703  15.110
  465    HD1  TRP  23           HD1      TRP  23  20.057  11.777  12.059
  466    HE1  TRP  23           HE1      TRP  23  19.602  10.380   9.942
  467    HE3  TRP  23           HE3      TRP  23  17.812   7.699  14.160
  468    HZ2  TRP  23           HZ2      TRP  23  18.436   7.868   9.232
  469    HZ3  TRP  23           HZ3      TRP  23  17.037   5.820  12.740
  470    HH2  TRP  23           HH2      TRP  23  17.346   5.900  10.281
  471    H    THR  24           HN       THR  24  17.689   9.767  17.049
  472    HA   THR  24           HA       THR  24  16.142   7.565  16.110
  473    HB   THR  24           HB       THR  24  15.886   7.107  18.606
  474    HG1  THR  24           HG1      THR  24  16.123   9.138  19.424
  475   HG21  THR  24          HG21      THR  24  18.536   7.402  17.197
  476   HG22  THR  24          HG22      THR  24  17.615   5.935  17.526
  477   HG23  THR  24          HG23      THR  24  18.448   6.764  18.840
  478    H    ILE  25           HN       ILE  25  15.350  10.574  17.798
  479    HA   ILE  25           HA       ILE  25  12.665   9.952  18.407
  480    HB   ILE  25           HB       ILE  25  14.073  12.579  17.926
  481   HG12  ILE  25          HG12      ILE  25  13.007  11.374  20.488
  482   HG13  ILE  25          HG11      ILE  25  14.649  11.083  19.921
  483   HG21  ILE  25          HG21      ILE  25  11.240  11.993  18.823
  484   HG22  ILE  25          HG22      ILE  25  11.747  12.974  17.448
  485   HG23  ILE  25          HG23      ILE  25  12.038  13.542  19.092
  486   HD11  ILE  25          HD11      ILE  25  13.399  13.754  20.613
  487   HD12  ILE  25          HD12      ILE  25  14.963  13.588  19.818
  488   HD13  ILE  25          HD13      ILE  25  14.730  12.953  21.445
  489    H    GLY  26           HN       GLY  26  14.140  11.550  15.584
  490    HA2  GLY  26           HA2      GLY  26  11.728  12.111  14.221
  491    HA3  GLY  26           HA1      GLY  26  13.317  11.974  13.472
  492    H    HIS  27           HN       HIS  27  13.909   9.317  14.133
  493    HA   HIS  27           HA       HIS  27  12.653   7.909  12.044
  494    HB2  HIS  27           HB2      HIS  27  14.804   7.172  12.738
  495    HB3  HIS  27           HB1      HIS  27  14.282   6.990  14.414
  496    HD2  HIS  27           HD2      HIS  27  13.417   4.443  15.011
  497    HE1  HIS  27           HE1      HIS  27  12.777   3.080  11.067
  498    HE2  HIS  27           HE2      HIS  27  12.757   2.406  13.515
  499    H    LEU  28           HN       LEU  28  12.068   7.915  15.543
  500    HA   LEU  28           HA       LEU  28   9.900   5.992  15.277
  501    HB2  LEU  28           HB2      LEU  28  10.931   7.533  17.672
  502    HB3  LEU  28           HB1      LEU  28   9.709   6.262  17.728
  503    HG   LEU  28           HG       LEU  28  12.508   5.867  16.632
  504   HD11  LEU  28          HD11      LEU  28  11.403   4.933  19.294
  505   HD12  LEU  28          HD12      LEU  28  12.393   6.382  19.114
  506   HD13  LEU  28          HD13      LEU  28  13.064   4.800  18.717
  507   HD21  LEU  28          HD21      LEU  28  10.175   4.031  17.235
  508   HD22  LEU  28          HD22      LEU  28  11.819   3.430  17.021
  509   HD23  LEU  28          HD23      LEU  28  11.003   4.256  15.694
  510    H    ASN  29           HN       ASN  29   7.768   6.454  15.265
  511    HA   ASN  29           HA       ASN  29   6.984   9.229  14.920
  512    HB2  ASN  29           HB2      ASN  29   6.088   7.426  13.465
  513    HB3  ASN  29           HB1      ASN  29   5.286   6.727  14.872
  514   HD21  ASN  29          HD21      ASN  29   3.097   7.183  14.424
  515   HD22  ASN  29          HD22      ASN  29   2.495   8.748  14.156
  516    H    GLN  30           HN       GLN  30   6.544  10.457  16.625
  517    HA   GLN  30           HA       GLN  30   5.656   9.225  19.125
  518    HB2  GLN  30           HB2      GLN  30   6.455  12.066  18.449
  519    HB3  GLN  30           HB1      GLN  30   5.976  11.516  20.055
  520    HG2  GLN  30           HG2      GLN  30   7.824   9.913  20.091
  521    HG3  GLN  30           HG1      GLN  30   8.283  10.375  18.453
  522   HE21  GLN  30          HE21      GLN  30   9.749  10.677  21.141
  523   HE22  GLN  30          HE22      GLN  30  10.169  12.321  21.193
  524    H    ILE  31           HN       ILE  31   3.698   9.631  20.095
  525    HA   ILE  31           HA       ILE  31   1.756  11.249  18.565
  526    HB   ILE  31           HB       ILE  31   0.034   9.548  19.055
  527   HG12  ILE  31          HG12      ILE  31   2.346   7.815  19.978
  528   HG13  ILE  31          HG11      ILE  31   1.255   8.642  21.089
  529   HG21  ILE  31          HG21      ILE  31   2.433   8.292  17.699
  530   HG22  ILE  31          HG22      ILE  31   1.433   9.530  16.940
  531   HG23  ILE  31          HG23      ILE  31   0.730   7.972  17.376
  532   HD11  ILE  31          HD11      ILE  31   0.572   6.282  20.651
  533   HD12  ILE  31          HD12      ILE  31   0.364   6.691  18.947
  534   HD13  ILE  31          HD13      ILE  31  -0.660   7.448  20.167
  535    H    LYS  32           HN       LYS  32  -0.006  12.094  19.820
  536    HA   LYS  32           HA       LYS  32   0.802  12.735  22.547
  537    HB2  LYS  32           HB2      LYS  32  -1.187  13.802  20.590
  538    HB3  LYS  32           HB1      LYS  32  -1.475  14.078  22.308
  539    HG2  LYS  32           HG2      LYS  32   1.259  14.613  21.201
  540    HG3  LYS  32           HG1      LYS  32  -0.022  15.791  20.911
  541    HD2  LYS  32           HD2      LYS  32   0.095  14.820  23.687
  542    HD3  LYS  32           HD1      LYS  32   1.533  15.704  23.177
  543    HE2  LYS  32           HE2      LYS  32  -1.059  16.901  22.377
  544    HE3  LYS  32           HE1      LYS  32  -0.705  16.923  24.105
  545    HZ1  LYS  32           HZ1      LYS  32   0.130  18.886  22.867
  546    HZ2  LYS  32           HZ2      LYS  32   1.184  17.858  22.016
  547    HZ3  LYS  32           HZ3      LYS  32   1.341  18.037  23.699
  548    H    ARG  33           HN       ARG  33   0.398  11.052  23.897
  549    HA   ARG  33           HA       ARG  33  -2.185   9.674  23.764
  550    HB2  ARG  33           HB2      ARG  33   0.367   9.168  25.298
  551    HB3  ARG  33           HB1      ARG  33  -1.120   8.267  25.603
  552    HG2  ARG  33           HG2      ARG  33  -1.168   7.412  23.366
  553    HG3  ARG  33           HG1      ARG  33   0.110   8.511  22.849
  554    HD2  ARG  33           HD2      ARG  33   0.998   6.240  23.220
  555    HD3  ARG  33           HD1      ARG  33   1.698   7.389  24.356
  556    HE   ARG  33           HE       ARG  33   0.624   6.269  26.082
  557   HH11  ARG  33          HH11      ARG  33  -0.717   5.315  23.007
  558   HH12  ARG  33          HH12      ARG  33  -1.661   4.036  23.680
  559   HH21  ARG  33          HH21      ARG  33  -0.623   4.588  26.934
  560   HH22  ARG  33          HH22      ARG  33  -1.611   3.625  25.888
  561    H1   MET   1           HT1      MET   1  50.896  -3.718  25.224
  562    H2   MET   1           HT2      MET   1  50.906  -5.057  24.178
  563    H3   MET   1           HT3      MET   1  50.019  -5.113  25.625
  564    HA   MET   1           HA       MET   1  48.629  -3.254  24.773
  565    HB2  MET   1           HB2      MET   1  50.513  -3.689  22.506
  566    HB3  MET   1           HB1      MET   1  48.830  -3.352  22.097
  567    HG2  MET   1           HG2      MET   1  48.891  -1.321  23.495
  568    HG3  MET   1           HG1      MET   1  50.570  -1.657  23.912
  569    HE1  MET   1           HE1      MET   1  48.794  -0.315  19.928
  570    HE2  MET   1           HE2      MET   1  47.975  -0.762  21.423
  571    HE3  MET   1           HE3      MET   1  48.636  -2.019  20.379
  572    H    PHE   2           HN       PHE   2  47.122  -4.766  25.441
  573    HA   PHE   2           HA       PHE   2  46.734  -7.220  23.934
  574    HB2  PHE   2           HB2      PHE   2  45.150  -6.034  26.227
  575    HB3  PHE   2           HB1      PHE   2  44.936  -7.652  25.559
  576    HD1  PHE   2           HD1      PHE   2  46.739  -5.650  27.916
  577    HD2  PHE   2           HD2      PHE   2  47.006  -9.208  25.526
  578    HE1  PHE   2           HE1      PHE   2  48.564  -6.489  29.369
  579    HE2  PHE   2           HE2      PHE   2  48.830 -10.048  26.980
  580    HZ   PHE   2           HZ       PHE   2  49.610  -8.688  28.902
  581    H    GLU   3           HN       GLU   3  45.392  -4.014  24.126
  582    HA   GLU   3           HA       GLU   3  42.949  -4.676  22.764
  583    HB2  GLU   3           HB2      GLU   3  42.604  -2.241  22.674
  584    HB3  GLU   3           HB1      GLU   3  43.058  -2.761  24.296
  585    HG2  GLU   3           HG2      GLU   3  45.476  -2.259  22.912
  586    HG3  GLU   3           HG1      GLU   3  44.406  -0.903  22.552
  587    HA   PRO   4           HA       PRO   4  44.435  -4.430  18.594
  588    HB2  PRO   4           HB2      PRO   4  42.211  -3.497  17.301
  589    HB3  PRO   4           HB1      PRO   4  42.359  -5.157  17.910
  590    HG2  PRO   4           HG2      PRO   4  40.923  -2.831  19.084
  591    HG3  PRO   4           HG1      PRO   4  40.462  -4.540  19.036
  592    HD2  PRO   4           HD2      PRO   4  41.530  -3.332  21.257
  593    HD3  PRO   4           HD1      PRO   4  41.696  -5.065  20.910
  594    H    PHE   5           HN       PHE   5  42.573  -1.576  19.631
  595    HA   PHE   5           HA       PHE   5  44.667   0.155  18.527
  596    HB2  PHE   5           HB2      PHE   5  41.962  -0.117  17.439
  597    HB3  PHE   5           HB1      PHE   5  42.357   1.544  17.876
  598    HD1  PHE   5           HD1      PHE   5  43.151  -1.269  15.672
  599    HD2  PHE   5           HD2      PHE   5  44.260   2.709  16.849
  600    HE1  PHE   5           HE1      PHE   5  44.533  -1.051  13.625
  601    HE2  PHE   5           HE2      PHE   5  45.645   2.929  14.804
  602    HZ   PHE   5           HZ       PHE   5  45.781   1.049  13.185
  603    H    GLN   6           HN       GLN   6  41.423   1.078  19.586
  604    HA   GLN   6           HA       GLN   6  42.364   1.844  22.230
  605    HB2  GLN   6           HB2      GLN   6  41.410   3.884  20.206
  606    HB3  GLN   6           HB1      GLN   6  41.644   4.206  21.925
  607    HG2  GLN   6           HG2      GLN   6  44.039   3.451  21.652
  608    HG3  GLN   6           HG1      GLN   6  43.757   3.392  19.912
  609   HE21  GLN   6          HE21      GLN   6  43.893   5.354  18.761
  610   HE22  GLN   6          HE22      GLN   6  44.092   6.869  19.500
  611    H    ILE   7           HN       ILE   7  40.596   2.627  23.582
  612    HA   ILE   7           HA       ILE   7  38.301   1.030  23.394
  613    HB   ILE   7           HB       ILE   7  37.440   2.358  25.252
  614   HG12  ILE   7          HG12      ILE   7  39.676   4.285  24.527
  615   HG13  ILE   7          HG11      ILE   7  37.945   4.598  24.399
  616   HG21  ILE   7          HG21      ILE   7  39.436   0.771  25.531
  617   HG22  ILE   7          HG22      ILE   7  39.204   1.969  26.804
  618   HG23  ILE   7          HG23      ILE   7  40.444   2.216  25.575
  619   HD11  ILE   7          HD11      ILE   7  39.555   4.181  26.924
  620   HD12  ILE   7          HD12      ILE   7  37.792   4.148  26.897
  621   HD13  ILE   7          HD13      ILE   7  38.654   5.618  26.444
  622    H    LEU   8           HN       LEU   8  38.953   4.301  22.298
  623    HA   LEU   8           HA       LEU   8  36.246   4.944  21.618
  624    HB2  LEU   8           HB2      LEU   8  38.893   6.156  20.789
  625    HB3  LEU   8           HB1      LEU   8  37.325   6.816  20.325
  626    HG   LEU   8           HG       LEU   8  38.123   6.319  23.204
  627   HD11  LEU   8          HD11      LEU   8  38.353   8.813  21.499
  628   HD12  LEU   8          HD12      LEU   8  39.648   7.981  22.361
  629   HD13  LEU   8          HD13      LEU   8  38.397   8.838  23.262
  630   HD21  LEU   8          HD21      LEU   8  36.250   8.052  23.513
  631   HD22  LEU   8          HD22      LEU   8  35.747   6.447  22.987
  632   HD23  LEU   8          HD23      LEU   8  35.852   7.764  21.819
  633    H    SER   9           HN       SER   9  38.949   3.477  19.967
  634    HA   SER   9           HA       SER   9  37.831   3.593  17.335
  635    HB2  SER   9           HB2      SER   9  40.246   3.316  17.692
  636    HB3  SER   9           HB1      SER   9  39.958   1.756  18.460
  637    HG   SER   9           HG       SER   9  39.783   0.909  16.549
  638    H    ILE  10           HN       ILE  10  37.926   1.119  19.879
  639    HA   ILE  10           HA       ILE  10  36.641  -0.927  18.409
  640    HB   ILE  10           HB       ILE  10  36.810  -0.395  21.379
  641   HG12  ILE  10          HG12      ILE  10  38.179  -2.518  19.714
  642   HG13  ILE  10          HG11      ILE  10  38.897  -0.929  19.982
  643   HG21  ILE  10          HG21      ILE  10  36.179  -2.872  21.501
  644   HG22  ILE  10          HG22      ILE  10  35.652  -2.720  19.825
  645   HG23  ILE  10          HG23      ILE  10  34.871  -1.765  21.084
  646   HD11  ILE  10          HD11      ILE  10  39.584  -2.770  21.625
  647   HD12  ILE  10          HD12      ILE  10  37.947  -2.672  22.265
  648   HD13  ILE  10          HD13      ILE  10  39.010  -1.266  22.339
  649    H    CYS  11           HN       CYS  11  35.367   1.523  20.660
  650    HA   CYS  11           HA       CYS  11  32.677   0.716  20.600
  651    HB2  CYS  11           HB2      CYS  11  33.728   2.410  22.159
  652    HB3  CYS  11           HB1      CYS  11  33.655   3.567  20.830
  653    HG   CYS  11           HG       CYS  11  31.002   2.187  21.690
  654    H    SER  12           HN       SER  12  34.345   3.211  18.645
  655    HA   SER  12           HA       SER  12  32.138   3.865  17.046
  656    HB2  SER  12           HB2      SER  12  33.794   4.761  15.464
  657    HB3  SER  12           HB1      SER  12  34.176   5.223  17.122
  658    HG   SER  12           HG       SER  12  36.037   4.439  16.182
  659    H    PHE  13           HN       PHE  13  34.630   1.349  16.653
  660    HA   PHE  13           HA       PHE  13  34.038   0.532  14.064
  661    HB2  PHE  13           HB2      PHE  13  35.966  -0.345  15.178
  662    HB3  PHE  13           HB1      PHE  13  34.983  -1.021  16.476
  663    HD1  PHE  13           HD1      PHE  13  35.635  -1.244  12.810
  664    HD2  PHE  13           HD2      PHE  13  34.037  -3.182  16.294
  665    HE1  PHE  13           HE1      PHE  13  35.365  -3.343  11.519
  666    HE2  PHE  13           HE2      PHE  13  33.767  -5.283  15.002
  667    HZ   PHE  13           HZ       PHE  13  34.432  -5.363  12.614
  668    H    ILE  14           HN       ILE  14  32.784  -0.893  17.090
  669    HA   ILE  14           HA       ILE  14  30.938  -2.611  15.804
  670    HB   ILE  14           HB       ILE  14  31.668  -3.014  18.092
  671   HG12  ILE  14          HG12      ILE  14  29.351  -3.217  19.188
  672   HG13  ILE  14          HG11      ILE  14  28.708  -2.507  17.714
  673   HG21  ILE  14          HG21      ILE  14  31.864  -0.636  18.772
  674   HG22  ILE  14          HG22      ILE  14  30.962  -1.593  19.939
  675   HG23  ILE  14          HG23      ILE  14  30.105  -0.524  18.836
  676   HD11  ILE  14          HD11      ILE  14  30.321  -5.056  17.952
  677   HD12  ILE  14          HD12      ILE  14  29.895  -4.308  16.414
  678   HD13  ILE  14          HD13      ILE  14  28.628  -4.914  17.479
  679    H    LEU  15           HN       LEU  15  30.634   0.656  17.114
  680    HA   LEU  15           HA       LEU  15  27.841   0.898  16.788
  681    HB2  LEU  15           HB2      LEU  15  30.114   2.821  17.106
  682    HB3  LEU  15           HB1      LEU  15  28.530   3.440  16.641
  683    HG   LEU  15           HG       LEU  15  28.831   1.552  18.977
  684   HD11  LEU  15          HD11      LEU  15  29.049   3.454  20.463
  685   HD12  LEU  15          HD12      LEU  15  28.909   4.581  19.114
  686   HD13  LEU  15          HD13      LEU  15  30.339   3.558  19.265
  687   HD21  LEU  15          HD21      LEU  15  26.831   3.734  18.300
  688   HD22  LEU  15          HD22      LEU  15  26.728   2.619  19.662
  689   HD23  LEU  15          HD23      LEU  15  26.576   2.014  18.013
  690    H    SER  16           HN       SER  16  30.497   1.176  14.582
  691    HA   SER  16           HA       SER  16  29.067   2.560  12.522
  692    HB2  SER  16           HB2      SER  16  31.611   0.943  12.443
  693    HB3  SER  16           HB1      SER  16  30.987   1.901  11.102
  694    HG   SER  16           HG       SER  16  32.245   3.322  12.111
  695    H    ALA  17           HN       ALA  17  29.968  -0.827  13.115
  696    HA   ALA  17           HA       ALA  17  28.916  -1.920  10.765
  697    HB1  ALA  17           HB1      ALA  17  29.129  -4.007  11.801
  698    HB2  ALA  17           HB2      ALA  17  28.715  -3.368  13.391
  699    HB3  ALA  17           HB3      ALA  17  30.294  -3.025  12.687
  700    H    LEU  18           HN       LEU  18  27.356  -1.567  13.965
  701    HA   LEU  18           HA       LEU  18  24.818  -2.492  13.062
  702    HB2  LEU  18           HB2      LEU  18  25.762  -2.335  15.476
  703    HB3  LEU  18           HB1      LEU  18  25.180  -0.671  15.421
  704    HG   LEU  18           HG       LEU  18  23.227  -2.614  14.405
  705   HD11  LEU  18          HD11      LEU  18  22.681  -3.635  16.515
  706   HD12  LEU  18          HD12      LEU  18  23.884  -2.662  17.360
  707   HD13  LEU  18          HD13      LEU  18  24.400  -3.918  16.236
  708   HD21  LEU  18          HD21      LEU  18  21.744  -1.288  15.821
  709   HD22  LEU  18          HD22      LEU  18  22.804  -0.211  14.913
  710   HD23  LEU  18          HD23      LEU  18  23.131  -0.541  16.614
  711    H    HIS  19           HN       HIS  19  26.433   0.563  13.018
  712    HA   HIS  19           HA       HIS  19  24.193   2.275  12.813
  713    HB2  HIS  19           HB2      HIS  19  26.144   3.446  13.208
  714    HB3  HIS  19           HB1      HIS  19  27.073   2.486  12.069
  715    HD2  HIS  19           HD2      HIS  19  26.856   3.296   9.351
  716    HE1  HIS  19           HE1      HIS  19  24.651   6.808  10.147
  717    HE2  HIS  19           HE2      HIS  19  25.926   5.527   8.362
  718    H    PHE  20           HN       PHE  20  26.260   0.861  10.278
  719    HA   PHE  20           HA       PHE  20  24.579   1.815   8.163
  720    HB2  PHE  20           HB2      PHE  20  27.127   0.529   8.402
  721    HB3  PHE  20           HB1      PHE  20  26.134  -0.380   7.263
  722    HD1  PHE  20           HD1      PHE  20  28.258   2.437   7.645
  723    HD2  PHE  20           HD2      PHE  20  24.775   1.073   5.532
  724    HE1  PHE  20           HE1      PHE  20  28.629   4.170   5.909
  725    HE2  PHE  20           HE2      PHE  20  25.146   2.805   3.799
  726    HZ   PHE  20           HZ       PHE  20  27.077   4.343   3.981
  727    H    MET  21           HN       MET  21  24.558  -0.946  10.250
  728    HA   MET  21           HA       MET  21  23.113  -2.717   8.547
  729    HB2  MET  21           HB2      MET  21  24.275  -2.801  11.088
  730    HB3  MET  21           HB1      MET  21  22.559  -3.090  11.356
  731    HG2  MET  21           HG2      MET  21  23.544  -5.231  10.910
  732    HG3  MET  21           HG1      MET  21  22.665  -4.770   9.453
  733    HE1  MET  21           HE1      MET  21  23.550  -5.582   7.482
  734    HE2  MET  21           HE2      MET  21  24.288  -6.844   8.465
  735    HE3  MET  21           HE3      MET  21  25.225  -6.070   7.190
  736    H    ALA  22           HN       ALA  22  22.057  -0.775  11.342
  737    HA   ALA  22           HA       ALA  22  19.292  -1.244  10.938
  738    HB1  ALA  22           HB1      ALA  22  18.937   0.139  12.737
  739    HB2  ALA  22           HB2      ALA  22  20.215   1.260  12.264
  740    HB3  ALA  22           HB3      ALA  22  20.627  -0.285  13.008
  741    H    TRP  23           HN       TRP  23  21.454   1.361   9.875
  742    HA   TRP  23           HA       TRP  23  19.479   3.085   8.850
  743    HB2  TRP  23           HB2      TRP  23  22.025   3.458   9.226
  744    HB3  TRP  23           HB1      TRP  23  22.197   2.796   7.602
  745    HD1  TRP  23           HD1      TRP  23  21.167   5.870   9.473
  746    HE1  TRP  23           HE1      TRP  23  20.471   7.712   7.810
  747    HE3  TRP  23           HE3      TRP  23  21.019   3.150   5.151
  748    HZ2  TRP  23           HZ2      TRP  23  19.922   7.996   5.017
  749    HZ3  TRP  23           HZ3      TRP  23  20.404   4.230   3.006
  750    HH2  TRP  23           HH2      TRP  23  19.856   6.647   2.934
  751    H    THR  24           HN       THR  24  21.258   0.389   7.358
  752    HA   THR  24           HA       THR  24  20.192   0.752   4.743
  753    HB   THR  24           HB       THR  24  20.912  -1.680   4.469
  754    HG1  THR  24           HG1      THR  24  20.799  -2.381   6.554
  755   HG21  THR  24          HG21      THR  24  22.747   0.544   5.353
  756   HG22  THR  24          HG22      THR  24  22.456  -0.069   3.725
  757   HG23  THR  24          HG23      THR  24  23.391  -1.026   4.872
  758    H    ILE  25           HN       ILE  25  19.164  -1.121   7.558
  759    HA   ILE  25           HA       ILE  25  17.123  -2.602   6.289
  760    HB   ILE  25           HB       ILE  25  17.470  -1.685   9.145
  761   HG12  ILE  25          HG12      ILE  25  17.695  -4.450   7.939
  762   HG13  ILE  25          HG11      ILE  25  19.073  -3.360   8.059
  763   HG21  ILE  25          HG21      ILE  25  15.383  -3.487   7.890
  764   HG22  ILE  25          HG22      ILE  25  15.107  -2.026   8.839
  765   HG23  ILE  25          HG23      ILE  25  15.739  -3.476   9.617
  766   HD11  ILE  25          HD11      ILE  25  17.398  -4.449  10.335
  767   HD12  ILE  25          HD12      ILE  25  18.592  -3.169  10.532
  768   HD13  ILE  25          HD13      ILE  25  19.101  -4.773  10.014
  769    H    GLY  26           HN       GLY  26  17.065   0.544   7.954
  770    HA2  GLY  26           HA2      GLY  26  14.287   1.005   7.704
  771    HA3  GLY  26           HA1      GLY  26  15.511   2.249   7.936
  772    H    HIS  27           HN       HIS  27  17.031   1.852   5.618
  773    HA   HIS  27           HA       HIS  27  15.625   3.386   3.731
  774    HB2  HIS  27           HB2      HIS  27  18.000   3.469   3.681
  775    HB3  HIS  27           HB1      HIS  27  18.131   1.718   3.522
  776    HD2  HIS  27           HD2      HIS  27  18.286   0.871   0.904
  777    HE1  HIS  27           HE1      HIS  27  16.824   4.371  -0.950
  778    HE2  HIS  27           HE2      HIS  27  17.797   2.063  -1.367
  779    H    LEU  28           HN       LEU  28  16.253  -0.099   3.899
  780    HA   LEU  28           HA       LEU  28  14.768  -0.581   1.445
  781    HB2  LEU  28           HB2      LEU  28  16.032  -2.488   3.430
  782    HB3  LEU  28           HB1      LEU  28  15.318  -2.953   1.885
  783    HG   LEU  28           HG       LEU  28  17.591  -0.967   2.165
  784   HD11  LEU  28          HD11      LEU  28  17.739  -3.842   1.221
  785   HD12  LEU  28          HD12      LEU  28  18.147  -3.344   2.862
  786   HD13  LEU  28          HD13      LEU  28  19.083  -2.733   1.498
  787   HD21  LEU  28          HD21      LEU  28  16.218  -2.320  -0.170
  788   HD22  LEU  28          HD22      LEU  28  17.802  -1.560  -0.318
  789   HD23  LEU  28          HD23      LEU  28  16.398  -0.591   0.125
  790    H    ASN  29           HN       ASN  29  12.711  -1.295   1.300
  791    HA   ASN  29           HA       ASN  29  11.089  -1.252   3.709
  792    HB2  ASN  29           HB2      ASN  29  10.328  -0.181   1.602
  793    HB3  ASN  29           HB1      ASN  29  10.272  -1.772   0.844
  794   HD21  ASN  29          HD21      ASN  29   8.022  -2.097   0.636
  795   HD22  ASN  29          HD22      ASN  29   6.939  -2.060   1.942
  796    H    GLN  30           HN       GLN  30  10.875  -3.010   4.922
  797    HA   GLN  30           HA       GLN  30  11.260  -5.658   3.735
  798    HB2  GLN  30           HB2      GLN  30  10.936  -4.763   6.609
  799    HB3  GLN  30           HB1      GLN  30  11.186  -6.435   6.103
  800    HG2  GLN  30           HG2      GLN  30  13.327  -5.836   5.079
  801    HG3  GLN  30           HG1      GLN  30  13.073  -4.142   5.493
  802   HE21  GLN  30          HE21      GLN  30  15.184  -6.164   6.437
  803   HE22  GLN  30          HE22      GLN  30  15.101  -6.083   8.131
  804    H    ILE  31           HN       ILE  31   9.700  -7.235   3.672
  805    HA   ILE  31           HA       ILE  31   6.983  -6.468   4.543
  806    HB   ILE  31           HB       ILE  31   6.091  -7.506   2.488
  807   HG12  ILE  31          HG12      ILE  31   8.975  -7.576   1.553
  808   HG13  ILE  31          HG11      ILE  31   8.118  -8.997   2.150
  809   HG21  ILE  31          HG21      ILE  31   8.169  -5.407   1.818
  810   HG22  ILE  31          HG22      ILE  31   6.663  -5.040   2.658
  811   HG23  ILE  31          HG23      ILE  31   6.623  -5.680   1.015
  812   HD11  ILE  31          HD11      ILE  31   8.043  -8.808  -0.337
  813   HD12  ILE  31          HD12      ILE  31   7.184  -7.278  -0.165
  814   HD13  ILE  31          HD13      ILE  31   6.439  -8.774   0.395
  815    H    LYS  32           HN       LYS  32   5.566  -8.250   4.993
  816    HA   LYS  32           HA       LYS  32   6.995 -10.543   6.080
  817    HB2  LYS  32           HB2      LYS  32   4.257  -9.386   6.368
  818    HB3  LYS  32           HB1      LYS  32   4.481 -11.101   6.718
  819    HG2  LYS  32           HG2      LYS  32   6.419  -9.129   7.875
  820    HG3  LYS  32           HG1      LYS  32   4.831  -9.300   8.623
  821    HD2  LYS  32           HD2      LYS  32   6.131 -11.864   7.988
  822    HD3  LYS  32           HD1      LYS  32   6.998 -10.897   9.182
  823    HE2  LYS  32           HE2      LYS  32   4.058 -11.038   9.538
  824    HE3  LYS  32           HE1      LYS  32   4.935 -12.542   9.819
  825    HZ1  LYS  32           HZ1      LYS  32   4.711 -11.107  11.810
  826    HZ2  LYS  32           HZ2      LYS  32   5.674  -9.940  11.038
  827    HZ3  LYS  32           HZ3      LYS  32   6.319 -11.468  11.409
  828    H    ARG  33           HN       ARG  33   7.563 -11.940   4.484
  829    HA   ARG  33           HA       ARG  33   5.596 -12.686   2.443
  830    HB2  ARG  33           HB2      ARG  33   8.538 -13.261   2.804
  831    HB3  ARG  33           HB1      ARG  33   7.562 -14.046   1.562
  832    HG2  ARG  33           HG2      ARG  33   7.041 -11.953   0.520
  833    HG3  ARG  33           HG1      ARG  33   7.702 -11.040   1.878
  834    HD2  ARG  33           HD2      ARG  33   9.282 -11.077  -0.017
  835    HD3  ARG  33           HD1      ARG  33   9.948 -11.913   1.382
  836    HE   ARG  33           HE       ARG  33   9.872 -13.895   0.178
  837   HH11  ARG  33          HH11      ARG  33   7.934 -11.458  -1.391
  838   HH12  ARG  33          HH12      ARG  33   7.674 -12.406  -2.810
  839   HH21  ARG  33          HH21      ARG  33   9.516 -15.112  -1.693
  840   HH22  ARG  33          HH22      ARG  33   8.561 -14.462  -2.983
  841    H1   MET   1           HT1      MET   1  57.922   4.221   4.041
  842    H2   MET   1           HT2      MET   1  57.944   5.242   2.684
  843    H3   MET   1           HT3      MET   1  57.678   3.575   2.493
  844    HA   MET   1           HA       MET   1  55.610   3.812   3.826
  845    HB2  MET   1           HB2      MET   1  56.616   6.616   3.765
  846    HB3  MET   1           HB1      MET   1  54.876   6.386   3.590
  847    HG2  MET   1           HG2      MET   1  54.841   5.037   5.654
  848    HG3  MET   1           HG1      MET   1  56.582   5.261   5.831
  849    HE1  MET   1           HE1      MET   1  53.210   8.295   6.329
  850    HE2  MET   1           HE2      MET   1  53.137   6.623   5.778
  851    HE3  MET   1           HE3      MET   1  53.716   7.878   4.686
  852    H    PHE   2           HN       PHE   2  54.939   2.696   2.006
  853    HA   PHE   2           HA       PHE   2  54.759   4.042  -0.563
  854    HB2  PHE   2           HB2      PHE   2  53.816   1.298   0.304
  855    HB3  PHE   2           HB1      PHE   2  53.852   1.894  -1.355
  856    HD1  PHE   2           HD1      PHE   2  55.718   0.279   1.239
  857    HD2  PHE   2           HD2      PHE   2  56.129   2.718  -2.274
  858    HE1  PHE   2           HE1      PHE   2  58.097  -0.396   1.049
  859    HE2  PHE   2           HE2      PHE   2  58.508   2.041  -2.464
  860    HZ   PHE   2           HZ       PHE   2  59.492   0.485  -0.803
  861    H    GLU   3           HN       GLU   3  52.715   3.278   2.151
  862    HA   GLU   3           HA       GLU   3  50.246   3.694   0.737
  863    HB2  GLU   3           HB2      GLU   3  49.212   3.576   2.967
  864    HB3  GLU   3           HB1      GLU   3  50.337   2.243   2.715
  865    HG2  GLU   3           HG2      GLU   3  51.861   4.384   3.765
  866    HG3  GLU   3           HG1      GLU   3  50.395   4.294   4.741
  867    HA   PRO   4           HA       PRO   4  50.030   8.109   1.077
  868    HB2  PRO   4           HB2      PRO   4  47.326   8.488   1.253
  869    HB3  PRO   4           HB1      PRO   4  48.149   8.023  -0.249
  870    HG2  PRO   4           HG2      PRO   4  46.615   6.343   1.669
  871    HG3  PRO   4           HG1      PRO   4  46.677   6.273  -0.100
  872    HD2  PRO   4           HD2      PRO   4  48.065   4.549   1.524
  873    HD3  PRO   4           HD1      PRO   4  48.586   4.982  -0.117
  874    H    PHE   5           HN       PHE   5  47.925   6.378   3.371
  875    HA   PHE   5           HA       PHE   5  48.902   8.107   5.528
  876    HB2  PHE   5           HB2      PHE   5  46.188   8.159   4.433
  877    HB3  PHE   5           HB1      PHE   5  46.217   7.841   6.166
  878    HD1  PHE   5           HD1      PHE   5  46.950  10.273   3.530
  879    HD2  PHE   5           HD2      PHE   5  47.219   9.442   7.733
  880    HE1  PHE   5           HE1      PHE   5  47.402  12.670   3.973
  881    HE2  PHE   5           HE2      PHE   5  47.672  11.838   8.180
  882    HZ   PHE   5           HZ       PHE   5  47.763  13.453   6.299
  883    H    GLN   6           HN       GLN   6  46.125   5.930   5.587
  884    HA   GLN   6           HA       GLN   6  47.671   3.772   6.779
  885    HB2  GLN   6           HB2      GLN   6  45.526   5.253   8.319
  886    HB3  GLN   6           HB1      GLN   6  46.249   3.725   8.818
  887    HG2  GLN   6           HG2      GLN   6  48.501   4.862   8.741
  888    HG3  GLN   6           HG1      GLN   6  47.655   6.386   8.475
  889   HE21  GLN   6          HE21      GLN   6  46.806   7.447  10.304
  890   HE22  GLN   6          HE22      GLN   6  46.810   6.784  11.867
  891    H    ILE   7           HN       ILE   7  46.347   1.852   7.140
  892    HA   ILE   7           HA       ILE   7  44.694   1.254   4.956
  893    HB   ILE   7           HB       ILE   7  44.204  -0.830   6.130
  894   HG12  ILE   7          HG12      ILE   7  45.387   0.591   8.541
  895   HG13  ILE   7          HG11      ILE   7  43.710   0.077   8.350
  896   HG21  ILE   7          HG21      ILE   7  46.535  -0.322   5.191
  897   HG22  ILE   7          HG22      ILE   7  46.435  -1.629   6.369
  898   HG23  ILE   7          HG23      ILE   7  47.033  -0.043   6.859
  899   HD11  ILE   7          HD11      ILE   7  46.157  -1.684   8.589
  900   HD12  ILE   7          HD12      ILE   7  44.588  -2.293   8.061
  901   HD13  ILE   7          HD13      ILE   7  44.771  -1.609   9.676
  902    H    LEU   8           HN       LEU   8  43.958   2.410   8.182
  903    HA   LEU   8           HA       LEU   8  41.119   2.053   8.002
  904    HB2  LEU   8           HB2      LEU   8  42.841   3.736   9.837
  905    HB3  LEU   8           HB1      LEU   8  41.091   3.585  10.000
  906    HG   LEU   8           HG       LEU   8  42.960   1.202   9.957
  907   HD11  LEU   8          HD11      LEU   8  41.852   2.795  12.283
  908   HD12  LEU   8          HD12      LEU   8  43.546   2.480  11.911
  909   HD13  LEU   8          HD13      LEU   8  42.504   1.165  12.451
  910   HD21  LEU   8          HD21      LEU   8  40.904   0.185  11.119
  911   HD22  LEU   8          HD22      LEU   8  40.729   0.547   9.403
  912   HD23  LEU   8          HD23      LEU   8  40.034   1.631  10.607
  913    H    SER   9           HN       SER   9  43.365   4.600   7.218
  914    HA   SER   9           HA       SER   9  41.412   6.660   6.830
  915    HB2  SER   9           HB2      SER   9  43.770   7.198   7.260
  916    HB3  SER   9           HB1      SER   9  44.228   6.431   5.742
  917    HG   SER   9           HG       SER   9  43.634   8.177   4.741
  918    H    ILE  10           HN       ILE  10  43.093   4.391   4.677
  919    HA   ILE  10           HA       ILE  10  42.019   5.372   2.249
  920    HB   ILE  10           HB       ILE  10  43.064   2.646   3.027
  921   HG12  ILE  10          HG12      ILE  10  44.304   4.754   1.247
  922   HG13  ILE  10          HG11      ILE  10  44.582   4.718   2.990
  923   HG21  ILE  10          HG21      ILE  10  43.251   2.384   0.489
  924   HG22  ILE  10          HG22      ILE  10  42.148   3.755   0.363
  925   HG23  ILE  10          HG23      ILE  10  41.622   2.269   1.155
  926   HD11  ILE  10          HD11      ILE  10  46.302   3.486   1.547
  927   HD12  ILE  10          HD12      ILE  10  45.042   2.298   1.234
  928   HD13  ILE  10          HD13      ILE  10  45.609   2.570   2.882
  929    H    CYS  11           HN       CYS  11  40.976   2.736   4.410
  930    HA   CYS  11           HA       CYS  11  38.790   1.853   2.884
  931    HB2  CYS  11           HB2      CYS  11  39.791   0.723   4.917
  932    HB3  CYS  11           HB1      CYS  11  38.927   1.900   5.905
  933    HG   CYS  11           HG       CYS  11  37.262   0.188   3.910
  934    H    SER  12           HN       SER  12  38.873   4.200   5.590
  935    HA   SER  12           HA       SER  12  36.155   4.875   5.485
  936    HB2  SER  12           HB2      SER  12  36.814   6.916   6.687
  937    HB3  SER  12           HB1      SER  12  37.610   5.492   7.358
  938    HG   SER  12           HG       SER  12  39.165   7.049   7.058
  939    H    PHE  13           HN       PHE  13  38.954   6.207   3.736
  940    HA   PHE  13           HA       PHE  13  37.752   8.444   2.600
  941    HB2  PHE  13           HB2      PHE  13  40.113   8.127   2.380
  942    HB3  PHE  13           HB1      PHE  13  39.888   6.583   1.556
  943    HD1  PHE  13           HD1      PHE  13  39.240  10.245   1.250
  944    HD2  PHE  13           HD2      PHE  13  39.598   6.481  -0.791
  945    HE1  PHE  13           HE1      PHE  13  39.145  11.418  -0.931
  946    HE2  PHE  13           HE2      PHE  13  39.504   7.656  -2.973
  947    HZ   PHE  13           HZ       PHE  13  39.277  10.125  -3.043
  948    H    ILE  14           HN       ILE  14  38.102   5.211   1.115
  949    HA   ILE  14           HA       ILE  14  36.502   5.809  -1.142
  950    HB   ILE  14           HB       ILE  14  38.073   3.948  -1.154
  951   HG12  ILE  14          HG12      ILE  14  36.453   2.102  -1.912
  952   HG13  ILE  14          HG11      ILE  14  35.157   3.222  -1.520
  953   HG21  ILE  14          HG21      ILE  14  37.807   3.309   1.227
  954   HG22  ILE  14          HG22      ILE  14  37.689   1.928   0.148
  955   HG23  ILE  14          HG23      ILE  14  36.232   2.614   0.850
  956   HD11  ILE  14          HD11      ILE  14  37.407   3.666  -3.494
  957   HD12  ILE  14          HD12      ILE  14  36.264   4.918  -3.013
  958   HD13  ILE  14          HD13      ILE  14  35.693   3.486  -3.866
  959    H    LEU  15           HN       LEU  15  35.758   4.370   1.999
  960    HA   LEU  15           HA       LEU  15  33.084   3.668   1.432
  961    HB2  LEU  15           HB2      LEU  15  34.676   4.125   3.927
  962    HB3  LEU  15           HB1      LEU  15  32.922   3.973   4.046
  963    HG   LEU  15           HG       LEU  15  34.553   1.957   2.497
  964   HD11  LEU  15          HD11      LEU  15  34.725   0.591   4.490
  965   HD12  LEU  15          HD12      LEU  15  33.802   1.765   5.429
  966   HD13  LEU  15          HD13      LEU  15  35.422   2.168   4.859
  967   HD21  LEU  15          HD21      LEU  15  31.907   1.806   3.980
  968   HD22  LEU  15          HD22      LEU  15  32.613   0.534   2.984
  969   HD23  LEU  15          HD23      LEU  15  32.071   2.037   2.241
  970    H    SER  16           HN       SER  16  34.596   6.669   2.261
  971    HA   SER  16           HA       SER  16  32.201   8.037   3.047
  972    HB2  SER  16           HB2      SER  16  34.906   9.070   2.201
  973    HB3  SER  16           HB1      SER  16  33.603  10.071   2.841
  974    HG   SER  16           HG       SER  16  34.672   9.537   4.629
  975    H    ALA  17           HN       ALA  17  34.176   7.902   0.093
  976    HA   ALA  17           HA       ALA  17  32.724   9.762  -1.416
  977    HB1  ALA  17           HB1      ALA  17  33.876   8.940  -3.279
  978    HB2  ALA  17           HB2      ALA  17  33.883   7.286  -2.665
  979    HB3  ALA  17           HB3      ALA  17  34.946   8.500  -1.950
  980    H    LEU  18           HN       LEU  18  32.360   6.198  -1.278
  981    HA   LEU  18           HA       LEU  18  30.046   6.165  -2.934
  982    HB2  LEU  18           HB2      LEU  18  31.690   4.247  -2.333
  983    HB3  LEU  18           HB1      LEU  18  30.675   4.041  -0.905
  984    HG   LEU  18           HG       LEU  18  29.133   4.347  -3.385
  985   HD11  LEU  18          HD11      LEU  18  29.685   2.217  -4.360
  986   HD12  LEU  18          HD12      LEU  18  30.778   1.827  -3.032
  987   HD13  LEU  18          HD13      LEU  18  31.198   3.104  -4.174
  988   HD21  LEU  18          HD21      LEU  18  27.934   2.449  -2.419
  989   HD22  LEU  18          HD22      LEU  18  28.247   3.646  -1.163
  990   HD23  LEU  18          HD23      LEU  18  29.235   2.189  -1.257
  991    H    HIS  19           HN       HIS  19  30.599   6.697   0.435
  992    HA   HIS  19           HA       HIS  19  28.044   6.026   1.435
  993    HB2  HIS  19           HB2      HIS  19  29.585   6.316   3.128
  994    HB3  HIS  19           HB1      HIS  19  30.286   7.745   2.386
  995    HD2  HIS  19           HD2      HIS  19  28.899  10.176   2.903
  996    HE1  HIS  19           HE1      HIS  19  26.214   8.524   5.713
  997    HE2  HIS  19           HE2      HIS  19  27.085  10.690   4.709
  998    H    PHE  20           HN       PHE  20  29.393   9.176   0.463
  999    HA   PHE  20           HA       PHE  20  26.877  10.515   0.760
 1000    HB2  PHE  20           HB2      PHE  20  29.600  11.248   0.254
 1001    HB3  PHE  20           HB1      PHE  20  28.574  11.981  -0.980
 1002    HD1  PHE  20           HD1      PHE  20  29.791  12.302   2.338
 1003    HD2  PHE  20           HD2      PHE  20  26.336  13.062  -0.100
 1004    HE1  PHE  20           HE1      PHE  20  28.990  13.975   3.987
 1005    HE2  PHE  20           HE2      PHE  20  25.539  14.731   1.547
 1006    HZ   PHE  20           HZ       PHE  20  26.855  15.178   3.590
 1007    H    MET  21           HN       MET  21  28.376   8.639  -1.733
 1008    HA   MET  21           HA       MET  21  26.998   9.774  -3.956
 1009    HB2  MET  21           HB2      MET  21  28.957   7.823  -3.529
 1010    HB3  MET  21           HB1      MET  21  27.603   6.967  -4.262
 1011    HG2  MET  21           HG2      MET  21  28.935   7.804  -6.071
 1012    HG3  MET  21           HG1      MET  21  27.506   8.833  -5.983
 1013    HE1  MET  21           HE1      MET  21  27.833  11.014  -6.663
 1014    HE2  MET  21           HE2      MET  21  29.197  10.398  -7.591
 1015    HE3  MET  21           HE3      MET  21  29.364  11.901  -6.688
 1016    H    ALA  22           HN       ALA  22  26.484   6.718  -2.183
 1017    HA   ALA  22           HA       ALA  22  24.013   6.126  -3.433
 1018    HB1  ALA  22           HB1      ALA  22  23.937   4.273  -2.075
 1019    HB2  ALA  22           HB2      ALA  22  24.585   5.136  -0.680
 1020    HB3  ALA  22           HB3      ALA  22  25.659   4.643  -1.989
 1021    H    TRP  23           HN       TRP  23  24.823   7.808  -0.419
 1022    HA   TRP  23           HA       TRP  23  22.208   8.005   0.611
 1023    HB2  TRP  23           HB2      TRP  23  24.501   8.558   1.705
 1024    HB3  TRP  23           HB1      TRP  23  24.271  10.155   0.995
 1025    HD1  TRP  23           HD1      TRP  23  23.133   7.943   3.790
 1026    HE1  TRP  23           HE1      TRP  23  21.402   9.183   5.239
 1027    HE3  TRP  23           HE3      TRP  23  22.255  12.007   0.827
 1028    HZ2  TRP  23           HZ2      TRP  23  19.846  11.581   5.153
 1029    HZ3  TRP  23           HZ3      TRP  23  20.642  13.751   1.533
 1030    HH2  TRP  23           HH2      TRP  23  19.438  13.544   3.691
 1031    H    THR  24           HN       THR  24  24.037  10.110  -1.595
 1032    HA   THR  24           HA       THR  24  22.066  12.164  -1.731
 1033    HB   THR  24           HB       THR  24  23.307  12.754  -3.880
 1034    HG1  THR  24           HG1      THR  24  24.137  10.784  -4.422
 1035   HG21  THR  24          HG21      THR  24  24.616  12.519  -1.173
 1036   HG22  THR  24          HG22      THR  24  23.960  13.952  -1.965
 1037   HG23  THR  24          HG23      THR  24  25.471  13.246  -2.534
 1038    H    ILE  25           HN       ILE  25  22.672   9.218  -3.602
 1039    HA   ILE  25           HA       ILE  25  20.833   9.726  -5.681
 1040    HB   ILE  25           HB       ILE  25  21.888   7.158  -4.493
 1041   HG12  ILE  25          HG12      ILE  25  22.450   8.450  -7.171
 1042   HG13  ILE  25          HG11      ILE  25  23.410   8.799  -5.735
 1043   HG21  ILE  25          HG21      ILE  25  20.097   7.633  -6.890
 1044   HG22  ILE  25          HG22      ILE  25  19.771   6.603  -5.496
 1045   HG23  ILE  25          HG23      ILE  25  21.022   6.150  -6.653
 1046   HD11  ILE  25          HD11      ILE  25  23.033   6.108  -7.075
 1047   HD12  ILE  25          HD12      ILE  25  23.798   6.312  -5.501
 1048   HD13  ILE  25          HD13      ILE  25  24.529   7.030  -6.934
 1049    H    GLY  26           HN       GLY  26  20.469   8.046  -2.560
 1050    HA2  GLY  26           HA2      GLY  26  17.774   7.272  -2.910
 1051    HA3  GLY  26           HA1      GLY  26  18.591   7.453  -1.361
 1052    H    HIS  27           HN       HIS  27  19.243  10.172  -1.501
 1053    HA   HIS  27           HA       HIS  27  16.885  11.382  -0.552
 1054    HB2  HIS  27           HB2      HIS  27  18.960  12.277   0.185
 1055    HB3  HIS  27           HB1      HIS  27  19.523  12.530  -1.467
 1056    HD2  HIS  27           HD2      HIS  27  18.975  15.053  -2.432
 1057    HE1  HIS  27           HE1      HIS  27  16.021  16.146   0.380
 1058    HE2  HIS  27           HE2      HIS  27  17.399  16.958  -1.593
 1059    H    LEU  28           HN       LEU  28  18.496  11.552  -3.709
 1060    HA   LEU  28           HA       LEU  28  16.449  13.337  -4.760
 1061    HB2  LEU  28           HB2      LEU  28  18.820  11.998  -6.087
 1062    HB3  LEU  28           HB1      LEU  28  17.773  13.199  -6.846
 1063    HG   LEU  28           HG       LEU  28  19.329  13.688  -4.290
 1064   HD11  LEU  28          HD11      LEU  28  19.954  14.712  -7.072
 1065   HD12  LEU  28          HD12      LEU  28  20.752  13.311  -6.358
 1066   HD13  LEU  28          HD13      LEU  28  20.930  14.901  -5.616
 1067   HD21  LEU  28          HD21      LEU  28  17.672  15.418  -6.143
 1068   HD22  LEU  28          HD22      LEU  28  18.813  16.100  -4.985
 1069   HD23  LEU  28          HD23      LEU  28  17.440  15.152  -4.415
 1070    H    ASN  29           HN       ASN  29  14.764  12.754  -6.021
 1071    HA   ASN  29           HA       ASN  29  14.168   9.922  -6.255
 1072    HB2  ASN  29           HB2      ASN  29  12.436  11.583  -5.606
 1073    HB3  ASN  29           HB1      ASN  29  12.576  12.315  -7.203
 1074   HD21  ASN  29          HD21      ASN  29  10.587  11.713  -8.145
 1075   HD22  ASN  29          HD22      ASN  29  10.073  10.103  -8.313
 1076    H    GLN  30           HN       GLN  30  14.854   8.756  -7.920
 1077    HA   GLN  30           HA       GLN  30  15.571  10.100 -10.426
 1078    HB2  GLN  30           HB2      GLN  30  16.049   7.273  -9.444
 1079    HB3  GLN  30           HB1      GLN  30  16.570   7.887 -11.013
 1080    HG2  GLN  30           HG2      GLN  30  17.946   9.593  -9.923
 1081    HG3  GLN  30           HG1      GLN  30  17.381   9.065  -8.339
 1082   HE21  GLN  30          HE21      GLN  30  20.174   9.004  -9.625
 1083   HE22  GLN  30          HE22      GLN  30  20.674   7.392  -9.442
 1084    H    ILE  31           HN       ILE  31  14.613   9.651 -12.369
 1085    HA   ILE  31           HA       ILE  31  12.282   7.838 -12.338
 1086    HB   ILE  31           HB       ILE  31  11.062   9.470 -13.726
 1087   HG12  ILE  31          HG12      ILE  31  13.322  11.378 -13.061
 1088   HG13  ILE  31          HG11      ILE  31  13.177  10.559 -14.615
 1089   HG21  ILE  31          HG21      ILE  31  12.080  10.770 -11.188
 1090   HG22  ILE  31          HG22      ILE  31  10.929   9.434 -11.193
 1091   HG23  ILE  31          HG23      ILE  31  10.497  10.974 -11.938
 1092   HD11  ILE  31          HD11      ILE  31  12.178  12.844 -14.643
 1093   HD12  ILE  31          HD12      ILE  31  11.036  12.327 -13.402
 1094   HD13  ILE  31          HD13      ILE  31  10.999  11.583 -15.001
 1095    H    LYS  32           HN       LYS  32  11.701   6.951 -14.391
 1096    HA   LYS  32           HA       LYS  32  14.008   6.533 -16.116
 1097    HB2  LYS  32           HB2      LYS  32  11.338   5.246 -15.749
 1098    HB3  LYS  32           HB1      LYS  32  12.152   5.055 -17.302
 1099    HG2  LYS  32           HG2      LYS  32  13.721   4.609 -14.788
 1100    HG3  LYS  32           HG1      LYS  32  12.618   3.347 -15.338
 1101    HD2  LYS  32           HD2      LYS  32  14.288   4.487 -17.478
 1102    HD3  LYS  32           HD1      LYS  32  15.203   3.653 -16.222
 1103    HE2  LYS  32           HE2      LYS  32  12.750   2.271 -17.149
 1104    HE3  LYS  32           HE1      LYS  32  14.061   2.372 -18.324
 1105    HZ1  LYS  32           HZ1      LYS  32  14.152   0.388 -16.865
 1106    HZ2  LYS  32           HZ2      LYS  32  14.406   1.417 -15.536
 1107    HZ3  LYS  32           HZ3      LYS  32  15.547   1.350 -16.795
 1108    H    ARG  33           HN       ARG  33  14.350   8.273 -17.414
 1109    HA   ARG  33           HA       ARG  33  12.091   9.494 -18.826
 1110    HB2  ARG  33           HB2      ARG  33  15.004  10.232 -18.534
 1111    HB3  ARG  33           HB1      ARG  33  13.920  11.066 -19.648
 1112    HG2  ARG  33           HG2      ARG  33  12.491  11.782 -17.865
 1113    HG3  ARG  33           HG1      ARG  33  13.299  10.725 -16.706
 1114    HD2  ARG  33           HD2      ARG  33  14.047  13.063 -16.445
 1115    HD3  ARG  33           HD1      ARG  33  15.373  12.023 -16.954
 1116    HE   ARG  33           HE       ARG  33  15.449  13.180 -18.964
 1117   HH11  ARG  33          HH11      ARG  33  12.470  13.869 -17.287
 1118   HH12  ARG  33          HH12      ARG  33  12.009  15.129 -18.374
 1119   HH21  ARG  33          HH21      ARG  33  14.819  14.834 -20.371
 1120   HH22  ARG  33          HH22      ARG  33  13.328  15.673 -20.109
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1  51.793  26.087   5.256
    2    H2   MET   1           HT2      MET   1  52.150  24.435   5.425
    3    H3   MET   1           HT3      MET   1  53.222  25.458   4.593
    4    HA   MET   1           HA       MET   1  53.476  24.748   7.175
    5    HB2  MET   1           HB2      MET   1  54.885  26.175   5.337
    6    HB3  MET   1           HB1      MET   1  54.464  27.454   6.477
    7    HG2  MET   1           HG2      MET   1  56.530  26.551   7.262
    8    HG3  MET   1           HG1      MET   1  55.288  25.883   8.321
    9    HE1  MET   1           HE1      MET   1  57.657  22.945   8.229
   10    HE2  MET   1           HE2      MET   1  56.245  23.495   9.126
   11    HE3  MET   1           HE3      MET   1  57.545  24.627   8.764
   12    H    PHE   2           HN       PHE   2  50.754  25.612   6.899
   13    HA   PHE   2           HA       PHE   2  50.558  27.265   9.261
   14    HB2  PHE   2           HB2      PHE   2  48.968  28.869   7.977
   15    HB3  PHE   2           HB1      PHE   2  50.709  29.117   7.833
   16    HD1  PHE   2           HD1      PHE   2  47.737  27.629   6.165
   17    HD2  PHE   2           HD2      PHE   2  51.839  28.836   5.750
   18    HE1  PHE   2           HE1      PHE   2  47.586  27.302   3.712
   19    HE2  PHE   2           HE2      PHE   2  51.686  28.510   3.296
   20    HZ   PHE   2           HZ       PHE   2  49.560  27.742   2.277
   21    H    GLU   3           HN       GLU   3  49.752  24.584   8.224
   22    HA   GLU   3           HA       GLU   3  46.912  24.640   7.866
   23    HB2  GLU   3           HB2      GLU   3  48.798  22.363   8.515
   24    HB3  GLU   3           HB1      GLU   3  47.087  22.164   8.139
   25    HG2  GLU   3           HG2      GLU   3  48.059  21.849   6.042
   26    HG3  GLU   3           HG1      GLU   3  47.671  23.567   6.000
   27    HA   PRO   4           HA       PRO   4  45.773  24.765  12.160
   28    HB2  PRO   4           HB2      PRO   4  43.298  23.641  12.079
   29    HB3  PRO   4           HB1      PRO   4  43.640  25.256  11.427
   30    HG2  PRO   4           HG2      PRO   4  43.345  22.661   9.995
   31    HG3  PRO   4           HG1      PRO   4  42.770  24.275   9.541
   32    HD2  PRO   4           HD2      PRO   4  45.031  23.122   8.485
   33    HD3  PRO   4           HD1      PRO   4  44.791  24.878   8.613
   34    H    PHE   5           HN       PHE   5  45.274  21.665  10.504
   35    HA   PHE   5           HA       PHE   5  46.411  20.252  12.796
   36    HB2  PHE   5           HB2      PHE   5  43.567  20.129  11.995
   37    HB3  PHE   5           HB1      PHE   5  44.347  18.571  12.261
   38    HD1  PHE   5           HD1      PHE   5  43.083  21.609  13.814
   39    HD2  PHE   5           HD2      PHE   5  45.456  18.087  14.459
   40    HE1  PHE   5           HE1      PHE   5  42.894  21.931  16.266
   41    HE2  PHE   5           HE2      PHE   5  45.269  18.410  16.912
   42    HZ   PHE   5           HZ       PHE   5  43.983  20.332  17.820
   43    H    GLN   6           HN       GLN   6  44.455  18.918  10.162
   44    HA   GLN   6           HA       GLN   6  46.836  18.155   8.665
   45    HB2  GLN   6           HB2      GLN   6  44.954  16.140   9.907
   46    HB3  GLN   6           HB1      GLN   6  46.097  15.755   8.620
   47    HG2  GLN   6           HG2      GLN   6  47.950  16.588  10.065
   48    HG3  GLN   6           HG1      GLN   6  46.785  16.850  11.361
   49   HE21  GLN   6          HE21      GLN   6  48.987  14.600  10.187
   50   HE22  GLN   6          HE22      GLN   6  48.341  13.205  10.907
   51    H    ILE   7           HN       ILE   7  46.280  17.176   6.587
   52    HA   ILE   7           HA       ILE   7  44.237  18.615   5.261
   53    HB   ILE   7           HB       ILE   7  45.548  16.077   4.274
   54   HG12  ILE   7          HG12      ILE   7  47.349  17.505   5.023
   55   HG13  ILE   7          HG11      ILE   7  47.251  17.658   3.271
   56   HG21  ILE   7          HG21      ILE   7  43.688  16.944   2.917
   57   HG22  ILE   7          HG22      ILE   7  45.223  17.151   2.073
   58   HG23  ILE   7          HG23      ILE   7  44.458  18.530   2.862
   59   HD11  ILE   7          HD11      ILE   7  46.279  19.609   5.363
   60   HD12  ILE   7          HD12      ILE   7  45.757  19.700   3.682
   61   HD13  ILE   7          HD13      ILE   7  47.463  19.883   4.087
   62    H    LEU   8           HN       LEU   8  44.439  15.273   6.391
   63    HA   LEU   8           HA       LEU   8  41.895  14.456   5.361
   64    HB2  LEU   8           HB2      LEU   8  43.961  13.315   7.141
   65    HB3  LEU   8           HB1      LEU   8  42.319  12.745   7.429
   66    HG   LEU   8           HG       LEU   8  43.639  11.377   5.762
   67   HD11  LEU   8          HD11      LEU   8  41.228  12.687   4.491
   68   HD12  LEU   8          HD12      LEU   8  41.082  11.594   5.867
   69   HD13  LEU   8          HD13      LEU   8  41.763  11.013   4.348
   70   HD21  LEU   8          HD21      LEU   8  44.697  13.485   4.743
   71   HD22  LEU   8          HD22      LEU   8  43.170  13.706   3.888
   72   HD23  LEU   8          HD23      LEU   8  44.137  12.257   3.609
   73    H    SER   9           HN       SER   9  42.996  15.856   8.380
   74    HA   SER   9           HA       SER   9  40.555  15.457   9.825
   75    HB2  SER   9           HB2      SER   9  41.484  17.062  11.431
   76    HB3  SER   9           HB1      SER   9  42.693  15.866  10.976
   77    HG   SER   9           HG       SER   9  42.433  18.557  10.161
   78    H    ILE  10           HN       ILE  10  41.913  18.133   7.944
   79    HA   ILE  10           HA       ILE  10  39.817  19.966   8.445
   80    HB   ILE  10           HB       ILE  10  41.957  19.742   6.354
   81   HG12  ILE  10          HG12      ILE  10  42.258  20.631   8.757
   82   HG13  ILE  10          HG11      ILE  10  42.837  21.660   7.449
   83   HG21  ILE  10          HG21      ILE  10  41.078  22.046   5.588
   84   HG22  ILE  10          HG22      ILE  10  39.559  21.584   6.358
   85   HG23  ILE  10          HG23      ILE  10  40.202  20.622   5.027
   86   HD11  ILE  10          HD11      ILE  10  41.161  23.223   7.749
   87   HD12  ILE  10          HD12      ILE  10  41.283  22.626   9.402
   88   HD13  ILE  10          HD13      ILE  10  40.001  22.039   8.351
   89    H    CYS  11           HN       CYS  11  40.344  17.569   5.885
   90    HA   CYS  11           HA       CYS  11  38.152  18.269   4.268
   91    HB2  CYS  11           HB2      CYS  11  39.503  15.604   4.741
   92    HB3  CYS  11           HB1      CYS  11  38.252  15.854   3.523
   93    HG   CYS  11           HG       CYS  11  39.879  17.059   2.080
   94    H    SER  12           HN       SER  12  38.384  15.848   6.892
   95    HA   SER  12           HA       SER  12  35.702  15.044   6.837
   96    HB2  SER  12           HB2      SER  12  37.425  13.823   8.080
   97    HB3  SER  12           HB1      SER  12  37.596  15.174   9.195
   98    HG   SER  12           HG       SER  12  35.138  13.842   8.711
   99    H    PHE  13           HN       PHE  13  37.278  17.705   8.565
  100    HA   PHE  13           HA       PHE  13  35.110  18.479  10.181
  101    HB2  PHE  13           HB2      PHE  13  37.394  19.317  10.512
  102    HB3  PHE  13           HB1      PHE  13  37.304  20.189   8.983
  103    HD1  PHE  13           HD1      PHE  13  35.523  19.844  12.262
  104    HD2  PHE  13           HD2      PHE  13  36.505  22.394   8.946
  105    HE1  PHE  13           HE1      PHE  13  34.468  21.764  13.425
  106    HE2  PHE  13           HE2      PHE  13  35.447  24.313  10.109
  107    HZ   PHE  13           HZ       PHE  13  34.430  23.998  12.348
  108    H    ILE  14           HN       ILE  14  36.119  19.746   6.982
  109    HA   ILE  14           HA       ILE  14  33.895  21.496   6.734
  110    HB   ILE  14           HB       ILE  14  35.960  21.803   5.434
  111   HG12  ILE  14          HG12      ILE  14  33.652  21.261   3.554
  112   HG13  ILE  14          HG11      ILE  14  33.670  22.630   4.667
  113   HG21  ILE  14          HG21      ILE  14  35.068  19.252   4.067
  114   HG22  ILE  14          HG22      ILE  14  36.577  19.530   4.934
  115   HG23  ILE  14          HG23      ILE  14  36.278  20.348   3.402
  116   HD11  ILE  14          HD11      ILE  14  35.709  22.046   2.500
  117   HD12  ILE  14          HD12      ILE  14  35.845  23.356   3.674
  118   HD13  ILE  14          HD13      ILE  14  34.527  23.356   2.502
  119    H    LEU  15           HN       LEU  15  34.402  18.131   5.968
  120    HA   LEU  15           HA       LEU  15  32.172  17.735   4.277
  121    HB2  LEU  15           HB2      LEU  15  33.781  15.938   6.074
  122    HB3  LEU  15           HB1      LEU  15  32.346  15.328   5.249
  123    HG   LEU  15           HG       LEU  15  34.468  16.827   3.723
  124   HD11  LEU  15          HD11      LEU  15  35.743  15.078   4.738
  125   HD12  LEU  15          HD12      LEU  15  35.337  14.496   3.124
  126   HD13  LEU  15          HD13      LEU  15  34.441  13.908   4.524
  127   HD21  LEU  15          HD21      LEU  15  33.550  15.534   1.853
  128   HD22  LEU  15          HD22      LEU  15  32.245  16.375   2.690
  129   HD23  LEU  15          HD23      LEU  15  32.495  14.650   2.957
  130    H    SER  16           HN       SER  16  32.470  16.830   7.725
  131    HA   SER  16           HA       SER  16  29.811  16.296   8.207
  132    HB2  SER  16           HB2      SER  16  30.293  16.741  10.569
  133    HB3  SER  16           HB1      SER  16  31.613  15.851   9.817
  134    HG   SER  16           HG       SER  16  32.496  17.541  10.958
  135    H    ALA  17           HN       ALA  17  31.436  19.450   8.183
  136    HA   ALA  17           HA       ALA  17  29.317  20.960   9.287
  137    HB1  ALA  17           HB1      ALA  17  31.481  21.714   7.310
  138    HB2  ALA  17           HB2      ALA  17  31.497  21.961   9.057
  139    HB3  ALA  17           HB3      ALA  17  30.379  22.876   8.046
  140    H    LEU  18           HN       LEU  18  30.137  20.190   5.929
  141    HA   LEU  18           HA       LEU  18  27.953  21.547   4.735
  142    HB2  LEU  18           HB2      LEU  18  29.642  19.235   3.761
  143    HB3  LEU  18           HB1      LEU  18  28.455  20.071   2.760
  144    HG   LEU  18           HG       LEU  18  30.732  21.475   4.178
  145   HD11  LEU  18          HD11      LEU  18  31.936  21.464   2.108
  146   HD12  LEU  18          HD12      LEU  18  30.559  20.790   1.236
  147   HD13  LEU  18          HD13      LEU  18  31.440  19.796   2.396
  148   HD21  LEU  18          HD21      LEU  18  28.670  22.288   2.121
  149   HD22  LEU  18          HD22      LEU  18  30.143  23.218   2.391
  150   HD23  LEU  18          HD23      LEU  18  28.978  23.016   3.697
  151    H    HIS  19           HN       HIS  19  28.357  18.308   5.973
  152    HA   HIS  19           HA       HIS  19  25.947  17.201   4.954
  153    HB2  HIS  19           HB2      HIS  19  27.159  15.444   5.663
  154    HB3  HIS  19           HB1      HIS  19  28.079  16.428   6.799
  155    HD2  HIS  19           HD2      HIS  19  26.876  16.660   9.408
  156    HE1  HIS  19           HE1      HIS  19  24.044  13.595   8.776
  157    HE2  HIS  19           HE2      HIS  19  25.112  15.094  10.526
  158    H    PHE  20           HN       PHE  20  26.744  18.921   7.903
  159    HA   PHE  20           HA       PHE  20  24.187  18.487   9.159
  160    HB2  PHE  20           HB2      PHE  20  26.717  19.570   9.903
  161    HB3  PHE  20           HB1      PHE  20  25.485  20.790  10.223
  162    HD1  PHE  20           HD1      PHE  20  26.649  17.380  11.019
  163    HD2  PHE  20           HD2      PHE  20  23.700  20.394  11.827
  164    HE1  PHE  20           HE1      PHE  20  25.914  16.121  13.027
  165    HE2  PHE  20           HE2      PHE  20  22.964  19.140  13.835
  166    HZ   PHE  20           HZ       PHE  20  24.060  17.000  14.438
  167    H    MET  21           HN       MET  21  25.666  21.003   7.186
  168    HA   MET  21           HA       MET  21  23.581  22.927   7.551
  169    HB2  MET  21           HB2      MET  21  25.824  22.619   5.558
  170    HB3  MET  21           HB1      MET  21  24.681  23.964   5.499
  171    HG2  MET  21           HG2      MET  21  25.250  24.544   7.835
  172    HG3  MET  21           HG1      MET  21  26.408  23.218   7.877
  173    HE1  MET  21           HE1      MET  21  28.188  26.753   7.839
  174    HE2  MET  21           HE2      MET  21  28.430  25.163   8.555
  175    HE3  MET  21           HE3      MET  21  26.864  25.954   8.697
  176    H    ALA  22           HN       ALA  22  24.444  20.809   4.849
  177    HA   ALA  22           HA       ALA  22  22.272  21.489   3.191
  178    HB1  ALA  22           HB1      ALA  22  22.749  19.118   2.215
  179    HB2  ALA  22           HB2      ALA  22  24.129  19.144   3.314
  180    HB3  ALA  22           HB3      ALA  22  23.970  20.381   2.067
  181    H    TRP  23           HN       TRP  23  22.619  18.894   5.601
  182    HA   TRP  23           HA       TRP  23  19.996  17.861   5.037
  183    HB2  TRP  23           HB2      TRP  23  21.967  17.332   7.248
  184    HB3  TRP  23           HB1      TRP  23  20.352  16.626   7.251
  185    HD1  TRP  23           HD1      TRP  23  23.620  15.622   6.363
  186    HE1  TRP  23           HE1      TRP  23  23.664  13.892   4.453
  187    HE3  TRP  23           HE3      TRP  23  18.894  16.225   4.512
  188    HZ2  TRP  23           HZ2      TRP  23  21.928  12.902   2.403
  189    HZ3  TRP  23           HZ3      TRP  23  18.122  14.885   2.577
  190    HH2  TRP  23           HH2      TRP  23  19.630  13.224   1.523
  191    H    THR  24           HN       THR  24  21.286  20.333   7.126
  192    HA   THR  24           HA       THR  24  19.104  20.509   8.938
  193    HB   THR  24           HB       THR  24  21.329  22.319   8.099
  194    HG1  THR  24           HG1      THR  24  21.591  22.257  10.405
  195   HG21  THR  24          HG21      THR  24  18.813  23.155   9.546
  196   HG22  THR  24          HG22      THR  24  19.590  23.935   8.169
  197   HG23  THR  24          HG23      THR  24  20.342  24.007   9.761
  198    H    ILE  25           HN       ILE  25  19.885  22.479   6.059
  199    HA   ILE  25           HA       ILE  25  17.419  23.880   6.048
  200    HB   ILE  25           HB       ILE  25  19.461  23.402   3.872
  201   HG12  ILE  25          HG12      ILE  25  18.831  25.898   5.473
  202   HG13  ILE  25          HG11      ILE  25  20.071  24.740   5.954
  203   HG21  ILE  25          HG21      ILE  25  17.360  23.880   2.785
  204   HG22  ILE  25          HG22      ILE  25  18.300  25.372   2.784
  205   HG23  ILE  25          HG23      ILE  25  16.991  25.157   3.946
  206   HD11  ILE  25          HD11      ILE  25  20.026  26.003   3.206
  207   HD12  ILE  25          HD12      ILE  25  21.355  25.145   3.985
  208   HD13  ILE  25          HD13      ILE  25  20.873  26.738   4.568
  209    H    GLY  26           HN       GLY  26  18.537  21.009   4.295
  210    HA2  GLY  26           HA2      GLY  26  16.280  20.658   2.644
  211    HA3  GLY  26           HA1      GLY  26  17.397  19.384   3.126
  212    H    HIS  27           HN       HIS  27  16.967  19.663   5.938
  213    HA   HIS  27           HA       HIS  27  14.659  17.990   6.241
  214    HB2  HIS  27           HB2      HIS  27  16.510  17.559   7.682
  215    HB3  HIS  27           HB1      HIS  27  16.566  19.239   8.220
  216    HD2  HIS  27           HD2      HIS  27  14.949  19.785  10.403
  217    HE1  HIS  27           HE1      HIS  27  12.717  16.200  10.374
  218    HE2  HIS  27           HE2      HIS  27  13.140  18.363  11.638
  219    H    LEU  28           HN       LEU  28  15.417  21.367   6.885
  220    HA   LEU  28           HA       LEU  28  13.157  22.009   8.444
  221    HB2  LEU  28           HB2      LEU  28  15.249  23.413   8.081
  222    HB3  LEU  28           HB1      LEU  28  14.552  23.882   6.531
  223    HG   LEU  28           HG       LEU  28  12.466  24.574   7.832
  224   HD11  LEU  28          HD11      LEU  28  13.022  25.165  10.260
  225   HD12  LEU  28          HD12      LEU  28  14.417  24.099  10.096
  226   HD13  LEU  28          HD13      LEU  28  12.785  23.452   9.917
  227   HD21  LEU  28          HD21      LEU  28  13.900  26.292   6.982
  228   HD22  LEU  28          HD22      LEU  28  15.137  25.955   8.194
  229   HD23  LEU  28          HD23      LEU  28  13.612  26.700   8.674
  230    H    ASN  29           HN       ASN  29  11.088  22.421   7.940
  231    HA   ASN  29           HA       ASN  29  10.366  22.716   5.089
  232    HB2  ASN  29           HB2      ASN  29   8.320  21.386   5.560
  233    HB3  ASN  29           HB1      ASN  29   9.797  20.446   5.757
  234   HD21  ASN  29          HD21      ASN  29   6.880  20.828   7.197
  235   HD22  ASN  29          HD22      ASN  29   7.306  20.561   8.818
  236    H    GLN  30           HN       GLN  30   8.903  24.283   4.648
  237    HA   GLN  30           HA       GLN  30   7.474  25.546   6.890
  238    HB2  GLN  30           HB2      GLN  30   8.117  27.764   6.166
  239    HB3  GLN  30           HB1      GLN  30   9.584  26.821   6.434
  240    HG2  GLN  30           HG2      GLN  30   9.614  26.288   3.981
  241    HG3  GLN  30           HG1      GLN  30   8.259  27.394   3.769
  242   HE21  GLN  30          HE21      GLN  30  11.514  27.316   3.364
  243   HE22  GLN  30          HE22      GLN  30  11.893  28.939   3.688
  244    H    ILE  31           HN       ILE  31   5.487  26.352   6.364
  245    HA   ILE  31           HA       ILE  31   4.695  26.377   3.538
  246    HB   ILE  31           HB       ILE  31   2.647  25.106   4.063
  247   HG12  ILE  31          HG12      ILE  31   3.965  24.584   6.745
  248   HG13  ILE  31          HG11      ILE  31   2.641  25.725   6.510
  249   HG21  ILE  31          HG21      ILE  31   5.180  23.659   4.895
  250   HG22  ILE  31          HG22      ILE  31   4.696  23.960   3.226
  251   HG23  ILE  31          HG23      ILE  31   3.715  22.915   4.254
  252   HD11  ILE  31          HD11      ILE  31   2.573  22.745   5.955
  253   HD12  ILE  31          HD12      ILE  31   1.265  23.863   5.566
  254   HD13  ILE  31          HD13      ILE  31   1.724  23.592   7.247
  255    H    LYS  32           HN       LYS  32   2.904  27.717   3.086
  256    HA   LYS  32           HA       LYS  32   2.614  29.928   4.917
  257    HB2  LYS  32           HB2      LYS  32   1.346  30.976   3.169
  258    HB3  LYS  32           HB1      LYS  32   2.700  30.143   2.403
  259    HG2  LYS  32           HG2      LYS  32   1.163  28.179   2.014
  260    HG3  LYS  32           HG1      LYS  32  -0.169  29.186   2.580
  261    HD2  LYS  32           HD2      LYS  32   0.334  30.838   0.808
  262    HD3  LYS  32           HD1      LYS  32   1.644  29.808   0.230
  263    HE2  LYS  32           HE2      LYS  32  -0.283  29.355  -1.147
  264    HE3  LYS  32           HE1      LYS  32  -0.060  27.968  -0.082
  265    HZ1  LYS  32           HZ1      LYS  32  -2.390  29.026  -0.327
  266    HZ2  LYS  32           HZ2      LYS  32  -1.794  30.190   0.758
  267    HZ3  LYS  32           HZ3      LYS  32  -1.849  28.553   1.210
  268    H    ARG  33           HN       ARG  33   0.764  30.567   6.013
  269    HA   ARG  33           HA       ARG  33  -1.114  28.403   6.602
  270    HB2  ARG  33           HB2      ARG  33  -0.135  30.806   7.988
  271    HB3  ARG  33           HB1      ARG  33  -1.860  30.499   8.196
  272    HG2  ARG  33           HG2      ARG  33  -0.614  29.332   9.944
  273    HG3  ARG  33           HG1      ARG  33  -1.331  28.151   8.846
  274    HD2  ARG  33           HD2      ARG  33   0.766  27.827   7.708
  275    HD3  ARG  33           HD1      ARG  33   1.504  29.176   8.566
  276    HE   ARG  33           HE       ARG  33   1.111  26.491   9.573
  277   HH11  ARG  33          HH11      ARG  33   1.549  29.852  10.389
  278   HH12  ARG  33          HH12      ARG  33   2.199  29.511  11.954
  279   HH21  ARG  33          HH21      ARG  33   1.976  26.075  11.623
  280   HH22  ARG  33          HH22      ARG  33   2.440  27.391  12.650
  281    H1   MET   1           HT1      MET   1  43.125  23.062  30.839
  282    H2   MET   1           HT2      MET   1  43.976  22.961  29.372
  283    H3   MET   1           HT3      MET   1  44.380  24.155  30.511
  284    HA   MET   1           HA       MET   1  45.647  21.796  30.250
  285    HB2  MET   1           HB2      MET   1  45.914  24.065  31.726
  286    HB3  MET   1           HB1      MET   1  45.535  22.902  32.997
  287    HG2  MET   1           HG2      MET   1  47.911  22.849  32.769
  288    HG3  MET   1           HG1      MET   1  47.324  21.398  31.957
  289    HE1  MET   1           HE1      MET   1  50.274  22.190  29.738
  290    HE2  MET   1           HE2      MET   1  49.133  20.880  30.025
  291    HE3  MET   1           HE3      MET   1  49.863  21.718  31.393
  292    H    PHE   2           HN       PHE   2  42.856  21.141  30.340
  293    HA   PHE   2           HA       PHE   2  42.965  18.927  32.195
  294    HB2  PHE   2           HB2      PHE   2  40.655  19.641  33.147
  295    HB3  PHE   2           HB1      PHE   2  42.107  20.392  33.811
  296    HD1  PHE   2           HD1      PHE   2  39.318  20.860  31.397
  297    HD2  PHE   2           HD2      PHE   2  42.534  22.726  33.548
  298    HE1  PHE   2           HE1      PHE   2  38.483  23.093  30.710
  299    HE2  PHE   2           HE2      PHE   2  41.699  24.958  32.862
  300    HZ   PHE   2           HZ       PHE   2  39.674  25.141  31.442
  301    H    GLU   3           HN       GLU   3  42.674  19.512  29.281
  302    HA   GLU   3           HA       GLU   3  39.981  18.861  28.557
  303    HB2  GLU   3           HB2      GLU   3  42.546  18.817  26.950
  304    HB3  GLU   3           HB1      GLU   3  40.938  18.567  26.271
  305    HG2  GLU   3           HG2      GLU   3  41.229  20.855  25.933
  306    HG3  GLU   3           HG1      GLU   3  40.372  20.829  27.471
  307    HA   PRO   4           HA       PRO   4  40.304  14.447  28.969
  308    HB2  PRO   4           HB2      PRO   4  38.369  13.617  27.249
  309    HB3  PRO   4           HB1      PRO   4  38.002  14.412  28.793
  310    HG2  PRO   4           HG2      PRO   4  38.020  15.544  26.039
  311    HG3  PRO   4           HG1      PRO   4  36.893  15.835  27.374
  312    HD2  PRO   4           HD2      PRO   4  38.922  17.564  26.705
  313    HD3  PRO   4           HD1      PRO   4  38.241  17.435  28.341
  314    H    PHE   5           HN       PHE   5  40.212  15.702  25.649
  315    HA   PHE   5           HA       PHE   5  42.382  13.893  24.902
  316    HB2  PHE   5           HB2      PHE   5  39.593  13.649  23.947
  317    HB3  PHE   5           HB1      PHE   5  40.830  13.609  22.691
  318    HD1  PHE   5           HD1      PHE   5  39.319  11.834  25.485
  319    HD2  PHE   5           HD2      PHE   5  42.680  11.920  22.811
  320    HE1  PHE   5           HE1      PHE   5  39.850   9.486  26.079
  321    HE2  PHE   5           HE2      PHE   5  43.211   9.571  23.405
  322    HZ   PHE   5           HZ       PHE   5  41.797   8.353  25.038
  323    H    GLN   6           HN       GLN   6  40.151  15.628  22.765
  324    HA   GLN   6           HA       GLN   6  42.038  17.825  22.441
  325    HB2  GLN   6           HB2      GLN   6  41.320  15.926  20.200
  326    HB3  GLN   6           HB1      GLN   6  42.045  17.514  19.949
  327    HG2  GLN   6           HG2      GLN   6  43.944  16.840  21.418
  328    HG3  GLN   6           HG1      GLN   6  43.236  15.231  21.546
  329   HE21  GLN   6          HE21      GLN   6  45.489  17.006  19.797
  330   HE22  GLN   6          HE22      GLN   6  45.542  16.051  18.395
  331    H    ILE   7           HN       ILE   7  41.147  19.539  21.075
  332    HA   ILE   7           HA       ILE   7  38.464  20.130  21.751
  333    HB   ILE   7           HB       ILE   7  40.056  21.407  19.521
  334   HG12  ILE   7          HG12      ILE   7  41.515  21.390  21.447
  335   HG13  ILE   7          HG11      ILE   7  40.815  23.003  21.333
  336   HG21  ILE   7          HG21      ILE   7  37.693  22.067  19.691
  337   HG22  ILE   7          HG22      ILE   7  38.744  23.400  20.168
  338   HG23  ILE   7          HG23      ILE   7  37.914  22.447  21.399
  339   HD11  ILE   7          HD11      ILE   7  40.057  20.780  23.231
  340   HD12  ILE   7          HD12      ILE   7  39.017  22.178  22.960
  341   HD13  ILE   7          HD13      ILE   7  40.636  22.397  23.627
  342    H    LEU   8           HN       LEU   8  39.970  19.010  18.751
  343    HA   LEU   8           HA       LEU   8  37.578  19.055  17.183
  344    HB2  LEU   8           HB2      LEU   8  40.343  18.057  16.863
  345    HB3  LEU   8           HB1      LEU   8  39.117  17.196  15.936
  346    HG   LEU   8           HG       LEU   8  40.167  19.161  14.740
  347   HD11  LEU   8          HD11      LEU   8  37.206  19.568  15.200
  348   HD12  LEU   8          HD12      LEU   8  37.831  18.182  14.307
  349   HD13  LEU   8          HD13      LEU   8  38.125  19.818  13.716
  350   HD21  LEU   8          HD21      LEU   8  40.185  20.567  16.890
  351   HD22  LEU   8          HD22      LEU   8  38.469  20.846  16.592
  352   HD23  LEU   8          HD23      LEU   8  39.667  21.386  15.417
  353    H    SER   9           HN       SER   9  39.147  16.660  19.213
  354    HA   SER   9           HA       SER   9  37.522  14.446  18.405
  355    HB2  SER   9           HB2      SER   9  38.414  13.329  20.399
  356    HB3  SER   9           HB1      SER   9  39.703  14.129  19.503
  357    HG   SER   9           HG       SER   9  38.431  14.908  21.901
  358    H    ILE  10           HN       ILE  10  37.372  16.786  21.060
  359    HA   ILE  10           HA       ILE  10  35.116  15.664  22.343
  360    HB   ILE  10           HB       ILE  10  36.435  18.356  22.393
  361   HG12  ILE  10          HG12      ILE  10  37.226  16.247  23.648
  362   HG13  ILE  10          HG11      ILE  10  37.029  17.714  24.603
  363   HG21  ILE  10          HG21      ILE  10  34.732  18.862  24.266
  364   HG22  ILE  10          HG22      ILE  10  33.743  17.594  23.542
  365   HG23  ILE  10          HG23      ILE  10  34.171  19.025  22.603
  366   HD11  ILE  10          HD11      ILE  10  35.166  16.913  25.711
  367   HD12  ILE  10          HD12      ILE  10  35.981  15.383  25.395
  368   HD13  ILE  10          HD13      ILE  10  34.653  15.899  24.362
  369    H    CYS  11           HN       CYS  11  35.453  18.148  19.832
  370    HA   CYS  11           HA       CYS  11  32.753  18.928  19.723
  371    HB2  CYS  11           HB2      CYS  11  34.890  18.848  17.583
  372    HB3  CYS  11           HB1      CYS  11  33.297  19.564  17.336
  373    HG   CYS  11           HG       CYS  11  33.953  21.528  18.713
  374    H    SER  12           HN       SER  12  34.506  16.457  17.819
  375    HA   SER  12           HA       SER  12  32.301  15.540  16.359
  376    HB2  SER  12           HB2      SER  12  34.610  14.925  15.804
  377    HB3  SER  12           HB1      SER  12  34.731  13.993  17.293
  378    HG   SER  12           HG       SER  12  32.743  13.542  15.321
  379    H    PHE  13           HN       PHE  13  33.516  14.573  19.546
  380    HA   PHE  13           HA       PHE  13  31.858  12.341  19.949
  381    HB2  PHE  13           HB2      PHE  13  33.783  12.859  21.382
  382    HB3  PHE  13           HB1      PHE  13  32.957  14.294  21.985
  383    HD1  PHE  13           HD1      PHE  13  32.507  10.590  21.645
  384    HD2  PHE  13           HD2      PHE  13  31.592  14.139  23.886
  385    HE1  PHE  13           HE1      PHE  13  31.379   9.210  23.370
  386    HE2  PHE  13           HE2      PHE  13  30.462  12.758  25.608
  387    HZ   PHE  13           HZ       PHE  13  30.355  10.295  25.351
  388    H    ILE  14           HN       ILE  14  31.372  15.737  20.987
  389    HA   ILE  14           HA       ILE  14  28.784  15.267  22.057
  390    HB   ILE  14           HB       ILE  14  30.137  17.217  22.703
  391   HG12  ILE  14          HG12      ILE  14  27.606  18.152  21.334
  392   HG13  ILE  14          HG11      ILE  14  27.586  17.171  22.801
  393   HG21  ILE  14          HG21      ILE  14  29.627  18.084  19.846
  394   HG22  ILE  14          HG22      ILE  14  31.187  17.809  20.618
  395   HG23  ILE  14          HG23      ILE  14  30.188  19.171  21.115
  396   HD11  ILE  14          HD11      ILE  14  28.893  19.887  22.470
  397   HD12  ILE  14          HD12      ILE  14  29.019  18.887  23.916
  398   HD13  ILE  14          HD13      ILE  14  27.452  19.525  23.420
  399    H    LEU  15           HN       LEU  15  29.960  16.027  18.858
  400    HA   LEU  15           HA       LEU  15  27.517  16.817  17.681
  401    HB2  LEU  15           HB2      LEU  15  30.065  15.620  16.619
  402    HB3  LEU  15           HB1      LEU  15  28.680  15.869  15.555
  403    HG   LEU  15           HG       LEU  15  29.671  18.097  17.325
  404   HD11  LEU  15          HD11      LEU  15  31.651  17.522  16.117
  405   HD12  LEU  15          HD12      LEU  15  30.931  18.868  15.235
  406   HD13  LEU  15          HD13      LEU  15  30.744  17.221  14.635
  407   HD21  LEU  15          HD21      LEU  15  28.611  19.479  15.597
  408   HD22  LEU  15          HD22      LEU  15  27.463  18.275  16.181
  409   HD23  LEU  15          HD23      LEU  15  28.271  18.043  14.631
  410    H    SER  16           HN       SER  16  29.159  13.658  17.349
  411    HA   SER  16           HA       SER  16  27.070  12.257  16.231
  412    HB2  SER  16           HB2      SER  16  28.138  10.231  17.103
  413    HB3  SER  16           HB1      SER  16  29.344  11.357  16.487
  414    HG   SER  16           HG       SER  16  30.020  10.666  18.487
  415    H    ALA  17           HN       ALA  17  27.623  12.968  19.664
  416    HA   ALA  17           HA       ALA  17  25.633  11.262  20.714
  417    HB1  ALA  17           HB1      ALA  17  26.730  13.896  21.721
  418    HB2  ALA  17           HB2      ALA  17  27.236  12.276  22.200
  419    HB3  ALA  17           HB3      ALA  17  25.638  12.869  22.651
  420    H    LEU  18           HN       LEU  18  25.510  14.663  19.732
  421    HA   LEU  18           HA       LEU  18  22.765  15.075  20.308
  422    HB2  LEU  18           HB2      LEU  18  24.639  16.483  18.396
  423    HB3  LEU  18           HB1      LEU  18  23.004  17.039  18.755
  424    HG   LEU  18           HG       LEU  18  25.111  16.560  20.876
  425   HD11  LEU  18          HD11      LEU  18  25.534  18.917  20.891
  426   HD12  LEU  18          HD12      LEU  18  24.203  19.229  19.777
  427   HD13  LEU  18          HD13      LEU  18  25.657  18.409  19.207
  428   HD21  LEU  18          HD21      LEU  18  22.354  17.803  20.843
  429   HD22  LEU  18          HD22      LEU  18  23.503  18.100  22.149
  430   HD23  LEU  18          HD23      LEU  18  22.930  16.464  21.835
  431    H    HIS  19           HN       HIS  19  24.460  13.926  17.477
  432    HA   HIS  19           HA       HIS  19  22.275  13.996  15.667
  433    HB2  HIS  19           HB2      HIS  19  24.102  13.684  14.391
  434    HB3  HIS  19           HB1      HIS  19  25.015  12.979  15.723
  435    HD2  HIS  19           HD2      HIS  19  24.706  10.128  15.991
  436    HE1  HIS  19           HE1      HIS  19  22.830   9.611  12.246
  437    HE2  HIS  19           HE2      HIS  19  23.926   8.403  14.192
  438    H    PHE  20           HN       PHE  20  23.456  11.575  17.912
  439    HA   PHE  20           HA       PHE  20  21.674   9.498  17.017
  440    HB2  PHE  20           HB2      PHE  20  23.883   9.728  18.806
  441    HB3  PHE  20           HB1      PHE  20  22.524   9.047  19.699
  442    HD1  PHE  20           HD1      PHE  20  24.815   8.577  16.848
  443    HD2  PHE  20           HD2      PHE  20  21.550   6.906  19.079
  444    HE1  PHE  20           HE1      PHE  20  25.174   6.391  15.735
  445    HE2  PHE  20           HE2      PHE  20  21.909   4.719  17.969
  446    HZ   PHE  20           HZ       PHE  20  23.723   4.462  16.297
  447    H    MET  21           HN       MET  21  21.650  11.960  19.536
  448    HA   MET  21           HA       MET  21  19.335  10.972  20.890
  449    HB2  MET  21           HB2      MET  21  20.806  13.605  20.898
  450    HB3  MET  21           HB1      MET  21  19.368  13.319  21.883
  451    HG2  MET  21           HG2      MET  21  20.465  11.350  22.904
  452    HG3  MET  21           HG1      MET  21  21.907  11.661  21.941
  453    HE1  MET  21           HE1      MET  21  22.482  12.458  25.772
  454    HE2  MET  21           HE2      MET  21  23.388  11.807  24.409
  455    HE3  MET  21           HE3      MET  21  21.793  11.161  24.786
  456    H    ALA  22           HN       ALA  22  19.852  13.715  18.712
  457    HA   ALA  22           HA       ALA  22  17.166  14.547  18.581
  458    HB1  ALA  22           HB1      ALA  22  17.968  15.528  16.299
  459    HB2  ALA  22           HB2      ALA  22  19.558  14.977  16.829
  460    HB3  ALA  22           HB3      ALA  22  18.657  16.142  17.801
  461    H    TRP  23           HN       TRP  23  18.998  12.303  16.512
  462    HA   TRP  23           HA       TRP  23  16.745  11.877  14.780
  463    HB2  TRP  23           HB2      TRP  23  19.388  10.468  15.083
  464    HB3  TRP  23           HB1      TRP  23  18.135   9.876  13.993
  465    HD1  TRP  23           HD1      TRP  23  21.087  11.802  13.749
  466    HE1  TRP  23           HE1      TRP  23  21.010  13.537  11.844
  467    HE3  TRP  23           HE3      TRP  23  16.055  11.923  12.864
  468    HZ2  TRP  23           HZ2      TRP  23  19.069  14.817  10.174
  469    HZ3  TRP  23           HZ3      TRP  23  15.119  13.418  11.127
  470    HH2  TRP  23           HH2      TRP  23  16.619  14.859   9.774
  471    H    THR  24           HN       THR  24  17.877  10.461  17.759
  472    HA   THR  24           HA       THR  24  16.438   8.018  17.616
  473    HB   THR  24           HB       THR  24  17.652   9.651  19.807
  474    HG1  THR  24           HG1      THR  24  18.652   7.580  20.128
  475   HG21  THR  24          HG21      THR  24  15.610   7.452  20.155
  476   HG22  THR  24          HG22      THR  24  15.643   9.044  20.916
  477   HG23  THR  24          HG23      THR  24  16.814   7.814  21.392
  478    H    ILE  25           HN       ILE  25  15.651  11.059  19.316
  479    HA   ILE  25           HA       ILE  25  13.019  10.275  20.018
  480    HB   ILE  25           HB       ILE  25  14.295  13.004  19.788
  481   HG12  ILE  25          HG12      ILE  25  13.525  11.385  22.232
  482   HG13  ILE  25          HG11      ILE  25  15.132  11.319  21.508
  483   HG21  ILE  25          HG21      ILE  25  11.912  13.310  19.557
  484   HG22  ILE  25          HG22      ILE  25  12.331  13.698  21.226
  485   HG23  ILE  25          HG23      ILE  25  11.587  12.146  20.842
  486   HD11  ILE  25          HD11      ILE  25  13.842  13.929  22.329
  487   HD12  ILE  25          HD12      ILE  25  15.539  13.626  21.956
  488   HD13  ILE  25          HD13      ILE  25  14.833  12.978  23.436
  489    H    GLY  26           HN       GLY  26  14.287  12.189  17.317
  490    HA2  GLY  26           HA2      GLY  26  11.821  12.939  16.179
  491    HA3  GLY  26           HA1      GLY  26  13.349  12.822  15.310
  492    H    HIS  27           HN       HIS  27  13.792  10.053  15.843
  493    HA   HIS  27           HA       HIS  27  12.285   8.897  13.698
  494    HB2  HIS  27           HB2      HIS  27  14.544   8.172  13.959
  495    HB3  HIS  27           HB1      HIS  27  14.281   7.756  15.655
  496    HD2  HIS  27           HD2      HIS  27  13.373   5.171  16.059
  497    HE1  HIS  27           HE1      HIS  27  12.381   4.279  12.053
  498    HE2  HIS  27           HE2      HIS  27  12.550   3.328  14.403
  499    H    LEU  28           HN       LEU  28  12.211   8.684  17.212
  500    HA   LEU  28           HA       LEU  28  10.486   6.471  17.459
  501    HB2  LEU  28           HB2      LEU  28  11.851   7.597  19.290
  502    HB3  LEU  28           HB1      LEU  28  10.587   8.825  19.348
  503    HG   LEU  28           HG       LEU  28   8.927   6.908  19.653
  504   HD11  LEU  28          HD11      LEU  28  10.041   4.850  20.692
  505   HD12  LEU  28          HD12      LEU  28  11.553   5.446  20.006
  506   HD13  LEU  28          HD13      LEU  28  10.210   5.021  18.946
  507   HD21  LEU  28          HD21      LEU  28   9.452   8.272  21.549
  508   HD22  LEU  28          HD22      LEU  28  11.054   7.553  21.709
  509   HD23  LEU  28          HD23      LEU  28   9.619   6.604  22.097
  510    H    ASN  29           HN       ASN  29   8.339   6.241  17.255
  511    HA   ASN  29           HA       ASN  29   6.682   8.672  16.963
  512    HB2  ASN  29           HB2      ASN  29   5.371   7.466  15.231
  513    HB3  ASN  29           HB1      ASN  29   7.038   7.757  14.736
  514   HD21  ASN  29          HD21      ASN  29   4.761   5.409  14.551
  515   HD22  ASN  29          HD22      ASN  29   5.745   4.028  14.625
  516    H    GLN  30           HN       GLN  30   4.771   8.639  18.028
  517    HA   GLN  30           HA       GLN  30   3.842   6.093  19.176
  518    HB2  GLN  30           HB2      GLN  30   3.549   7.084  21.364
  519    HB3  GLN  30           HB1      GLN  30   5.230   7.305  20.875
  520    HG2  GLN  30           HG2      GLN  30   4.620   9.591  20.037
  521    HG3  GLN  30           HG1      GLN  30   3.011   9.363  20.720
  522   HE21  GLN  30          HE21      GLN  30   5.838  10.873  21.424
  523   HE22  GLN  30          HE22      GLN  30   5.818  10.766  23.118
  524    H    ILE  31           HN       ILE  31   1.649   5.927  19.367
  525    HA   ILE  31           HA       ILE  31   0.016   8.299  18.801
  526    HB   ILE  31           HB       ILE  31  -1.296   7.044  17.132
  527   HG12  ILE  31          HG12      ILE  31   0.908   4.968  17.336
  528   HG13  ILE  31          HG11      ILE  31  -0.690   4.774  18.055
  529   HG21  ILE  31          HG21      ILE  31   1.672   7.088  16.509
  530   HG22  ILE  31          HG22      ILE  31   0.610   8.494  16.444
  531   HG23  ILE  31          HG23      ILE  31   0.359   7.147  15.334
  532   HD11  ILE  31          HD11      ILE  31  -0.073   5.151  15.110
  533   HD12  ILE  31          HD12      ILE  31  -1.700   5.105  15.792
  534   HD13  ILE  31          HD13      ILE  31  -0.666   3.678  15.879
  535    H    LYS  32           HN       LYS  32  -2.130   8.153  19.563
  536    HA   LYS  32           HA       LYS  32  -2.438   6.425  21.853
  537    HB2  LYS  32           HB2      LYS  32  -4.446   7.663  22.292
  538    HB3  LYS  32           HB1      LYS  32  -3.234   8.819  21.738
  539    HG2  LYS  32           HG2      LYS  32  -4.180   8.570  19.411
  540    HG3  LYS  32           HG1      LYS  32  -5.489   7.617  20.112
  541    HD2  LYS  32           HD2      LYS  32  -6.081   9.519  21.579
  542    HD3  LYS  32           HD1      LYS  32  -4.790  10.475  20.851
  543    HE2  LYS  32           HE2      LYS  32  -6.841  11.076  19.735
  544    HE3  LYS  32           HE1      LYS  32  -5.897  10.100  18.611
  545    HZ1  LYS  32           HZ1      LYS  32  -8.381   9.561  18.990
  546    HZ2  LYS  32           HZ2      LYS  32  -7.830   8.798  20.405
  547    HZ3  LYS  32           HZ3      LYS  32  -7.262   8.291  18.887
  548    H    ARG  33           HN       ARG  33  -3.937   4.783  22.138
  549    HA   ARG  33           HA       ARG  33  -4.817   3.490  19.666
  550    HB2  ARG  33           HB2      ARG  33  -4.179   2.628  22.406
  551    HB3  ARG  33           HB1      ARG  33  -5.579   1.822  21.697
  552    HG2  ARG  33           HG2      ARG  33  -3.556   0.571  21.139
  553    HG3  ARG  33           HG1      ARG  33  -4.216   1.302  19.676
  554    HD2  ARG  33           HD2      ARG  33  -2.599   3.085  19.748
  555    HD3  ARG  33           HD1      ARG  33  -2.045   2.592  21.346
  556    HE   ARG  33           HE       ARG  33  -1.301   1.404  18.813
  557   HH11  ARG  33          HH11      ARG  33  -1.612   0.927  22.253
  558   HH12  ARG  33          HH12      ARG  33  -0.423  -0.326  22.306
  559   HH21  ARG  33          HH21      ARG  33   0.258  -0.231  18.917
  560   HH22  ARG  33          HH22      ARG  33   0.629  -0.979  20.433
  561    H1   MET   1           HT1      MET   1  45.109  -4.261  28.277
  562    H2   MET   1           HT2      MET   1  45.410  -2.589  28.296
  563    H3   MET   1           HT3      MET   1  45.827  -3.546  29.637
  564    HA   MET   1           HA       MET   1  47.531  -2.812  27.690
  565    HB2  MET   1           HB2      MET   1  47.640  -4.156  30.053
  566    HB3  MET   1           HB1      MET   1  48.049  -5.454  28.931
  567    HG2  MET   1           HG2      MET   1  50.126  -4.421  29.497
  568    HG3  MET   1           HG1      MET   1  49.725  -3.829  27.885
  569    HE1  MET   1           HE1      MET   1  51.417  -0.749  29.267
  570    HE2  MET   1           HE2      MET   1  50.848  -1.383  27.724
  571    HE3  MET   1           HE3      MET   1  51.734  -2.434  28.828
  572    H    PHE   2           HN       PHE   2  45.230  -3.845  26.323
  573    HA   PHE   2           HA       PHE   2  46.566  -5.499  24.365
  574    HB2  PHE   2           HB2      PHE   2  44.610  -7.205  24.507
  575    HB3  PHE   2           HB1      PHE   2  45.932  -7.342  25.667
  576    HD1  PHE   2           HD1      PHE   2  42.479  -6.048  25.189
  577    HD2  PHE   2           HD2      PHE   2  45.582  -7.000  28.002
  578    HE1  PHE   2           HE1      PHE   2  40.879  -5.739  27.057
  579    HE2  PHE   2           HE2      PHE   2  43.981  -6.691  29.872
  580    HZ   PHE   2           HZ       PHE   2  41.630  -6.060  29.400
  581    H    GLU   3           HN       GLU   3  45.163  -2.877  24.628
  582    HA   GLU   3           HA       GLU   3  42.675  -3.109  23.229
  583    HB2  GLU   3           HB2      GLU   3  44.455  -0.718  23.750
  584    HB3  GLU   3           HB1      GLU   3  42.849  -0.627  23.029
  585    HG2  GLU   3           HG2      GLU   3  42.364  -0.260  25.279
  586    HG3  GLU   3           HG1      GLU   3  42.116  -1.998  25.142
  587    HA   PRO   4           HA       PRO   4  44.325  -3.291  19.106
  588    HB2  PRO   4           HB2      PRO   4  42.235  -2.323  17.662
  589    HB3  PRO   4           HB1      PRO   4  42.204  -3.916  18.444
  590    HG2  PRO   4           HG2      PRO   4  40.979  -1.350  19.329
  591    HG3  PRO   4           HG1      PRO   4  40.333  -2.999  19.408
  592    HD2  PRO   4           HD2      PRO   4  41.456  -1.711  21.562
  593    HD3  PRO   4           HD1      PRO   4  41.431  -3.478  21.376
  594    H    PHE   5           HN       PHE   5  42.778  -0.234  20.035
  595    HA   PHE   5           HA       PHE   5  44.981   1.255  18.820
  596    HB2  PHE   5           HB2      PHE   5  42.217   1.195  17.769
  597    HB3  PHE   5           HB1      PHE   5  42.917   2.801  17.967
  598    HD1  PHE   5           HD1      PHE   5  42.990  -0.303  16.069
  599    HD2  PHE   5           HD2      PHE   5  45.090   3.362  16.849
  600    HE1  PHE   5           HE1      PHE   5  44.322  -0.625  14.001
  601    HE2  PHE   5           HE2      PHE   5  46.421   3.040  14.783
  602    HZ   PHE   5           HZ       PHE   5  46.037   1.048  13.359
  603    H    GLN   6           HN       GLN   6  41.774   2.455  19.729
  604    HA   GLN   6           HA       GLN   6  42.754   3.362  22.319
  605    HB2  GLN   6           HB2      GLN   6  41.880   5.259  20.132
  606    HB3  GLN   6           HB1      GLN   6  42.008   5.710  21.832
  607    HG2  GLN   6           HG2      GLN   6  44.397   4.999  21.804
  608    HG3  GLN   6           HG1      GLN   6  44.249   4.670  20.078
  609   HE21  GLN   6          HE21      GLN   6  45.199   7.047  22.253
  610   HE22  GLN   6          HE22      GLN   6  45.038   8.403  21.243
  611    H    ILE   7           HN       ILE   7  41.019   4.299  23.626
  612    HA   ILE   7           HA       ILE   7  38.668   2.728  23.526
  613    HB   ILE   7           HB       ILE   7  38.999   5.340  25.011
  614   HG12  ILE   7          HG12      ILE   7  40.962   4.030  25.529
  615   HG13  ILE   7          HG11      ILE   7  39.848   3.864  26.882
  616   HG21  ILE   7          HG21      ILE   7  36.745   4.355  25.024
  617   HG22  ILE   7          HG22      ILE   7  37.483   4.240  26.622
  618   HG23  ILE   7          HG23      ILE   7  37.412   2.819  25.580
  619   HD11  ILE   7          HD11      ILE   7  40.416   1.865  24.689
  620   HD12  ILE   7          HD12      ILE   7  39.002   1.735  25.735
  621   HD13  ILE   7          HD13      ILE   7  40.621   1.659  26.428
  622    H    LEU   8           HN       LEU   8  39.324   6.087  22.625
  623    HA   LEU   8           HA       LEU   8  36.631   6.734  21.910
  624    HB2  LEU   8           HB2      LEU   8  39.289   8.007  21.666
  625    HB3  LEU   8           HB1      LEU   8  38.112   8.474  20.441
  626    HG   LEU   8           HG       LEU   8  38.110   9.916  22.518
  627   HD11  LEU   8          HD11      LEU   8  35.486   8.458  22.154
  628   HD12  LEU   8          HD12      LEU   8  36.133   9.540  20.921
  629   HD13  LEU   8          HD13      LEU   8  35.746  10.161  22.525
  630   HD21  LEU   8          HD21      LEU   8  38.460   7.874  24.037
  631   HD22  LEU   8          HD22      LEU   8  36.737   7.556  23.823
  632   HD23  LEU   8          HD23      LEU   8  37.270   9.060  24.574
  633    H    SER   9           HN       SER   9  39.388   5.419  20.183
  634    HA   SER   9           HA       SER   9  38.268   5.665  17.560
  635    HB2  SER   9           HB2      SER   9  40.052   4.125  16.879
  636    HB3  SER   9           HB1      SER   9  40.688   5.393  17.922
  637    HG   SER   9           HG       SER   9  40.135   2.688  18.514
  638    H    ILE  10           HN       ILE  10  38.378   3.073  19.970
  639    HA   ILE  10           HA       ILE  10  37.089   1.116  18.386
  640    HB   ILE  10           HB       ILE  10  37.549   1.465  21.330
  641   HG12  ILE  10          HG12      ILE  10  39.266   0.604  19.608
  642   HG13  ILE  10          HG11      ILE  10  39.005  -0.391  21.038
  643   HG21  ILE  10          HG21      ILE  10  36.506  -0.891  21.502
  644   HG22  ILE  10          HG22      ILE  10  35.723  -0.522  19.965
  645   HG23  ILE  10          HG23      ILE  10  35.397   0.474  21.383
  646   HD11  ILE  10          HD11      ILE  10  37.921  -2.055  19.856
  647   HD12  ILE  10          HD12      ILE  10  38.971  -1.445  18.578
  648   HD13  ILE  10          HD13      ILE  10  37.285  -0.943  18.643
  649    H    CYS  11           HN       CYS  11  35.861   3.536  20.672
  650    HA   CYS  11           HA       CYS  11  33.178   2.692  20.693
  651    HB2  CYS  11           HB2      CYS  11  34.402   5.439  21.024
  652    HB3  CYS  11           HB1      CYS  11  32.688   5.105  21.268
  653    HG   CYS  11           HG       CYS  11  33.197   3.999  23.435
  654    H    SER  12           HN       SER  12  34.798   5.135  18.642
  655    HA   SER  12           HA       SER  12  32.576   5.767  17.060
  656    HB2  SER  12           HB2      SER  12  34.637   7.096  17.046
  657    HB3  SER  12           HB1      SER  12  35.506   5.759  16.296
  658    HG   SER  12           HG       SER  12  33.177   6.938  15.182
  659    H    PHE  13           HN       PHE  13  35.010   3.215  16.699
  660    HA   PHE  13           HA       PHE  13  34.271   2.313  14.142
  661    HB2  PHE  13           HB2      PHE  13  36.343   1.620  15.263
  662    HB3  PHE  13           HB1      PHE  13  35.405   0.739  16.466
  663    HD1  PHE  13           HD1      PHE  13  35.913   0.982  12.762
  664    HD2  PHE  13           HD2      PHE  13  34.858  -1.512  16.098
  665    HE1  PHE  13           HE1      PHE  13  35.859  -0.995  11.267
  666    HE2  PHE  13           HE2      PHE  13  34.802  -3.489  14.601
  667    HZ   PHE  13           HZ       PHE  13  35.303  -3.230  12.185
  668    H    ILE  14           HN       ILE  14  33.242   1.100  17.354
  669    HA   ILE  14           HA       ILE  14  31.404  -0.785  16.293
  670    HB   ILE  14           HB       ILE  14  32.300  -0.968  18.576
  671   HG12  ILE  14          HG12      ILE  14  29.303  -0.576  18.694
  672   HG13  ILE  14          HG11      ILE  14  30.050  -1.937  17.859
  673   HG21  ILE  14          HG21      ILE  14  30.640   1.519  19.057
  674   HG22  ILE  14          HG22      ILE  14  32.380   1.335  19.268
  675   HG23  ILE  14          HG23      ILE  14  31.269   0.496  20.346
  676   HD11  ILE  14          HD11      ILE  14  30.363  -1.235  20.792
  677   HD12  ILE  14          HD12      ILE  14  31.240  -2.530  19.975
  678   HD13  ILE  14          HD13      ILE  14  29.485  -2.616  20.131
  679    H    LEU  15           HN       LEU  15  31.175   2.607  17.092
  680    HA   LEU  15           HA       LEU  15  28.361   2.852  17.113
  681    HB2  LEU  15           HB2      LEU  15  30.627   4.752  16.562
  682    HB3  LEU  15           HB1      LEU  15  28.953   5.268  16.351
  683    HG   LEU  15           HG       LEU  15  29.825   3.899  18.890
  684   HD11  LEU  15          HD11      LEU  15  31.361   5.726  18.774
  685   HD12  LEU  15          HD12      LEU  15  30.043   6.279  19.809
  686   HD13  LEU  15          HD13      LEU  15  30.130   6.813  18.130
  687   HD21  LEU  15          HD21      LEU  15  27.908   5.128  19.804
  688   HD22  LEU  15          HD22      LEU  15  27.403   4.210  18.385
  689   HD23  LEU  15          HD23      LEU  15  27.674   5.947  18.260
  690    H    SER  16           HN       SER  16  30.604   3.791  14.489
  691    HA   SER  16           HA       SER  16  28.734   4.155  12.502
  692    HB2  SER  16           HB2      SER  16  30.549   3.749  10.906
  693    HB3  SER  16           HB1      SER  16  31.115   4.716  12.265
  694    HG   SER  16           HG       SER  16  32.588   3.088  11.932
  695    H    ALA  17           HN       ALA  17  30.189   1.109  13.594
  696    HA   ALA  17           HA       ALA  17  29.225  -0.526  11.501
  697    HB1  ALA  17           HB1      ALA  17  29.823  -1.149  14.402
  698    HB2  ALA  17           HB2      ALA  17  30.888  -1.389  13.016
  699    HB3  ALA  17           HB3      ALA  17  29.437  -2.377  13.194
  700    H    LEU  18           HN       LEU  18  27.842   0.284  14.660
  701    HA   LEU  18           HA       LEU  18  25.452  -1.211  14.367
  702    HB2  LEU  18           HB2      LEU  18  26.105   1.198  16.076
  703    HB3  LEU  18           HB1      LEU  18  24.600   0.286  16.202
  704    HG   LEU  18           HG       LEU  18  27.344  -0.969  16.465
  705   HD11  LEU  18          HD11      LEU  18  27.075  -0.889  18.844
  706   HD12  LEU  18          HD12      LEU  18  25.416  -0.308  18.703
  707   HD13  LEU  18          HD13      LEU  18  26.760   0.745  18.260
  708   HD21  LEU  18          HD21      LEU  18  24.507  -1.914  16.921
  709   HD22  LEU  18          HD22      LEU  18  25.899  -2.752  17.609
  710   HD23  LEU  18          HD23      LEU  18  25.728  -2.617  15.862
  711    H    HIS  19           HN       HIS  19  26.341   2.056  13.506
  712    HA   HIS  19           HA       HIS  19  23.746   3.002  12.851
  713    HB2  HIS  19           HB2      HIS  19  25.049   4.833  12.941
  714    HB3  HIS  19           HB1      HIS  19  26.513   3.911  12.608
  715    HD2  HIS  19           HD2      HIS  19  27.115   3.614   9.808
  716    HE1  HIS  19           HE1      HIS  19  24.308   6.494   8.524
  717    HE2  HIS  19           HE2      HIS  19  26.286   5.070   7.806
  718    H    PHE  20           HN       PHE  20  26.234   1.350  11.010
  719    HA   PHE  20           HA       PHE  20  24.905   1.622   8.470
  720    HB2  PHE  20           HB2      PHE  20  27.430   0.698   9.417
  721    HB3  PHE  20           HB1      PHE  20  26.696  -0.594   8.468
  722    HD1  PHE  20           HD1      PHE  20  27.930   2.882   8.410
  723    HD2  PHE  20           HD2      PHE  20  26.204  -0.303   6.103
  724    HE1  PHE  20           HE1      PHE  20  28.487   4.094   6.321
  725    HE2  PHE  20           HE2      PHE  20  26.762   0.910   4.013
  726    HZ   PHE  20           HZ       PHE  20  27.905   3.105   4.122
  727    H    MET  21           HN       MET  21  25.048  -0.806  11.021
  728    HA   MET  21           HA       MET  21  23.695  -2.851   9.552
  729    HB2  MET  21           HB2      MET  21  24.291  -2.414  12.476
  730    HB3  MET  21           HB1      MET  21  23.408  -3.828  11.890
  731    HG2  MET  21           HG2      MET  21  25.286  -4.362  10.371
  732    HG3  MET  21           HG1      MET  21  26.171  -2.968  10.982
  733    HE1  MET  21           HE1      MET  21  27.758  -6.384  12.193
  734    HE2  MET  21           HE2      MET  21  28.296  -4.778  11.707
  735    HE3  MET  21           HE3      MET  21  27.167  -5.666  10.687
  736    H    ALA  22           HN       ALA  22  22.665  -0.692  12.161
  737    HA   ALA  22           HA       ALA  22  19.973  -1.516  12.226
  738    HB1  ALA  22           HB1      ALA  22  19.648   0.877  13.211
  739    HB2  ALA  22           HB2      ALA  22  21.409   0.942  13.151
  740    HB3  ALA  22           HB3      ALA  22  20.604  -0.308  14.099
  741    H    TRP  23           HN       TRP  23  21.549   1.111  10.410
  742    HA   TRP  23           HA       TRP  23  19.056   1.973   9.268
  743    HB2  TRP  23           HB2      TRP  23  21.927   2.629   8.644
  744    HB3  TRP  23           HB1      TRP  23  20.597   3.233   7.657
  745    HD1  TRP  23           HD1      TRP  23  22.638   4.436  10.279
  746    HE1  TRP  23           HE1      TRP  23  21.447   6.159  11.781
  747    HE3  TRP  23           HE3      TRP  23  17.777   3.537   8.979
  748    HZ2  TRP  23           HZ2      TRP  23  18.784   7.034  12.363
  749    HZ3  TRP  23           HZ3      TRP  23  15.937   4.819  10.030
  750    HH2  TRP  23           HH2      TRP  23  16.433   6.568  11.716
  751    H    THR  24           HN       THR  24  21.470  -0.403   8.438
  752    HA   THR  24           HA       THR  24  20.805  -0.712   5.695
  753    HB   THR  24           HB       THR  24  22.180  -2.385   7.755
  754    HG1  THR  24           HG1      THR  24  23.763  -2.298   6.056
  755   HG21  THR  24          HG21      THR  24  21.067  -3.369   5.125
  756   HG22  THR  24          HG22      THR  24  20.915  -4.105   6.720
  757   HG23  THR  24          HG23      THR  24  22.469  -4.122   5.887
  758    H    ILE  25           HN       ILE  25  19.823  -2.643   8.537
  759    HA   ILE  25           HA       ILE  25  17.909  -4.191   7.132
  760    HB   ILE  25           HB       ILE  25  18.225  -3.593  10.077
  761   HG12  ILE  25          HG12      ILE  25  18.802  -6.119   8.502
  762   HG13  ILE  25          HG11      ILE  25  20.024  -4.885   8.814
  763   HG21  ILE  25          HG21      ILE  25  15.918  -4.205   9.717
  764   HG22  ILE  25          HG22      ILE  25  16.748  -5.635  10.329
  765   HG23  ILE  25          HG23      ILE  25  16.379  -5.498   8.610
  766   HD11  ILE  25          HD11      ILE  25  18.416  -6.157  11.037
  767   HD12  ILE  25          HD12      ILE  25  19.900  -5.216  11.172
  768   HD13  ILE  25          HD13      ILE  25  19.944  -6.834  10.472
  769    H    GLY  26           HN       GLY  26  17.611  -1.262   9.106
  770    HA2  GLY  26           HA2      GLY  26  14.801  -1.058   9.080
  771    HA3  GLY  26           HA1      GLY  26  15.916   0.286   9.310
  772    H    HIS  27           HN       HIS  27  17.261  -0.002   6.808
  773    HA   HIS  27           HA       HIS  27  15.504   1.517   5.132
  774    HB2  HIS  27           HB2      HIS  27  17.825   2.065   5.060
  775    HB3  HIS  27           HB1      HIS  27  18.275   0.393   4.718
  776    HD2  HIS  27           HD2      HIS  27  18.307  -0.244   2.023
  777    HE1  HIS  27           HE1      HIS  27  16.314   3.195   0.597
  778    HE2  HIS  27           HE2      HIS  27  17.519   1.068  -0.093
  779    H    LEU  28           HN       LEU  28  16.677  -1.802   5.177
  780    HA   LEU  28           HA       LEU  28  15.821  -2.580   2.608
  781    HB2  LEU  28           HB2      LEU  28  17.353  -3.853   4.192
  782    HB3  LEU  28           HB1      LEU  28  15.896  -4.370   5.040
  783    HG   LEU  28           HG       LEU  28  15.034  -5.185   2.777
  784   HD11  LEU  28          HD11      LEU  28  16.957  -5.733   1.177
  785   HD12  LEU  28          HD12      LEU  28  17.923  -4.582   2.101
  786   HD13  LEU  28          HD13      LEU  28  16.475  -4.038   1.254
  787   HD21  LEU  28          HD21      LEU  28  15.768  -6.814   4.371
  788   HD22  LEU  28          HD22      LEU  28  17.463  -6.397   4.121
  789   HD23  LEU  28          HD23      LEU  28  16.565  -7.233   2.855
  790    H    ASN  29           HN       ASN  29  13.883  -3.121   1.797
  791    HA   ASN  29           HA       ASN  29  11.621  -3.471   3.669
  792    HB2  ASN  29           HB2      ASN  29  10.192  -2.270   2.028
  793    HB3  ASN  29           HB1      ASN  29  11.445  -1.239   2.716
  794   HD21  ASN  29          HD21      ASN  29   9.983  -1.796  -0.162
  795   HD22  ASN  29          HD22      ASN  29  11.275  -1.497  -1.221
  796    H    GLN  30           HN       GLN  30  10.267  -5.128   3.208
  797    HA   GLN  30           HA       GLN  30  10.523  -6.469   0.600
  798    HB2  GLN  30           HB2      GLN  30  10.720  -8.646   1.640
  799    HB3  GLN  30           HB1      GLN  30  12.008  -7.614   2.264
  800    HG2  GLN  30           HG2      GLN  30  10.545  -7.086   4.235
  801    HG3  GLN  30           HG1      GLN  30   9.389  -8.275   3.638
  802   HE21  GLN  30          HE21      GLN  30  11.753  -7.997   5.895
  803   HE22  GLN  30          HE22      GLN  30  12.335  -9.592   5.916
  804    H    ILE  31           HN       ILE  31   8.658  -7.400  -0.130
  805    HA   ILE  31           HA       ILE  31   6.342  -7.483   1.669
  806    HB   ILE  31           HB       ILE  31   4.946  -6.340  -0.014
  807   HG12  ILE  31          HG12      ILE  31   7.573  -5.728  -1.403
  808   HG13  ILE  31          HG11      ILE  31   6.429  -6.949  -1.961
  809   HG21  ILE  31          HG21      ILE  31   7.396  -4.734   0.774
  810   HG22  ILE  31          HG22      ILE  31   6.030  -5.071   1.837
  811   HG23  ILE  31          HG23      ILE  31   5.801  -4.086   0.392
  812   HD11  ILE  31          HD11      ILE  31   5.891  -3.981  -1.657
  813   HD12  ILE  31          HD12      ILE  31   4.669  -5.179  -2.085
  814   HD13  ILE  31          HD13      ILE  31   6.023  -4.875  -3.173
  815    H    LYS  32           HN       LYS  32   4.707  -8.933   1.014
  816    HA   LYS  32           HA       LYS  32   5.679 -11.152  -0.554
  817    HB2  LYS  32           HB2      LYS  32   3.676 -12.281   0.132
  818    HB3  LYS  32           HB1      LYS  32   4.261 -11.369   1.524
  819    HG2  LYS  32           HG2      LYS  32   2.697  -9.505   0.856
  820    HG3  LYS  32           HG1      LYS  32   2.018 -10.592  -0.356
  821    HD2  LYS  32           HD2      LYS  32   1.451 -12.216   1.424
  822    HD3  LYS  32           HD1      LYS  32   2.103 -11.108   2.632
  823    HE2  LYS  32           HE2      LYS  32  -0.285 -10.779   2.577
  824    HE3  LYS  32           HE1      LYS  32   0.457  -9.377   1.806
  825    HZ1  LYS  32           HZ1      LYS  32  -1.502 -10.580   0.654
  826    HZ2  LYS  32           HZ2      LYS  32  -0.318 -11.700   0.176
  827    HZ3  LYS  32           HZ3      LYS  32  -0.179 -10.068  -0.276
  828    H    ARG  33           HN       ARG  33   4.881 -11.899  -2.512
  829    HA   ARG  33           HA       ARG  33   3.614  -9.855  -4.175
  830    HB2  ARG  33           HB2      ARG  33   5.349 -12.188  -4.625
  831    HB3  ARG  33           HB1      ARG  33   4.073 -11.988  -5.827
  832    HG2  ARG  33           HG2      ARG  33   6.052 -10.740  -6.532
  833    HG3  ARG  33           HG1      ARG  33   4.763  -9.610  -6.116
  834    HD2  ARG  33           HD2      ARG  33   5.750  -9.160  -3.966
  835    HD3  ARG  33           HD1      ARG  33   6.923 -10.457  -4.171
  836    HE   ARG  33           HE       ARG  33   7.068  -7.798  -5.306
  837   HH11  ARG  33          HH11      ARG  33   8.079 -11.124  -5.585
  838   HH12  ARG  33          HH12      ARG  33   9.515 -10.737  -6.468
  839   HH21  ARG  33          HH21      ARG  33   8.960  -7.323  -6.452
  840   HH22  ARG  33          HH22      ARG  33  10.011  -8.603  -6.958
  841    H1   MET   1           HT1      MET   1  53.527  -1.173   2.623
  842    H2   MET   1           HT2      MET   1  53.329  -1.034   4.304
  843    H3   MET   1           HT3      MET   1  54.411  -2.177   3.665
  844    HA   MET   1           HA       MET   1  55.110   0.263   4.555
  845    HB2  MET   1           HB2      MET   1  56.356  -1.959   3.599
  846    HB3  MET   1           HB1      MET   1  56.731  -0.808   2.316
  847    HG2  MET   1           HG2      MET   1  58.494  -0.586   3.911
  848    HG3  MET   1           HG1      MET   1  57.443   0.807   4.169
  849    HE1  MET   1           HE1      MET   1  58.540   0.196   7.730
  850    HE2  MET   1           HE2      MET   1  57.708   1.425   6.780
  851    HE3  MET   1           HE3      MET   1  59.163   0.663   6.141
  852    H    PHE   2           HN       PHE   2  52.886   0.715   2.804
  853    HA   PHE   2           HA       PHE   2  53.929   2.959   1.311
  854    HB2  PHE   2           HB2      PHE   2  52.694   2.094  -0.807
  855    HB3  PHE   2           HB1      PHE   2  54.302   1.460  -0.452
  856    HD1  PHE   2           HD1      PHE   2  50.663   0.755  -0.157
  857    HD2  PHE   2           HD2      PHE   2  54.644  -0.840   0.084
  858    HE1  PHE   2           HE1      PHE   2  49.736  -1.541  -0.033
  859    HE2  PHE   2           HE2      PHE   2  53.716  -3.136   0.208
  860    HZ   PHE   2           HZ       PHE   2  51.262  -3.487   0.150
  861    H    GLU   3           HN       GLU   3  52.001   2.312   3.498
  862    HA   GLU   3           HA       GLU   3  49.369   2.756   2.458
  863    HB2  GLU   3           HB2      GLU   3  50.464   2.959   5.273
  864    HB3  GLU   3           HB1      GLU   3  48.756   3.082   4.856
  865    HG2  GLU   3           HG2      GLU   3  48.941   0.815   5.370
  866    HG3  GLU   3           HG1      GLU   3  49.168   0.803   3.623
  867    HA   PRO   4           HA       PRO   4  49.574   7.186   2.178
  868    HB2  PRO   4           HB2      PRO   4  46.946   7.847   2.389
  869    HB3  PRO   4           HB1      PRO   4  47.624   7.053   0.954
  870    HG2  PRO   4           HG2      PRO   4  46.079   5.879   3.211
  871    HG3  PRO   4           HG1      PRO   4  45.987   5.531   1.476
  872    HD2  PRO   4           HD2      PRO   4  47.334   3.939   3.267
  873    HD3  PRO   4           HD1      PRO   4  47.755   4.052   1.543
  874    H    PHE   5           HN       PHE   5  47.610   5.881   4.830
  875    HA   PHE   5           HA       PHE   5  48.786   7.828   6.668
  876    HB2  PHE   5           HB2      PHE   5  45.967   7.854   5.770
  877    HB3  PHE   5           HB1      PHE   5  46.208   7.964   7.513
  878    HD1  PHE   5           HD1      PHE   5  46.541   9.667   4.314
  879    HD2  PHE   5           HD2      PHE   5  47.647   9.784   8.463
  880    HE1  PHE   5           HE1      PHE   5  47.164  12.056   4.080
  881    HE2  PHE   5           HE2      PHE   5  48.271  12.173   8.229
  882    HZ   PHE   5           HZ       PHE   5  48.028  13.309   6.038
  883    H    GLN   6           HN       GLN   6  45.844   5.908   7.113
  884    HA   GLN   6           HA       GLN   6  47.307   3.844   8.561
  885    HB2  GLN   6           HB2      GLN   6  45.271   5.653   9.877
  886    HB3  GLN   6           HB1      GLN   6  45.810   4.118  10.559
  887    HG2  GLN   6           HG2      GLN   6  48.158   4.948  10.486
  888    HG3  GLN   6           HG1      GLN   6  47.560   6.505   9.912
  889   HE21  GLN   6          HE21      GLN   6  48.444   4.872  12.712
  890   HE22  GLN   6          HE22      GLN   6  47.587   5.807  13.840
  891    H    ILE   7           HN       ILE   7  45.897   2.049   9.180
  892    HA   ILE   7           HA       ILE   7  44.188   1.279   7.060
  893    HB   ILE   7           HB       ILE   7  44.226   0.083   9.838
  894   HG12  ILE   7          HG12      ILE   7  46.537   0.238   9.149
  895   HG13  ILE   7          HG11      ILE   7  46.018  -1.424   8.880
  896   HG21  ILE   7          HG21      ILE   7  42.475  -0.740   8.318
  897   HG22  ILE   7          HG22      ILE   7  43.691  -1.987   8.601
  898   HG23  ILE   7          HG23      ILE   7  43.693  -1.080   7.088
  899   HD11  ILE   7          HD11      ILE   7  46.389   0.763   6.828
  900   HD12  ILE   7          HD12      ILE   7  45.485  -0.710   6.476
  901   HD13  ILE   7          HD13      ILE   7  47.192  -0.804   6.906
  902    H    LEU   8           HN       LEU   8  43.538   2.462  10.329
  903    HA   LEU   8           HA       LEU   8  40.691   2.218  10.173
  904    HB2  LEU   8           HB2      LEU   8  42.648   3.406  12.043
  905    HB3  LEU   8           HB1      LEU   8  41.057   4.163  12.034
  906    HG   LEU   8           HG       LEU   8  41.316   2.261  13.678
  907   HD11  LEU   8          HD11      LEU   8  39.247   1.649  11.560
  908   HD12  LEU   8          HD12      LEU   8  39.122   3.063  12.608
  909   HD13  LEU   8          HD13      LEU   8  39.116   1.443  13.307
  910   HD21  LEU   8          HD21      LEU   8  42.705   0.892  12.005
  911   HD22  LEU   8          HD22      LEU   8  41.172   0.486  11.233
  912   HD23  LEU   8          HD23      LEU   8  41.469   0.016  12.907
  913    H    SER   9           HN       SER   9  42.993   4.744   9.396
  914    HA   SER   9           HA       SER   9  41.065   6.828   9.014
  915    HB2  SER   9           HB2      SER   9  42.892   8.035   7.909
  916    HB3  SER   9           HB1      SER   9  43.443   7.318   9.421
  917    HG   SER   9           HG       SER   9  43.904   6.482   6.762
  918    H    ILE  10           HN       ILE  10  42.679   4.520   6.865
  919    HA   ILE  10           HA       ILE  10  41.562   5.498   4.458
  920    HB   ILE  10           HB       ILE  10  42.828   2.908   5.285
  921   HG12  ILE  10          HG12      ILE  10  44.067   5.089   4.682
  922   HG13  ILE  10          HG11      ILE  10  44.576   3.626   3.843
  923   HG21  ILE  10          HG21      ILE  10  42.613   2.310   2.783
  924   HG22  ILE  10          HG22      ILE  10  41.304   3.493   2.739
  925   HG23  ILE  10          HG23      ILE  10  41.184   2.082   3.791
  926   HD11  ILE  10          HD11      ILE  10  43.689   4.307   1.821
  927   HD12  ILE  10          HD12      ILE  10  44.050   5.887   2.512
  928   HD13  ILE  10          HD13      ILE  10  42.407   5.259   2.568
  929    H    CYS  11           HN       CYS  11  40.505   3.008   6.752
  930    HA   CYS  11           HA       CYS  11  38.329   2.032   5.260
  931    HB2  CYS  11           HB2      CYS  11  38.762   2.233   8.247
  932    HB3  CYS  11           HB1      CYS  11  37.387   1.401   7.521
  933    HG   CYS  11           HG       CYS  11  38.862  -0.490   6.865
  934    H    SER  12           HN       SER  12  38.434   4.598   7.753
  935    HA   SER  12           HA       SER  12  35.737   5.329   7.589
  936    HB2  SER  12           HB2      SER  12  37.212   6.098   9.390
  937    HB3  SER  12           HB1      SER  12  38.136   7.058   8.238
  938    HG   SER  12           HG       SER  12  35.339   7.338   8.626
  939    H    PHE  13           HN       PHE  13  38.541   6.425   5.722
  940    HA   PHE  13           HA       PHE  13  37.307   8.542   4.343
  941    HB2  PHE  13           HB2      PHE  13  39.735   8.185   4.352
  942    HB3  PHE  13           HB1      PHE  13  39.528   6.702   3.421
  943    HD1  PHE  13           HD1      PHE  13  38.718  10.360   3.311
  944    HD2  PHE  13           HD2      PHE  13  39.556   6.787   1.077
  945    HE1  PHE  13           HE1      PHE  13  38.748  11.679   1.211
  946    HE2  PHE  13           HE2      PHE  13  39.583   8.108  -1.022
  947    HZ   PHE  13           HZ       PHE  13  39.179  10.553  -0.955
  948    H    ILE  14           HN       ILE  14  37.759   5.134   3.328
  949    HA   ILE  14           HA       ILE  14  36.290   5.435   0.916
  950    HB   ILE  14           HB       ILE  14  37.892   3.597   1.259
  951   HG12  ILE  14          HG12      ILE  14  35.113   2.461   0.882
  952   HG13  ILE  14          HG11      ILE  14  35.904   3.460  -0.339
  953   HG21  ILE  14          HG21      ILE  14  35.842   2.653   3.278
  954   HG22  ILE  14          HG22      ILE  14  37.533   3.050   3.575
  955   HG23  ILE  14          HG23      ILE  14  37.116   1.627   2.623
  956   HD11  ILE  14          HD11      ILE  14  36.935   0.840   0.789
  957   HD12  ILE  14          HD12      ILE  14  37.832   1.868  -0.330
  958   HD13  ILE  14          HD13      ILE  14  36.324   1.111  -0.843
  959    H    LEU  15           HN       LEU  15  35.382   4.722   4.214
  960    HA   LEU  15           HA       LEU  15  32.777   3.723   3.716
  961    HB2  LEU  15           HB2      LEU  15  34.098   5.083   6.052
  962    HB3  LEU  15           HB1      LEU  15  32.373   4.715   6.090
  963    HG   LEU  15           HG       LEU  15  34.375   2.598   5.326
  964   HD11  LEU  15          HD11      LEU  15  35.204   3.302   7.455
  965   HD12  LEU  15          HD12      LEU  15  34.197   1.891   7.781
  966   HD13  LEU  15          HD13      LEU  15  33.576   3.512   8.100
  967   HD21  LEU  15          HD21      LEU  15  32.594   1.116   6.129
  968   HD22  LEU  15          HD22      LEU  15  31.939   2.243   4.940
  969   HD23  LEU  15          HD23      LEU  15  31.649   2.509   6.659
  970    H    SER  16           HN       SER  16  33.705   6.995   4.842
  971    HA   SER  16           HA       SER  16  31.261   8.215   4.474
  972    HB2  SER  16           HB2      SER  16  32.492  10.332   4.349
  973    HB3  SER  16           HB1      SER  16  33.168   9.284   5.593
  974    HG   SER  16           HG       SER  16  34.854  10.057   4.373
  975    H    ALA  17           HN       ALA  17  33.787   7.601   2.067
  976    HA   ALA  17           HA       ALA  17  32.704   9.178  -0.012
  977    HB1  ALA  17           HB1      ALA  17  34.359   6.647  -0.085
  978    HB2  ALA  17           HB2      ALA  17  34.939   8.306  -0.218
  979    HB3  ALA  17           HB3      ALA  17  33.971   7.604  -1.513
  980    H    LEU  18           HN       LEU  18  32.247   5.765   0.816
  981    HA   LEU  18           HA       LEU  18  30.419   5.163  -1.266
  982    HB2  LEU  18           HB2      LEU  18  30.877   3.866   1.428
  983    HB3  LEU  18           HB1      LEU  18  29.818   3.197   0.184
  984    HG   LEU  18           HG       LEU  18  32.738   3.860  -0.280
  985   HD11  LEU  18          HD11      LEU  18  33.241   1.538   0.030
  986   HD12  LEU  18          HD12      LEU  18  31.533   1.115   0.143
  987   HD13  LEU  18          HD13      LEU  18  32.303   2.030   1.440
  988   HD21  LEU  18          HD21      LEU  18  30.594   2.420  -1.857
  989   HD22  LEU  18          HD22      LEU  18  32.311   2.229  -2.213
  990   HD23  LEU  18          HD23      LEU  18  31.554   3.813  -2.351
  991    H    HIS  19           HN       HIS  19  30.016   6.388   1.977
  992    HA   HIS  19           HA       HIS  19  27.193   6.133   2.140
  993    HB2  HIS  19           HB2      HIS  19  27.878   6.557   4.239
  994    HB3  HIS  19           HB1      HIS  19  29.353   7.347   3.690
  995    HD2  HIS  19           HD2      HIS  19  29.073  10.171   3.202
  996    HE1  HIS  19           HE1      HIS  19  25.307  10.494   5.080
  997    HE2  HIS  19           HE2      HIS  19  27.263  11.807   4.130
  998    H    PHE  20           HN       PHE  20  29.312   8.661   0.955
  999    HA   PHE  20           HA       PHE  20  27.215  10.595   0.556
 1000    HB2  PHE  20           HB2      PHE  20  30.063  10.554   0.440
 1001    HB3  PHE  20           HB1      PHE  20  29.461  11.149  -1.107
 1002    HD1  PHE  20           HD1      PHE  20  29.565  11.742   2.532
 1003    HD2  PHE  20           HD2      PHE  20  28.167  13.204  -1.255
 1004    HE1  PHE  20           HE1      PHE  20  29.040  13.930   3.573
 1005    HE2  PHE  20           HE2      PHE  20  27.644  15.395  -0.216
 1006    HZ   PHE  20           HZ       PHE  20  28.079  15.760   2.201
 1007    H    MET  21           HN       MET  21  28.857   8.174  -1.408
 1008    HA   MET  21           HA       MET  21  27.743   9.016  -3.902
 1009    HB2  MET  21           HB2      MET  21  29.101   6.494  -2.958
 1010    HB3  MET  21           HB1      MET  21  28.517   6.694  -4.613
 1011    HG2  MET  21           HG2      MET  21  29.874   8.749  -4.838
 1012    HG3  MET  21           HG1      MET  21  30.473   8.529  -3.197
 1013    HE1  MET  21           HE1      MET  21  33.270   7.832  -5.908
 1014    HE2  MET  21           HE2      MET  21  33.140   8.527  -4.294
 1015    HE3  MET  21           HE3      MET  21  32.045   9.062  -5.565
 1016    H    ALA  22           HN       ALA  22  27.045   6.282  -1.764
 1017    HA   ALA  22           HA       ALA  22  24.870   5.263  -3.234
 1018    HB1  ALA  22           HB1      ALA  22  24.216   4.304  -0.898
 1019    HB2  ALA  22           HB2      ALA  22  25.768   4.973  -0.392
 1020    HB3  ALA  22           HB3      ALA  22  25.703   3.765  -1.676
 1021    H    TRP  23           HN       TRP  23  24.960   7.599  -0.548
 1022    HA   TRP  23           HA       TRP  23  22.096   7.835  -0.504
 1023    HB2  TRP  23           HB2      TRP  23  24.296   9.434   0.783
 1024    HB3  TRP  23           HB1      TRP  23  22.605   9.918   0.894
 1025    HD1  TRP  23           HD1      TRP  23  24.951   8.207   2.905
 1026    HE1  TRP  23           HE1      TRP  23  23.871   6.442   4.443
 1027    HE3  TRP  23           HE3      TRP  23  20.403   7.710   0.626
 1028    HZ2  TRP  23           HZ2      TRP  23  21.408   5.002   4.670
 1029    HZ3  TRP  23           HZ3      TRP  23  18.720   6.125   1.512
 1030    HH2  TRP  23           HH2      TRP  23  19.211   4.776   3.535
 1031    H    THR  24           HN       THR  24  24.678   9.367  -2.272
 1032    HA   THR  24           HA       THR  24  23.279  11.702  -3.085
 1033    HB   THR  24           HB       THR  24  25.664  10.195  -4.071
 1034    HG1  THR  24           HG1      THR  24  26.517  12.337  -3.799
 1035   HG21  THR  24          HG21      THR  24  24.089  12.244  -5.635
 1036   HG22  THR  24          HG22      THR  24  24.674  10.671  -6.177
 1037   HG23  THR  24          HG23      THR  24  25.813  11.987  -5.903
 1038    H    ILE  25           HN       ILE  25  23.859   8.631  -4.821
 1039    HA   ILE  25           HA       ILE  25  22.119   9.241  -6.977
 1040    HB   ILE  25           HB       ILE  25  23.187   6.607  -5.948
 1041   HG12  ILE  25          HG12      ILE  25  23.918   8.203  -8.420
 1042   HG13  ILE  25          HG11      ILE  25  24.769   8.373  -6.885
 1043   HG21  ILE  25          HG21      ILE  25  21.163   6.127  -7.171
 1044   HG22  ILE  25          HG22      ILE  25  22.517   5.794  -8.250
 1045   HG23  ILE  25          HG23      ILE  25  21.589   7.282  -8.433
 1046   HD11  ILE  25          HD11      ILE  25  24.400   5.690  -8.232
 1047   HD12  ILE  25          HD12      ILE  25  25.516   6.109  -6.932
 1048   HD13  ILE  25          HD13      ILE  25  25.788   6.727  -8.561
 1049    H    GLY  26           HN       GLY  26  21.656   7.380  -3.995
 1050    HA2  GLY  26           HA2      GLY  26  19.053   6.441  -4.523
 1051    HA3  GLY  26           HA1      GLY  26  19.753   6.652  -2.921
 1052    H    HIS  27           HN       HIS  27  20.241   9.456  -3.176
 1053    HA   HIS  27           HA       HIS  27  17.680  10.466  -2.379
 1054    HB2  HIS  27           HB2      HIS  27  19.594  11.355  -1.266
 1055    HB3  HIS  27           HB1      HIS  27  20.367  11.777  -2.797
 1056    HD2  HIS  27           HD2      HIS  27  19.706  14.295  -3.744
 1057    HE1  HIS  27           HE1      HIS  27  16.468  15.054  -1.142
 1058    HE2  HIS  27           HE2      HIS  27  17.938  16.049  -2.959
 1059    H    LEU  28           HN       LEU  28  19.694  10.718  -5.255
 1060    HA   LEU  28           HA       LEU  28  18.314  12.810  -6.545
 1061    HB2  LEU  28           HB2      LEU  28  20.572  11.815  -7.170
 1062    HB3  LEU  28           HB1      LEU  28  19.677  10.499  -7.930
 1063    HG   LEU  28           HG       LEU  28  18.400  12.296  -9.222
 1064   HD11  LEU  28          HD11      LEU  28  19.773  14.444  -9.457
 1065   HD12  LEU  28          HD12      LEU  28  20.616  13.948  -7.989
 1066   HD13  LEU  28          HD13      LEU  28  18.880  14.259  -7.948
 1067   HD21  LEU  28          HD21      LEU  28  20.041  11.003 -10.392
 1068   HD22  LEU  28          HD22      LEU  28  21.371  11.837  -9.588
 1069   HD23  LEU  28          HD23      LEU  28  20.390  12.687 -10.782
 1070    H    ASN  29           HN       ASN  29  16.458  12.883  -7.663
 1071    HA   ASN  29           HA       ASN  29  15.121  10.335  -8.339
 1072    HB2  ASN  29           HB2      ASN  29  12.958  11.417  -7.763
 1073    HB3  ASN  29           HB1      ASN  29  14.018  11.240  -6.366
 1074   HD21  ASN  29          HD21      ASN  29  11.928  13.413  -7.644
 1075   HD22  ASN  29          HD22      ASN  29  12.667  14.863  -7.161
 1076    H    GLN  30           HN       GLN  30  14.221  10.245 -10.332
 1077    HA   GLN  30           HA       GLN  30  13.990  12.734 -11.886
 1078    HB2  GLN  30           HB2      GLN  30  15.124  11.757 -13.787
 1079    HB3  GLN  30           HB1      GLN  30  16.194  11.651 -12.388
 1080    HG2  GLN  30           HG2      GLN  30  15.359   9.314 -12.006
 1081    HG3  GLN  30           HG1      GLN  30  14.462   9.436 -13.518
 1082   HE21  GLN  30          HE21      GLN  30  17.245   8.144 -12.357
 1083   HE22  GLN  30          HE22      GLN  30  18.231   8.275 -13.734
 1084    H    ILE  31           HN       ILE  31  12.335  12.744 -13.347
 1085    HA   ILE  31           HA       ILE  31  10.851  10.252 -13.790
 1086    HB   ILE  31           HB       ILE  31   8.722  11.384 -13.269
 1087   HG12  ILE  31          HG12      ILE  31  10.470  13.615 -12.186
 1088   HG13  ILE  31          HG11      ILE  31   9.603  13.705 -13.720
 1089   HG21  ILE  31          HG21      ILE  31  10.732  11.544 -11.002
 1090   HG22  ILE  31          HG22      ILE  31   9.936  10.064 -11.538
 1091   HG23  ILE  31          HG23      ILE  31   8.984  11.373 -10.837
 1092   HD11  ILE  31          HD11      ILE  31   8.372  13.329 -10.976
 1093   HD12  ILE  31          HD12      ILE  31   7.472  13.268 -12.491
 1094   HD13  ILE  31          HD13      ILE  31   8.256  14.766 -11.992
 1095    H    LYS  32           HN       LYS  32   9.575  10.253 -15.683
 1096    HA   LYS  32           HA       LYS  32  10.576  11.989 -17.760
 1097    HB2  LYS  32           HB2      LYS  32   9.311  10.616 -19.268
 1098    HB3  LYS  32           HB1      LYS  32  10.031   9.543 -18.067
 1099    HG2  LYS  32           HG2      LYS  32   7.873   9.686 -16.766
 1100    HG3  LYS  32           HG1      LYS  32   7.177  10.553 -18.136
 1101    HD2  LYS  32           HD2      LYS  32   7.702   8.637 -19.610
 1102    HD3  LYS  32           HD1      LYS  32   8.367   7.765 -18.228
 1103    HE2  LYS  32           HE2      LYS  32   6.100   7.001 -18.532
 1104    HE3  LYS  32           HE1      LYS  32   6.122   8.026 -17.096
 1105    HZ1  LYS  32           HZ1      LYS  32   4.323   8.389 -18.896
 1106    HZ2  LYS  32           HZ2      LYS  32   5.556   9.210 -19.728
 1107    HZ3  LYS  32           HZ3      LYS  32   5.072   9.735 -18.186
 1108    H    ARG  33           HN       ARG  33   9.435  13.522 -18.932
 1109    HA   ARG  33           HA       ARG  33   7.173  14.711 -17.508
 1110    HB2  ARG  33           HB2      ARG  33   9.256  15.658 -19.357
 1111    HB3  ARG  33           HB1      ARG  33   7.659  16.350 -19.645
 1112    HG2  ARG  33           HG2      ARG  33   8.863  17.736 -18.031
 1113    HG3  ARG  33           HG1      ARG  33   7.513  16.936 -17.226
 1114    HD2  ARG  33           HD2      ARG  33   8.970  15.276 -16.268
 1115    HD3  ARG  33           HD1      ARG  33  10.331  15.833 -17.238
 1116    HE   ARG  33           HE       ARG  33   9.340  17.033 -14.796
 1117   HH11  ARG  33          HH11      ARG  33  11.107  17.537 -17.760
 1118   HH12  ARG  33          HH12      ARG  33  12.007  18.874 -17.136
 1119   HH21  ARG  33          HH21      ARG  33  10.542  18.778 -14.004
 1120   HH22  ARG  33          HH22      ARG  33  11.692  19.574 -15.025
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  52.789  25.035  11.557
    2    H2   MET   1           HT2      MET   1  53.631  24.197  12.769
    3    H3   MET   1           HT3      MET   1  53.689  25.893  12.710
    4    HA   MET   1           HA       MET   1  51.319  24.220  13.337
    5    HB2  MET   1           HB2      MET   1  53.208  24.670  15.068
    6    HB3  MET   1           HB1      MET   1  52.599  26.325  15.072
    7    HG2  MET   1           HG2      MET   1  50.388  25.571  15.727
    8    HG3  MET   1           HG1      MET   1  50.873  23.884  15.565
    9    HE1  MET   1           HE1      MET   1  53.138  23.158  16.539
   10    HE2  MET   1           HE2      MET   1  51.912  22.491  17.613
   11    HE3  MET   1           HE3      MET   1  53.361  23.227  18.294
   12    H    PHE   2           HN       PHE   2  51.292  25.881  11.086
   13    HA   PHE   2           HA       PHE   2  50.069  28.404  11.922
   14    HB2  PHE   2           HB2      PHE   2  50.935  27.276   9.268
   15    HB3  PHE   2           HB1      PHE   2  49.930  28.721   9.373
   16    HD1  PHE   2           HD1      PHE   2  53.258  27.518   9.337
   17    HD2  PHE   2           HD2      PHE   2  50.774  30.551  11.092
   18    HE1  PHE   2           HE1      PHE   2  55.269  28.885   9.821
   19    HE2  PHE   2           HE2      PHE   2  52.786  31.919  11.576
   20    HZ   PHE   2           HZ       PHE   2  55.033  31.086  10.941
   21    H    GLU   3           HN       GLU   3  49.244  25.344  10.390
   22    HA   GLU   3           HA       GLU   3  46.572  26.133   9.762
   23    HB2  GLU   3           HB2      GLU   3  46.242  23.795   9.126
   24    HB3  GLU   3           HB1      GLU   3  47.771  24.382   8.487
   25    HG2  GLU   3           HG2      GLU   3  48.959  23.366  10.393
   26    HG3  GLU   3           HG1      GLU   3  47.430  22.774  11.037
   27    HA   PRO   4           HA       PRO   4  44.370  25.361  13.499
   28    HB2  PRO   4           HB2      PRO   4  42.668  23.408  12.018
   29    HB3  PRO   4           HB1      PRO   4  42.195  24.848  12.936
   30    HG2  PRO   4           HG2      PRO   4  42.161  24.834  10.278
   31    HG3  PRO   4           HG1      PRO   4  42.640  26.276  11.193
   32    HD2  PRO   4           HD2      PRO   4  44.346  24.347   9.689
   33    HD3  PRO   4           HD1      PRO   4  44.543  26.097   9.923
   34    H    PHE   5           HN       PHE   5  45.051  22.442  11.583
   35    HA   PHE   5           HA       PHE   5  46.318  21.124  13.786
   36    HB2  PHE   5           HB2      PHE   5  43.466  20.717  13.397
   37    HB3  PHE   5           HB1      PHE   5  44.367  19.208  13.247
   38    HD1  PHE   5           HD1      PHE   5  42.909  21.498  15.529
   39    HD2  PHE   5           HD2      PHE   5  46.229  18.812  15.073
   40    HE1  PHE   5           HE1      PHE   5  43.176  21.410  17.993
   41    HE2  PHE   5           HE2      PHE   5  46.497  18.724  17.537
   42    HZ   PHE   5           HZ       PHE   5  44.970  20.022  18.997
   43    H    GLN   6           HN       GLN   6  44.349  19.908  11.076
   44    HA   GLN   6           HA       GLN   6  46.747  19.250   9.558
   45    HB2  GLN   6           HB2      GLN   6  45.196  17.263  11.075
   46    HB3  GLN   6           HB1      GLN   6  45.452  16.846   9.380
   47    HG2  GLN   6           HG2      GLN   6  47.831  17.029   9.604
   48    HG3  GLN   6           HG1      GLN   6  47.690  17.768  11.197
   49   HE21  GLN   6          HE21      GLN   6  49.261  15.690  11.449
   50   HE22  GLN   6          HE22      GLN   6  48.468  14.286  11.981
   51    H    ILE   7           HN       ILE   7  46.233  18.475   7.386
   52    HA   ILE   7           HA       ILE   7  44.220  19.975   6.131
   53    HB   ILE   7           HB       ILE   7  45.770  17.564   5.194
   54   HG12  ILE   7          HG12      ILE   7  46.013  20.475   4.396
   55   HG13  ILE   7          HG11      ILE   7  46.947  19.772   5.717
   56   HG21  ILE   7          HG21      ILE   7  43.776  17.618   3.866
   57   HG22  ILE   7          HG22      ILE   7  45.029  18.399   2.902
   58   HG23  ILE   7          HG23      ILE   7  43.827  19.376   3.744
   59   HD11  ILE   7          HD11      ILE   7  48.060  18.253   4.259
   60   HD12  ILE   7          HD12      ILE   7  48.082  19.803   3.419
   61   HD13  ILE   7          HD13      ILE   7  46.923  18.561   2.945
   62    H    LEU   8           HN       LEU   8  44.249  16.734   7.396
   63    HA   LEU   8           HA       LEU   8  41.859  15.792   6.184
   64    HB2  LEU   8           HB2      LEU   8  43.539  14.968   8.492
   65    HB3  LEU   8           HB1      LEU   8  41.881  14.367   8.460
   66    HG   LEU   8           HG       LEU   8  43.590  12.888   7.294
   67   HD11  LEU   8          HD11      LEU   8  42.058  12.268   5.593
   68   HD12  LEU   8          HD12      LEU   8  41.483  13.920   5.384
   69   HD13  LEU   8          HD13      LEU   8  41.048  13.011   6.832
   70   HD21  LEU   8          HD21      LEU   8  43.453  14.961   5.092
   71   HD22  LEU   8          HD22      LEU   8  44.535  13.578   5.226
   72   HD23  LEU   8          HD23      LEU   8  44.753  14.971   6.283
   73    H    SER   9           HN       SER   9  42.262  16.645   9.621
   74    HA   SER   9           HA       SER   9  39.621  16.854  10.327
   75    HB2  SER   9           HB2      SER   9  40.342  18.393  12.100
   76    HB3  SER   9           HB1      SER   9  41.502  17.081  11.915
   77    HG   SER   9           HG       SER   9  42.386  19.275  12.029
   78    H    ILE  10           HN       ILE  10  41.569  19.157   8.518
   79    HA   ILE  10           HA       ILE  10  39.706  21.322   8.647
   80    HB   ILE  10           HB       ILE  10  41.995  20.693   6.790
   81   HG12  ILE  10          HG12      ILE  10  41.711  22.917   8.817
   82   HG13  ILE  10          HG11      ILE  10  42.330  21.330   9.266
   83   HG21  ILE  10          HG21      ILE  10  40.476  22.029   5.500
   84   HG22  ILE  10          HG22      ILE  10  41.718  23.123   6.107
   85   HG23  ILE  10          HG23      ILE  10  40.132  23.075   6.876
   86   HD11  ILE  10          HD11      ILE  10  43.532  23.380   7.422
   87   HD12  ILE  10          HD12      ILE  10  43.940  21.683   7.214
   88   HD13  ILE  10          HD13      ILE  10  44.296  22.485   8.733
   89    H    CYS  11           HN       CYS  11  40.391  18.834   6.205
   90    HA   CYS  11           HA       CYS  11  38.500  19.676   4.293
   91    HB2  CYS  11           HB2      CYS  11  39.655  16.947   4.909
   92    HB3  CYS  11           HB1      CYS  11  38.605  17.265   3.528
   93    HG   CYS  11           HG       CYS  11  40.837  17.789   2.489
   94    H    SER  12           HN       SER  12  38.239  17.256   6.914
   95    HA   SER  12           HA       SER  12  35.540  16.582   6.430
   96    HB2  SER  12           HB2      SER  12  37.238  16.401   8.923
   97    HB3  SER  12           HB1      SER  12  35.609  15.742   8.804
   98    HG   SER  12           HG       SER  12  37.891  14.662   7.996
   99    H    PHE  13           HN       PHE  13  37.064  19.189   8.198
  100    HA   PHE  13           HA       PHE  13  34.881  20.010   9.776
  101    HB2  PHE  13           HB2      PHE  13  37.149  20.868  10.122
  102    HB3  PHE  13           HB1      PHE  13  37.094  21.676   8.563
  103    HD1  PHE  13           HD1      PHE  13  35.607  21.591  11.951
  104    HD2  PHE  13           HD2      PHE  13  35.916  23.738   8.243
  105    HE1  PHE  13           HE1      PHE  13  34.496  23.549  12.992
  106    HE2  PHE  13           HE2      PHE  13  34.806  25.696   9.284
  107    HZ   PHE  13           HZ       PHE  13  34.096  25.602  11.659
  108    H    ILE  14           HN       ILE  14  35.938  21.093   6.539
  109    HA   ILE  14           HA       ILE  14  33.756  22.885   6.152
  110    HB   ILE  14           HB       ILE  14  35.635  21.535   4.213
  111   HG12  ILE  14          HG12      ILE  14  35.437  24.422   5.120
  112   HG13  ILE  14          HG11      ILE  14  36.521  23.243   5.859
  113   HG21  ILE  14          HG21      ILE  14  33.482  23.617   3.753
  114   HG22  ILE  14          HG22      ILE  14  33.610  22.032   2.993
  115   HG23  ILE  14          HG23      ILE  14  34.779  23.289   2.606
  116   HD11  ILE  14          HD11      ILE  14  37.736  24.514   4.157
  117   HD12  ILE  14          HD12      ILE  14  36.521  24.097   2.950
  118   HD13  ILE  14          HD13      ILE  14  37.555  22.841   3.628
  119    H    LEU  15           HN       LEU  15  34.307  19.514   5.264
  120    HA   LEU  15           HA       LEU  15  31.982  19.138   3.698
  121    HB2  LEU  15           HB2      LEU  15  33.797  17.312   5.231
  122    HB3  LEU  15           HB1      LEU  15  32.299  16.679   4.545
  123    HG   LEU  15           HG       LEU  15  34.213  18.314   2.881
  124   HD11  LEU  15          HD11      LEU  15  35.507  16.438   3.773
  125   HD12  LEU  15          HD12      LEU  15  35.140  16.147   2.074
  126   HD13  LEU  15          HD13      LEU  15  34.224  15.313   3.329
  127   HD21  LEU  15          HD21      LEU  15  33.104  16.964   1.069
  128   HD22  LEU  15          HD22      LEU  15  31.983  17.992   1.959
  129   HD23  LEU  15          HD23      LEU  15  32.051  16.264   2.298
  130    H    SER  16           HN       SER  16  32.513  18.003   7.039
  131    HA   SER  16           HA       SER  16  29.989  17.262   7.738
  132    HB2  SER  16           HB2      SER  16  31.881  17.054   9.273
  133    HB3  SER  16           HB1      SER  16  31.961  18.804   9.448
  134    HG   SER  16           HG       SER  16  30.579  18.509  10.998
  135    H    ALA  17           HN       ALA  17  31.295  20.568   7.599
  136    HA   ALA  17           HA       ALA  17  29.126  21.936   8.747
  137    HB1  ALA  17           HB1      ALA  17  30.655  23.020   6.390
  138    HB2  ALA  17           HB2      ALA  17  31.442  22.807   7.954
  139    HB3  ALA  17           HB3      ALA  17  30.050  23.880   7.807
  140    H    LEU  18           HN       LEU  18  29.780  21.418   5.263
  141    HA   LEU  18           HA       LEU  18  27.218  22.328   4.419
  142    HB2  LEU  18           HB2      LEU  18  29.538  20.951   3.178
  143    HB3  LEU  18           HB1      LEU  18  27.985  20.737   2.371
  144    HG   LEU  18           HG       LEU  18  29.347  22.740   1.593
  145   HD11  LEU  18          HD11      LEU  18  26.691  23.523   2.816
  146   HD12  LEU  18          HD12      LEU  18  26.800  22.448   1.424
  147   HD13  LEU  18          HD13      LEU  18  27.410  24.098   1.315
  148   HD21  LEU  18          HD21      LEU  18  29.568  24.636   3.011
  149   HD22  LEU  18          HD22      LEU  18  30.031  23.275   4.029
  150   HD23  LEU  18          HD23      LEU  18  28.431  23.998   4.192
  151    H    HIS  19           HN       HIS  19  28.276  19.390   5.802
  152    HA   HIS  19           HA       HIS  19  26.344  17.648   4.672
  153    HB2  HIS  19           HB2      HIS  19  28.505  16.998   5.874
  154    HB3  HIS  19           HB1      HIS  19  27.636  17.314   7.374
  155    HD2  HIS  19           HD2      HIS  19  24.875  15.930   5.454
  156    HE1  HIS  19           HE1      HIS  19  26.950  12.457   6.668
  157    HE2  HIS  19           HE2      HIS  19  24.763  13.332   5.723
  158    H    PHE  20           HN       PHE  20  26.504  19.430   7.741
  159    HA   PHE  20           HA       PHE  20  23.896  18.559   8.579
  160    HB2  PHE  20           HB2      PHE  20  26.115  19.895   9.753
  161    HB3  PHE  20           HB1      PHE  20  24.705  20.936   9.942
  162    HD1  PHE  20           HD1      PHE  20  25.386  17.237  10.043
  163    HD2  PHE  20           HD2      PHE  20  23.551  20.631  11.932
  164    HE1  PHE  20           HE1      PHE  20  24.539  15.771  11.854
  165    HE2  PHE  20           HE2      PHE  20  22.704  19.164  13.744
  166    HZ   PHE  20           HZ       PHE  20  23.189  16.727  13.701
  167    H    MET  21           HN       MET  21  25.147  21.125   6.628
  168    HA   MET  21           HA       MET  21  22.948  22.928   6.953
  169    HB2  MET  21           HB2      MET  21  25.105  22.631   4.859
  170    HB3  MET  21           HB1      MET  21  23.866  23.883   4.776
  171    HG2  MET  21           HG2      MET  21  25.646  23.472   7.186
  172    HG3  MET  21           HG1      MET  21  26.012  24.614   5.897
  173    HE1  MET  21           HE1      MET  21  23.716  25.296   9.558
  174    HE2  MET  21           HE2      MET  21  25.083  24.271   9.127
  175    HE3  MET  21           HE3      MET  21  23.441  23.704   8.837
  176    H    ALA  22           HN       ALA  22  23.873  20.876   4.187
  177    HA   ALA  22           HA       ALA  22  21.398  21.203   2.841
  178    HB1  ALA  22           HB1      ALA  22  23.164  18.810   2.449
  179    HB2  ALA  22           HB2      ALA  22  23.689  20.409   1.924
  180    HB3  ALA  22           HB3      ALA  22  22.220  19.698   1.254
  181    H    TRP  23           HN       TRP  23  22.625  18.700   5.025
  182    HA   TRP  23           HA       TRP  23  20.505  16.876   4.723
  183    HB2  TRP  23           HB2      TRP  23  22.698  16.414   5.841
  184    HB3  TRP  23           HB1      TRP  23  22.124  17.341   7.229
  185    HD1  TRP  23           HD1      TRP  23  21.634  14.068   5.368
  186    HE1  TRP  23           HE1      TRP  23  20.167  12.502   6.799
  187    HE3  TRP  23           HE3      TRP  23  20.235  17.301   9.068
  188    HZ2  TRP  23           HZ2      TRP  23  18.606  12.607   9.194
  189    HZ3  TRP  23           HZ3      TRP  23  18.760  16.541  10.909
  190    HH2  TRP  23           HH2      TRP  23  17.944  14.202  10.977
  191    H    THR  24           HN       THR  24  20.949  19.636   6.898
  192    HA   THR  24           HA       THR  24  18.612  19.215   8.444
  193    HB   THR  24           HB       THR  24  20.256  21.675   7.869
  194    HG1  THR  24           HG1      THR  24  19.936  19.932  10.076
  195   HG21  THR  24          HG21      THR  24  17.772  21.326   9.545
  196   HG22  THR  24          HG22      THR  24  18.128  22.576   8.351
  197   HG23  THR  24          HG23      THR  24  18.964  22.574   9.905
  198    H    ILE  25           HN       ILE  25  19.243  21.079   5.497
  199    HA   ILE  25           HA       ILE  25  16.724  22.322   5.284
  200    HB   ILE  25           HB       ILE  25  18.727  21.485   3.181
  201   HG12  ILE  25          HG12      ILE  25  18.021  24.239   4.223
  202   HG13  ILE  25          HG11      ILE  25  19.299  23.256   4.937
  203   HG21  ILE  25          HG21      ILE  25  16.144  23.047   2.963
  204   HG22  ILE  25          HG22      ILE  25  16.647  21.644   2.021
  205   HG23  ILE  25          HG23      ILE  25  17.440  23.199   1.778
  206   HD11  ILE  25          HD11      ILE  25  20.297  23.069   2.605
  207   HD12  ILE  25          HD12      ILE  25  20.359  24.679   3.322
  208   HD13  ILE  25          HD13      ILE  25  19.143  24.304   2.101
  209    H    GLY  26           HN       GLY  26  17.912  19.224   4.002
  210    HA2  GLY  26           HA2      GLY  26  15.566  18.498   2.602
  211    HA3  GLY  26           HA1      GLY  26  16.797  17.378   3.180
  212    H    HIS  27           HN       HIS  27  16.639  17.831   5.937
  213    HA   HIS  27           HA       HIS  27  14.568  16.135   6.716
  214    HB2  HIS  27           HB2      HIS  27  16.458  16.409   8.161
  215    HB3  HIS  27           HB1      HIS  27  16.192  18.148   8.282
  216    HD2  HIS  27           HD2      HIS  27  14.776  18.801  10.549
  217    HE1  HIS  27           HE1      HIS  27  12.798  15.117  11.124
  218    HE2  HIS  27           HE2      HIS  27  13.142  17.447  12.072
  219    H    LEU  28           HN       LEU  28  14.763  19.684   6.800
  220    HA   LEU  28           HA       LEU  28  12.165  20.014   7.939
  221    HB2  LEU  28           HB2      LEU  28  14.288  21.768   6.846
  222    HB3  LEU  28           HB1      LEU  28  12.647  22.409   6.763
  223    HG   LEU  28           HG       LEU  28  13.897  22.974   8.893
  224   HD11  LEU  28          HD11      LEU  28  11.458  21.255   9.402
  225   HD12  LEU  28          HD12      LEU  28  11.350  22.829   8.619
  226   HD13  LEU  28          HD13      LEU  28  11.964  22.700  10.266
  227   HD21  LEU  28          HD21      LEU  28  13.393  20.077   9.624
  228   HD22  LEU  28          HD22      LEU  28  14.346  21.272  10.495
  229   HD23  LEU  28          HD23      LEU  28  14.941  20.615   8.972
  230    H    ASN  29           HN       ASN  29  10.223  20.132   7.006
  231    HA   ASN  29           HA       ASN  29  10.005  19.463   4.203
  232    HB2  ASN  29           HB2      ASN  29   7.889  20.076   6.281
  233    HB3  ASN  29           HB1      ASN  29   7.568  19.472   4.657
  234   HD21  ASN  29          HD21      ASN  29   7.400  18.270   7.584
  235   HD22  ASN  29          HD22      ASN  29   8.103  16.738   7.384
  236    H    GLN  30           HN       GLN  30   9.314  20.746   2.548
  237    HA   GLN  30           HA       GLN  30   9.323  23.634   3.062
  238    HB2  GLN  30           HB2      GLN  30   9.715  21.914   0.640
  239    HB3  GLN  30           HB1      GLN  30   9.220  23.596   0.438
  240    HG2  GLN  30           HG2      GLN  30  11.618  23.580   0.386
  241    HG3  GLN  30           HG1      GLN  30  11.152  24.230   1.957
  242   HE21  GLN  30          HE21      GLN  30  13.060  23.500   3.082
  243   HE22  GLN  30          HE22      GLN  30  13.383  21.853   3.336
  244    H    ILE  31           HN       ILE  31   7.457  24.661   3.332
  245    HA   ILE  31           HA       ILE  31   5.034  23.544   2.048
  246    HB   ILE  31           HB       ILE  31   5.234  25.195   4.583
  247   HG12  ILE  31          HG12      ILE  31   4.495  22.272   4.237
  248   HG13  ILE  31          HG11      ILE  31   6.101  22.819   4.717
  249   HG21  ILE  31          HG21      ILE  31   2.873  23.751   3.337
  250   HG22  ILE  31          HG22      ILE  31   3.136  25.490   3.239
  251   HG23  ILE  31          HG23      ILE  31   2.850  24.731   4.802
  252   HD11  ILE  31          HD11      ILE  31   3.514  23.352   6.203
  253   HD12  ILE  31          HD12      ILE  31   5.088  24.006   6.656
  254   HD13  ILE  31          HD13      ILE  31   4.807  22.266   6.712
  255    H    LYS  32           HN       LYS  32   4.057  24.783   0.579
  256    HA   LYS  32           HA       LYS  32   4.953  27.568   0.278
  257    HB2  LYS  32           HB2      LYS  32   5.131  26.139  -1.706
  258    HB3  LYS  32           HB1      LYS  32   3.408  25.775  -1.611
  259    HG2  LYS  32           HG2      LYS  32   2.852  28.127  -1.959
  260    HG3  LYS  32           HG1      LYS  32   4.562  28.557  -1.949
  261    HD2  LYS  32           HD2      LYS  32   4.946  27.199  -3.954
  262    HD3  LYS  32           HD1      LYS  32   3.259  26.685  -3.947
  263    HE2  LYS  32           HE2      LYS  32   4.080  29.593  -4.103
  264    HE3  LYS  32           HE1      LYS  32   3.802  28.601  -5.534
  265    HZ1  LYS  32           HZ1      LYS  32   1.907  29.932  -4.008
  266    HZ2  LYS  32           HZ2      LYS  32   1.657  28.279  -3.713
  267    HZ3  LYS  32           HZ3      LYS  32   1.632  28.875  -5.303
  268    H    ARG  33           HN       ARG  33   3.740  28.999   1.343
  269    HA   ARG  33           HA       ARG  33   0.831  28.538   1.534
  270    HB2  ARG  33           HB2      ARG  33   2.293  28.925   3.621
  271    HB3  ARG  33           HB1      ARG  33   2.386  30.601   3.083
  272    HG2  ARG  33           HG2      ARG  33  -0.016  30.840   3.170
  273    HG3  ARG  33           HG1      ARG  33  -0.222  29.115   3.476
  274    HD2  ARG  33           HD2      ARG  33  -0.434  30.369   5.566
  275    HD3  ARG  33           HD1      ARG  33   1.005  29.355   5.607
  276    HE   ARG  33           HE       ARG  33   1.659  31.948   4.640
  277   HH11  ARG  33          HH11      ARG  33   0.782  30.198   7.514
  278   HH12  ARG  33          HH12      ARG  33   1.616  31.272   8.574
  279   HH21  ARG  33          HH21      ARG  33   2.754  33.353   6.048
  280   HH22  ARG  33          HH22      ARG  33   2.731  33.053   7.753
  281    H1   MET   1           HT1      MET   1  46.673  17.244  30.709
  282    H2   MET   1           HT2      MET   1  48.054  16.348  30.296
  283    H3   MET   1           HT3      MET   1  47.602  16.512  31.925
  284    HA   MET   1           HA       MET   1  46.127  15.034  29.816
  285    HB2  MET   1           HB2      MET   1  48.256  14.072  30.960
  286    HB3  MET   1           HB1      MET   1  47.238  13.941  32.395
  287    HG2  MET   1           HG2      MET   1  45.649  12.539  31.212
  288    HG3  MET   1           HG1      MET   1  46.516  12.773  29.695
  289    HE1  MET   1           HE1      MET   1  49.081  12.592  29.706
  290    HE2  MET   1           HE2      MET   1  48.496  11.135  28.908
  291    HE3  MET   1           HE3      MET   1  49.813  11.023  30.073
  292    H    PHE   2           HN       PHE   2  44.932  17.221  31.091
  293    HA   PHE   2           HA       PHE   2  43.369  16.140  33.317
  294    HB2  PHE   2           HB2      PHE   2  43.640  18.875  32.082
  295    HB3  PHE   2           HB1      PHE   2  42.355  18.502  33.231
  296    HD1  PHE   2           HD1      PHE   2  45.702  19.607  32.902
  297    HD2  PHE   2           HD2      PHE   2  43.143  17.266  35.436
  298    HE1  PHE   2           HE1      PHE   2  47.294  19.901  34.781
  299    HE2  PHE   2           HE2      PHE   2  44.734  17.560  37.316
  300    HZ   PHE   2           HZ       PHE   2  46.809  18.878  36.988
  301    H    GLU   3           HN       GLU   3  43.009  17.149  29.963
  302    HA   GLU   3           HA       GLU   3  40.168  16.872  29.961
  303    HB2  GLU   3           HB2      GLU   3  40.328  17.247  27.552
  304    HB3  GLU   3           HB1      GLU   3  41.355  18.390  28.407
  305    HG2  GLU   3           HG2      GLU   3  43.310  16.945  27.993
  306    HG3  GLU   3           HG1      GLU   3  42.285  15.798  27.134
  307    HA   PRO   4           HA       PRO   4  39.557  12.577  29.195
  308    HB2  PRO   4           HB2      PRO   4  38.100  13.301  26.691
  309    HB3  PRO   4           HB1      PRO   4  37.552  12.343  28.080
  310    HG2  PRO   4           HG2      PRO   4  36.692  14.829  27.694
  311    HG3  PRO   4           HG1      PRO   4  37.009  14.197  29.320
  312    HD2  PRO   4           HD2      PRO   4  38.627  16.101  27.689
  313    HD3  PRO   4           HD1      PRO   4  38.386  16.029  29.447
  314    H    PHE   5           HN       PHE   5  40.400  14.470  26.302
  315    HA   PHE   5           HA       PHE   5  42.609  12.768  25.661
  316    HB2  PHE   5           HB2      PHE   5  40.014  12.145  24.504
  317    HB3  PHE   5           HB1      PHE   5  41.210  12.518  23.263
  318    HD1  PHE   5           HD1      PHE   5  39.955   9.990  25.408
  319    HD2  PHE   5           HD2      PHE   5  43.583  11.418  23.607
  320    HE1  PHE   5           HE1      PHE   5  40.993   7.761  25.734
  321    HE2  PHE   5           HE2      PHE   5  44.622   9.189  23.933
  322    HZ   PHE   5           HZ       PHE   5  43.323   7.357  24.996
  323    H    GLN   6           HN       GLN   6  40.317  14.581  23.623
  324    HA   GLN   6           HA       GLN   6  42.200  16.792  23.379
  325    HB2  GLN   6           HB2      GLN   6  41.828  14.743  21.301
  326    HB3  GLN   6           HB1      GLN   6  41.655  16.403  20.729
  327    HG2  GLN   6           HG2      GLN   6  43.831  17.000  21.545
  328    HG3  GLN   6           HG1      GLN   6  43.986  15.483  22.426
  329   HE21  GLN   6          HE21      GLN   6  46.080  15.684  20.870
  330   HE22  GLN   6          HE22      GLN   6  45.922  14.861  19.393
  331    H    ILE   7           HN       ILE   7  41.269  18.624  22.209
  332    HA   ILE   7           HA       ILE   7  38.628  19.186  22.966
  333    HB   ILE   7           HB       ILE   7  40.418  20.479  20.911
  334   HG12  ILE   7          HG12      ILE   7  39.574  21.448  23.653
  335   HG13  ILE   7          HG11      ILE   7  41.032  20.488  23.393
  336   HG21  ILE   7          HG21      ILE   7  38.173  21.050  20.289
  337   HG22  ILE   7          HG22      ILE   7  38.793  22.420  21.212
  338   HG23  ILE   7          HG23      ILE   7  37.694  21.271  21.973
  339   HD11  ILE   7          HD11      ILE   7  42.014  22.162  22.014
  340   HD12  ILE   7          HD12      ILE   7  41.334  23.035  23.388
  341   HD13  ILE   7          HD13      ILE   7  40.486  23.027  21.842
  342    H    LEU   8           HN       LEU   8  39.970  17.854  20.041
  343    HA   LEU   8           HA       LEU   8  37.689  18.131  18.373
  344    HB2  LEU   8           HB2      LEU   8  40.167  16.489  18.333
  345    HB3  LEU   8           HB1      LEU   8  38.823  15.932  17.335
  346    HG   LEU   8           HG       LEU   8  40.432  17.529  16.184
  347   HD11  LEU   8          HD11      LEU   8  38.691  18.581  14.967
  348   HD12  LEU   8          HD12      LEU   8  37.638  18.673  16.375
  349   HD13  LEU   8          HD13      LEU   8  37.943  17.117  15.603
  350   HD21  LEU   8          HD21      LEU   8  39.040  19.651  17.837
  351   HD22  LEU   8          HD22      LEU   8  40.445  19.831  16.789
  352   HD23  LEU   8          HD23      LEU   8  40.596  18.974  18.322
  353    H    SER   9           HN       SER   9  38.890  15.078  19.763
  354    HA   SER   9           HA       SER   9  36.657  13.528  19.406
  355    HB2  SER   9           HB2      SER   9  37.435  12.180  21.303
  356    HB3  SER   9           HB1      SER   9  38.801  12.692  20.317
  357    HG   SER   9           HG       SER   9  39.005  12.983  22.661
  358    H    ILE  10           HN       ILE  10  37.208  16.001  21.846
  359    HA   ILE  10           HA       ILE  10  34.952  15.351  23.477
  360    HB   ILE  10           HB       ILE  10  36.619  17.844  23.183
  361   HG12  ILE  10          HG12      ILE  10  36.373  15.947  25.523
  362   HG13  ILE  10          HG11      ILE  10  37.527  15.669  24.223
  363   HG21  ILE  10          HG21      ILE  10  34.462  18.605  23.905
  364   HG22  ILE  10          HG22      ILE  10  35.470  18.507  25.348
  365   HG23  ILE  10          HG23      ILE  10  34.285  17.244  25.012
  366   HD11  ILE  10          HD11      ILE  10  37.444  17.902  26.236
  367   HD12  ILE  10          HD12      ILE  10  38.230  18.164  24.686
  368   HD13  ILE  10          HD13      ILE  10  38.807  16.896  25.753
  369    H    CYS  11           HN       CYS  11  35.503  17.761  20.919
  370    HA   CYS  11           HA       CYS  11  32.951  18.952  20.992
  371    HB2  CYS  11           HB2      CYS  11  34.958  18.632  18.749
  372    HB3  CYS  11           HB1      CYS  11  33.484  19.590  18.602
  373    HG   CYS  11           HG       CYS  11  35.039  21.348  19.511
  374    H    SER  12           HN       SER  12  34.221  16.287  18.969
  375    HA   SER  12           HA       SER  12  31.814  15.787  17.583
  376    HB2  SER  12           HB2      SER  12  34.185  14.013  18.187
  377    HB3  SER  12           HB1      SER  12  32.860  13.542  17.129
  378    HG   SER  12           HG       SER  12  34.983  15.026  16.559
  379    H    PHE  13           HN       PHE  13  33.015  14.771  20.710
  380    HA   PHE  13           HA       PHE  13  31.299  12.588  21.173
  381    HB2  PHE  13           HB2      PHE  13  33.223  13.077  22.610
  382    HB3  PHE  13           HB1      PHE  13  32.453  14.561  23.154
  383    HD1  PHE  13           HD1      PHE  13  32.199  10.869  23.173
  384    HD2  PHE  13           HD2      PHE  13  30.701  14.556  24.788
  385    HE1  PHE  13           HE1      PHE  13  30.968   9.606  24.916
  386    HE2  PHE  13           HE2      PHE  13  29.470  13.293  26.532
  387    HZ   PHE  13           HZ       PHE  13  29.604  10.818  26.596
  388    H    ILE  14           HN       ILE  14  30.935  16.039  22.020
  389    HA   ILE  14           HA       ILE  14  28.330  15.747  23.138
  390    HB   ILE  14           HB       ILE  14  29.803  18.142  22.042
  391   HG12  ILE  14          HG12      ILE  14  29.099  17.363  24.886
  392   HG13  ILE  14          HG11      ILE  14  30.645  16.980  24.128
  393   HG21  ILE  14          HG21      ILE  14  27.128  17.947  23.451
  394   HG22  ILE  14          HG22      ILE  14  27.436  18.611  21.846
  395   HG23  ILE  14          HG23      ILE  14  28.033  19.449  23.275
  396   HD11  ILE  14          HD11      ILE  14  30.864  19.052  25.406
  397   HD12  ILE  14          HD12      ILE  14  29.490  19.752  24.549
  398   HD13  ILE  14          HD13      ILE  14  30.989  19.411  23.683
  399    H    LEU  15           HN       LEU  15  29.502  16.613  19.920
  400    HA   LEU  15           HA       LEU  15  27.011  17.270  18.761
  401    HB2  LEU  15           HB2      LEU  15  29.652  16.356  17.681
  402    HB3  LEU  15           HB1      LEU  15  28.259  16.460  16.603
  403    HG   LEU  15           HG       LEU  15  29.010  18.755  18.412
  404   HD11  LEU  15          HD11      LEU  15  30.994  18.263  17.065
  405   HD12  LEU  15          HD12      LEU  15  30.210  19.720  16.455
  406   HD13  LEU  15          HD13      LEU  15  30.009  18.189  15.603
  407   HD21  LEU  15          HD21      LEU  15  27.819  20.013  16.588
  408   HD22  LEU  15          HD22      LEU  15  26.791  18.846  17.416
  409   HD23  LEU  15          HD23      LEU  15  27.449  18.466  15.826
  410    H    SER  16           HN       SER  16  28.860  14.258  18.267
  411    HA   SER  16           HA       SER  16  27.001  12.710  17.029
  412    HB2  SER  16           HB2      SER  16  29.245  11.888  17.495
  413    HB3  SER  16           HB1      SER  16  28.906  11.856  19.224
  414    HG   SER  16           HG       SER  16  28.231   9.906  18.832
  415    H    ALA  17           HN       ALA  17  27.208  13.439  20.502
  416    HA   ALA  17           HA       ALA  17  25.216  11.688  21.429
  417    HB1  ALA  17           HB1      ALA  17  25.564  14.473  22.521
  418    HB2  ALA  17           HB2      ALA  17  26.819  13.253  22.737
  419    HB3  ALA  17           HB3      ALA  17  25.204  12.982  23.392
  420    H    LEU  18           HN       LEU  18  24.863  15.158  20.609
  421    HA   LEU  18           HA       LEU  18  22.019  15.125  20.725
  422    HB2  LEU  18           HB2      LEU  18  24.122  17.013  19.812
  423    HB3  LEU  18           HB1      LEU  18  22.520  17.233  19.107
  424    HG   LEU  18           HG       LEU  18  22.948  18.520  21.260
  425   HD11  LEU  18          HD11      LEU  18  20.702  16.509  21.524
  426   HD12  LEU  18          HD12      LEU  18  20.665  17.793  20.318
  427   HD13  LEU  18          HD13      LEU  18  20.720  18.195  22.033
  428   HD21  LEU  18          HD21      LEU  18  23.071  17.356  23.327
  429   HD22  LEU  18          HD22      LEU  18  24.178  16.477  22.275
  430   HD23  LEU  18          HD23      LEU  18  22.571  15.831  22.601
  431    H    HIS  19           HN       HIS  19  24.242  14.046  18.366
  432    HA   HIS  19           HA       HIS  19  22.626  14.367  16.053
  433    HB2  HIS  19           HB2      HIS  19  25.148  13.940  16.142
  434    HB3  HIS  19           HB1      HIS  19  24.741  12.251  16.435
  435    HD2  HIS  19           HD2      HIS  19  22.027  13.056  14.152
  436    HE1  HIS  19           HE1      HIS  19  25.270  12.448  11.513
  437    HE2  HIS  19           HE2      HIS  19  22.743  12.639  11.671
  438    H    PHE  20           HN       PHE  20  23.238  11.625  18.234
  439    HA   PHE  20           HA       PHE  20  21.382   9.906  16.870
  440    HB2  PHE  20           HB2      PHE  20  23.385   9.630  18.872
  441    HB3  PHE  20           HB1      PHE  20  21.873   9.022  19.544
  442    HD1  PHE  20           HD1      PHE  20  23.561   8.976  16.181
  443    HD2  PHE  20           HD2      PHE  20  21.547   6.743  19.250
  444    HE1  PHE  20           HE1      PHE  20  23.781   6.913  14.825
  445    HE2  PHE  20           HE2      PHE  20  21.768   4.680  17.892
  446    HZ   PHE  20           HZ       PHE  20  22.889   4.762  15.682
  447    H    MET  21           HN       MET  21  21.175  12.286  19.368
  448    HA   MET  21           HA       MET  21  18.773  11.319  20.586
  449    HB2  MET  21           HB2      MET  21  20.156  14.006  20.553
  450    HB3  MET  21           HB1      MET  21  18.651  13.722  21.427
  451    HG2  MET  21           HG2      MET  21  21.137  12.044  21.821
  452    HG3  MET  21           HG1      MET  21  20.734  13.432  22.829
  453    HE1  MET  21           HE1      MET  21  19.615   9.243  23.408
  454    HE2  MET  21           HE2      MET  21  21.008  10.066  22.712
  455    HE3  MET  21           HE3      MET  21  19.592   9.751  21.715
  456    H    ALA  22           HN       ALA  22  19.325  14.138  18.471
  457    HA   ALA  22           HA       ALA  22  16.569  14.579  17.974
  458    HB1  ALA  22           HB1      ALA  22  18.726  15.425  16.067
  459    HB2  ALA  22           HB2      ALA  22  18.588  16.175  17.657
  460    HB3  ALA  22           HB3      ALA  22  17.247  16.274  16.515
  461    H    TRP  23           HN       TRP  23  19.072  12.818  16.189
  462    HA   TRP  23           HA       TRP  23  17.569  12.294  13.870
  463    HB2  TRP  23           HB2      TRP  23  20.038  11.963  14.133
  464    HB3  TRP  23           HB1      TRP  23  19.688  10.509  15.071
  465    HD1  TRP  23           HD1      TRP  23  19.586  11.934  11.553
  466    HE1  TRP  23           HE1      TRP  23  19.145  10.017   9.886
  467    HE3  TRP  23           HE3      TRP  23  18.566   8.139  14.816
  468    HZ2  TRP  23           HZ2      TRP  23  18.451   7.242   9.929
  469    HZ3  TRP  23           HZ3      TRP  23  18.019   5.872  13.977
  470    HH2  TRP  23           HH2      TRP  23  17.960   5.419  11.540
  471    H    THR  24           HN       THR  24  17.877  10.530  16.927
  472    HA   THR  24           HA       THR  24  16.359   8.267  16.154
  473    HB   THR  24           HB       THR  24  16.977   9.480  18.842
  474    HG1  THR  24           HG1      THR  24  17.866   7.204  17.411
  475   HG21  THR  24          HG21      THR  24  15.352   7.042  18.118
  476   HG22  THR  24          HG22      THR  24  14.943   8.344  19.237
  477   HG23  THR  24          HG23      THR  24  16.191   7.173  19.664
  478    H    ILE  25           HN       ILE  25  15.483  11.336  17.690
  479    HA   ILE  25           HA       ILE  25  12.779  10.741  18.223
  480    HB   ILE  25           HB       ILE  25  14.174  13.355  17.624
  481   HG12  ILE  25          HG12      ILE  25  13.081  12.275  20.232
  482   HG13  ILE  25          HG11      ILE  25  14.742  11.990  19.710
  483   HG21  ILE  25          HG21      ILE  25  11.324  12.762  18.449
  484   HG22  ILE  25          HG22      ILE  25  11.877  13.739  17.090
  485   HG23  ILE  25          HG23      ILE  25  12.085  14.325  18.741
  486   HD11  ILE  25          HD11      ILE  25  14.969  14.510  19.452
  487   HD12  ILE  25          HD12      ILE  25  14.794  13.939  21.110
  488   HD13  ILE  25          HD13      ILE  25  13.416  14.653  20.273
  489    H    GLY  26           HN       GLY  26  14.330  12.200  15.372
  490    HA2  GLY  26           HA2      GLY  26  11.971  12.680  13.891
  491    HA3  GLY  26           HA1      GLY  26  13.584  12.499  13.210
  492    H    HIS  27           HN       HIS  27  14.181   9.882  13.977
  493    HA   HIS  27           HA       HIS  27  13.022   8.365  11.948
  494    HB2  HIS  27           HB2      HIS  27  15.110   7.660  12.884
  495    HB3  HIS  27           HB1      HIS  27  14.416   7.542  14.502
  496    HD2  HIS  27           HD2      HIS  27  13.659   4.963  15.090
  497    HE1  HIS  27           HE1      HIS  27  13.080   3.574  11.146
  498    HE2  HIS  27           HE2      HIS  27  13.035   2.912  13.597
  499    H    LEU  28           HN       LEU  28  12.224   8.519  15.408
  500    HA   LEU  28           HA       LEU  28  10.129   6.584  15.234
  501    HB2  LEU  28           HB2      LEU  28  11.216   8.418  17.293
  502    HB3  LEU  28           HB1      LEU  28   9.521   7.969  17.483
  503    HG   LEU  28           HG       LEU  28  11.166   6.421  18.635
  504   HD11  LEU  28          HD11      LEU  28   9.596   5.027  16.455
  505   HD12  LEU  28          HD12      LEU  28   8.808   5.809  17.822
  506   HD13  LEU  28          HD13      LEU  28   9.917   4.465  18.090
  507   HD21  LEU  28          HD21      LEU  28  11.749   5.422  15.834
  508   HD22  LEU  28          HD22      LEU  28  12.551   4.983  17.337
  509   HD23  LEU  28          HD23      LEU  28  12.800   6.584  16.645
  510    H    ASN  29           HN       ASN  29   8.041   6.807  14.738
  511    HA   ASN  29           HA       ASN  29   7.156   9.332  13.647
  512    HB2  ASN  29           HB2      ASN  29   5.712   6.692  13.993
  513    HB3  ASN  29           HB1      ASN  29   5.090   8.080  13.102
  514   HD21  ASN  29          HD21      ASN  29   6.197   5.210  12.331
  515   HD22  ASN  29          HD22      ASN  29   7.209   5.559  11.013
  516    H    GLN  30           HN       GLN  30   5.653  10.716  14.474
  517    HA   GLN  30           HA       GLN  30   5.002  10.374  17.313
  518    HB2  GLN  30           HB2      GLN  30   5.077  12.699  15.425
  519    HB3  GLN  30           HB1      GLN  30   4.098  12.800  16.889
  520    HG2  GLN  30           HG2      GLN  30   6.262  13.665  17.454
  521    HG3  GLN  30           HG1      GLN  30   6.151  12.064  18.182
  522   HE21  GLN  30          HE21      GLN  30   8.439  11.618  18.108
  523   HE22  GLN  30          HE22      GLN  30   9.271  11.408  16.644
  524    H    ILE  31           HN       ILE  31   3.104   9.532  17.866
  525    HA   ILE  31           HA       ILE  31   0.822   9.860  16.010
  526    HB   ILE  31           HB       ILE  31   1.332   7.627  17.994
  527   HG12  ILE  31          HG12      ILE  31   1.378   7.559  14.960
  528   HG13  ILE  31          HG11      ILE  31   2.831   7.684  15.952
  529   HG21  ILE  31          HG21      ILE  31  -0.792   7.926  15.846
  530   HG22  ILE  31          HG22      ILE  31  -1.075   8.190  17.566
  531   HG23  ILE  31          HG23      ILE  31  -0.630   6.589  16.983
  532   HD11  ILE  31          HD11      ILE  31   0.807   5.429  16.011
  533   HD12  ILE  31          HD12      ILE  31   2.174   5.575  17.115
  534   HD13  ILE  31          HD13      ILE  31   2.455   5.343  15.390
  535    H    LYS  32           HN       LYS  32  -0.875  10.969  16.746
  536    HA   LYS  32           HA       LYS  32  -0.945  11.689  19.598
  537    HB2  LYS  32           HB2      LYS  32  -1.000  13.547  18.005
  538    HB3  LYS  32           HB1      LYS  32  -2.422  12.854  17.226
  539    HG2  LYS  32           HG2      LYS  32  -3.714  13.097  19.283
  540    HG3  LYS  32           HG1      LYS  32  -2.290  13.692  20.136
  541    HD2  LYS  32           HD2      LYS  32  -2.181  15.640  18.644
  542    HD3  LYS  32           HD1      LYS  32  -3.568  15.035  17.736
  543    HE2  LYS  32           HE2      LYS  32  -3.686  15.597  20.706
  544    HE3  LYS  32           HE1      LYS  32  -4.101  16.804  19.490
  545    HZ1  LYS  32           HZ1      LYS  32  -5.729  14.808  20.504
  546    HZ2  LYS  32           HZ2      LYS  32  -5.392  14.349  18.904
  547    HZ3  LYS  32           HZ3      LYS  32  -6.076  15.869  19.229
  548    H    ARG  33           HN       ARG  33  -2.120  10.351  20.816
  549    HA   ARG  33           HA       ARG  33  -4.564   9.159  19.668
  550    HB2  ARG  33           HB2      ARG  33  -2.694   7.713  20.690
  551    HB3  ARG  33           HB1      ARG  33  -3.249   8.327  22.248
  552    HG2  ARG  33           HG2      ARG  33  -5.469   7.443  21.884
  553    HG3  ARG  33           HG1      ARG  33  -5.069   7.000  20.224
  554    HD2  ARG  33           HD2      ARG  33  -4.963   5.027  21.670
  555    HD3  ARG  33           HD1      ARG  33  -3.359   5.428  21.062
  556    HE   ARG  33           HE       ARG  33  -3.799   6.689  23.572
  557   HH11  ARG  33          HH11      ARG  33  -3.207   3.600  22.086
  558   HH12  ARG  33          HH12      ARG  33  -2.423   2.943  23.472
  559   HH21  ARG  33          HH21      ARG  33  -2.763   5.809  25.391
  560   HH22  ARG  33          HH22      ARG  33  -2.169   4.182  25.340
  561    H1   MET   1           HT1      MET   1  49.831  -3.267  23.574
  562    H2   MET   1           HT2      MET   1  51.167  -2.335  23.091
  563    H3   MET   1           HT3      MET   1  51.294  -4.027  23.176
  564    HA   MET   1           HA       MET   1  49.643  -2.462  21.269
  565    HB2  MET   1           HB2      MET   1  52.214  -2.747  20.986
  566    HB3  MET   1           HB1      MET   1  51.832  -4.432  20.628
  567    HG2  MET   1           HG2      MET   1  50.388  -3.776  18.792
  568    HG3  MET   1           HG1      MET   1  50.574  -2.071  19.205
  569    HE1  MET   1           HE1      MET   1  52.933  -1.197  19.760
  570    HE2  MET   1           HE2      MET   1  52.530  -0.550  18.172
  571    HE3  MET   1           HE3      MET   1  54.146  -1.186  18.472
  572    H    PHE   2           HN       PHE   2  48.402  -4.203  23.073
  573    HA   PHE   2           HA       PHE   2  48.071  -6.755  21.681
  574    HB2  PHE   2           HB2      PHE   2  47.124  -5.676  24.330
  575    HB3  PHE   2           HB1      PHE   2  46.474  -7.169  23.653
  576    HD1  PHE   2           HD1      PHE   2  49.050  -5.785  25.648
  577    HD2  PHE   2           HD2      PHE   2  48.285  -8.890  22.781
  578    HE1  PHE   2           HE1      PHE   2  51.041  -7.022  26.457
  579    HE2  PHE   2           HE2      PHE   2  50.277 -10.128  23.590
  580    HZ   PHE   2           HZ       PHE   2  51.654  -9.193  25.427
  581    H    GLU   3           HN       GLU   3  46.308  -3.797  22.418
  582    HA   GLU   3           HA       GLU   3  43.839  -4.747  21.347
  583    HB2  GLU   3           HB2      GLU   3  43.049  -2.456  21.658
  584    HB3  GLU   3           HB1      GLU   3  43.947  -2.977  23.077
  585    HG2  GLU   3           HG2      GLU   3  45.958  -1.833  22.224
  586    HG3  GLU   3           HG1      GLU   3  45.059  -1.304  20.803
  587    HA   PRO   4           HA       PRO   4  44.223  -3.966  17.027
  588    HB2  PRO   4           HB2      PRO   4  41.851  -2.163  17.208
  589    HB3  PRO   4           HB1      PRO   4  42.106  -3.595  16.194
  590    HG2  PRO   4           HG2      PRO   4  40.510  -3.673  18.320
  591    HG3  PRO   4           HG1      PRO   4  41.527  -5.054  17.871
  592    HD2  PRO   4           HD2      PRO   4  41.890  -3.086  20.083
  593    HD3  PRO   4           HD1      PRO   4  42.297  -4.813  20.019
  594    H    PHE   5           HN       PHE   5  43.457  -1.087  18.971
  595    HA   PHE   5           HA       PHE   5  45.688   0.375  17.939
  596    HB2  PHE   5           HB2      PHE   5  43.137   0.618  16.563
  597    HB3  PHE   5           HB1      PHE   5  43.681   2.166  17.211
  598    HD1  PHE   5           HD1      PHE   5  43.997  -0.121  14.519
  599    HD2  PHE   5           HD2      PHE   5  46.231   2.721  16.838
  600    HE1  PHE   5           HE1      PHE   5  45.661   0.063  12.688
  601    HE2  PHE   5           HE2      PHE   5  47.896   2.905  15.008
  602    HZ   PHE   5           HZ       PHE   5  47.610   1.577  12.934
  603    H    GLN   6           HN       GLN   6  42.426   1.401  18.947
  604    HA   GLN   6           HA       GLN   6  43.414   2.131  21.588
  605    HB2  GLN   6           HB2      GLN   6  42.935   4.079  19.434
  606    HB3  GLN   6           HB1      GLN   6  42.124   4.454  20.955
  607    HG2  GLN   6           HG2      GLN   6  44.191   4.394  22.171
  608    HG3  GLN   6           HG1      GLN   6  45.053   3.715  20.794
  609   HE21  GLN   6          HE21      GLN   6  46.331   5.885  21.529
  610   HE22  GLN   6          HE22      GLN   6  45.911   7.265  20.633
  611    H    ILE   7           HN       ILE   7  41.669   2.799  23.032
  612    HA   ILE   7           HA       ILE   7  39.405   1.155  22.858
  613    HB   ILE   7           HB       ILE   7  39.942   3.611  24.521
  614   HG12  ILE   7          HG12      ILE   7  39.864   0.690  25.317
  615   HG13  ILE   7          HG11      ILE   7  41.347   1.495  24.801
  616   HG21  ILE   7          HG21      ILE   7  37.553   3.386  24.404
  617   HG22  ILE   7          HG22      ILE   7  38.050   2.665  25.935
  618   HG23  ILE   7          HG23      ILE   7  37.650   1.633  24.562
  619   HD11  ILE   7          HD11      ILE   7  41.283   3.014  26.631
  620   HD12  ILE   7          HD12      ILE   7  40.901   1.440  27.327
  621   HD13  ILE   7          HD13      ILE   7  39.613   2.602  27.018
  622    H    LEU   8           HN       LEU   8  39.969   4.436  21.835
  623    HA   LEU   8           HA       LEU   8  37.268   5.199  21.395
  624    HB2  LEU   8           HB2      LEU   8  39.932   6.193  20.525
  625    HB3  LEU   8           HB1      LEU   8  38.538   6.704  19.572
  626    HG   LEU   8           HG       LEU   8  39.134   8.230  21.516
  627   HD11  LEU   8          HD11      LEU   8  36.861   8.710  21.978
  628   HD12  LEU   8          HD12      LEU   8  36.378   7.023  21.828
  629   HD13  LEU   8          HD13      LEU   8  36.818   7.946  20.391
  630   HD21  LEU   8          HD21      LEU   8  37.872   6.062  23.214
  631   HD22  LEU   8          HD22      LEU   8  38.703   7.518  23.747
  632   HD23  LEU   8          HD23      LEU   8  39.621   6.196  23.029
  633    H    SER   9           HN       SER   9  39.679   4.497  18.869
  634    HA   SER   9           HA       SER   9  37.989   4.164  16.735
  635    HB2  SER   9           HB2      SER   9  39.718   2.729  15.742
  636    HB3  SER   9           HB1      SER   9  40.456   4.093  16.577
  637    HG   SER   9           HG       SER   9  41.354   1.928  17.005
  638    H    ILE  10           HN       ILE  10  38.634   1.911  19.359
  639    HA   ILE  10           HA       ILE  10  37.352  -0.347  18.165
  640    HB   ILE  10           HB       ILE  10  38.054   0.343  21.014
  641   HG12  ILE  10          HG12      ILE  10  39.165  -1.821  19.220
  642   HG13  ILE  10          HG11      ILE  10  39.830  -0.191  19.224
  643   HG21  ILE  10          HG21      ILE  10  36.157  -1.116  21.166
  644   HG22  ILE  10          HG22      ILE  10  37.585  -2.121  21.411
  645   HG23  ILE  10          HG23      ILE  10  36.756  -2.131  19.855
  646   HD11  ILE  10          HD11      ILE  10  39.829  -2.239  21.426
  647   HD12  ILE  10          HD12      ILE  10  39.929  -0.532  21.832
  648   HD13  ILE  10          HD13      ILE  10  41.164  -1.263  20.822
  649    H    CYS  11           HN       CYS  11  36.297   2.091  20.528
  650    HA   CYS  11           HA       CYS  11  33.703   1.080  20.951
  651    HB2  CYS  11           HB2      CYS  11  34.825   3.882  21.134
  652    HB3  CYS  11           HB1      CYS  11  33.180   3.467  21.619
  653    HG   CYS  11           HG       CYS  11  34.403   3.040  23.784
  654    H    SER  12           HN       SER  12  34.883   3.578  18.679
  655    HA   SER  12           HA       SER  12  32.385   4.088  17.469
  656    HB2  SER  12           HB2      SER  12  35.212   4.436  16.457
  657    HB3  SER  12           HB1      SER  12  33.788   5.007  15.592
  658    HG   SER  12           HG       SER  12  35.089   6.175  17.584
  659    H    PHE  13           HN       PHE  13  34.822   1.626  16.953
  660    HA   PHE  13           HA       PHE  13  34.047   0.743  14.397
  661    HB2  PHE  13           HB2      PHE  13  36.131   0.020  15.462
  662    HB3  PHE  13           HB1      PHE  13  35.218  -0.844  16.690
  663    HD1  PHE  13           HD1      PHE  13  36.018  -0.724  13.077
  664    HD2  PHE  13           HD2      PHE  13  34.212  -2.974  16.260
  665    HE1  PHE  13           HE1      PHE  13  35.862  -2.702  11.591
  666    HE2  PHE  13           HE2      PHE  13  34.057  -4.953  14.773
  667    HZ   PHE  13           HZ       PHE  13  34.883  -4.818  12.438
  668    H    ILE  14           HN       ILE  14  33.054  -0.392  17.633
  669    HA   ILE  14           HA       ILE  14  31.184  -2.309  16.662
  670    HB   ILE  14           HB       ILE  14  31.460  -0.929  19.331
  671   HG12  ILE  14          HG12      ILE  14  32.023  -3.789  18.499
  672   HG13  ILE  14          HG11      ILE  14  33.256  -2.527  18.533
  673   HG21  ILE  14          HG21      ILE  14  29.605  -3.156  18.447
  674   HG22  ILE  14          HG22      ILE  14  29.139  -1.585  19.098
  675   HG23  ILE  14          HG23      ILE  14  29.933  -2.764  20.134
  676   HD11  ILE  14          HD11      ILE  14  33.320  -3.776  20.633
  677   HD12  ILE  14          HD12      ILE  14  31.600  -3.480  20.887
  678   HD13  ILE  14          HD13      ILE  14  32.743  -2.138  20.942
  679    H    LEU  15           HN       LEU  15  30.884   1.053  17.697
  680    HA   LEU  15           HA       LEU  15  28.067   1.250  17.579
  681    HB2  LEU  15           HB2      LEU  15  30.318   3.221  17.408
  682    HB3  LEU  15           HB1      LEU  15  28.666   3.749  17.075
  683    HG   LEU  15           HG       LEU  15  29.327   2.160  19.553
  684   HD11  LEU  15          HD11      LEU  15  30.786   4.126  19.591
  685   HD12  LEU  15          HD12      LEU  15  29.471   4.342  20.746
  686   HD13  LEU  15          HD13      LEU  15  29.424   5.172  19.190
  687   HD21  LEU  15          HD21      LEU  15  27.285   3.388  20.357
  688   HD22  LEU  15          HD22      LEU  15  26.968   2.345  18.974
  689   HD23  LEU  15          HD23      LEU  15  27.122   4.086  18.746
  690    H    SER  16           HN       SER  16  30.395   2.528  15.196
  691    HA   SER  16           HA       SER  16  28.732   3.152  13.136
  692    HB2  SER  16           HB2      SER  16  31.135   3.528  13.004
  693    HB3  SER  16           HB1      SER  16  31.431   1.793  12.944
  694    HG   SER  16           HG       SER  16  31.222   2.033  10.871
  695    H    ALA  17           HN       ALA  17  29.913  -0.079  14.033
  696    HA   ALA  17           HA       ALA  17  28.933  -1.523  11.831
  697    HB1  ALA  17           HB1      ALA  17  28.841  -2.600  14.643
  698    HB2  ALA  17           HB2      ALA  17  30.383  -2.296  13.842
  699    HB3  ALA  17           HB3      ALA  17  29.241  -3.446  13.147
  700    H    LEU  18           HN       LEU  18  27.370  -1.084  15.021
  701    HA   LEU  18           HA       LEU  18  24.866  -2.160  14.194
  702    HB2  LEU  18           HB2      LEU  18  25.911  -0.702  16.561
  703    HB3  LEU  18           HB1      LEU  18  24.170  -0.606  16.291
  704    HG   LEU  18           HG       LEU  18  24.944  -2.554  17.731
  705   HD11  LEU  18          HD11      LEU  18  23.578  -3.447  15.182
  706   HD12  LEU  18          HD12      LEU  18  22.772  -2.409  16.356
  707   HD13  LEU  18          HD13      LEU  18  23.305  -4.022  16.824
  708   HD21  LEU  18          HD21      LEU  18  26.086  -4.379  16.728
  709   HD22  LEU  18          HD22      LEU  18  26.963  -2.960  16.162
  710   HD23  LEU  18          HD23      LEU  18  25.816  -3.771  15.098
  711    H    HIS  19           HN       HIS  19  26.348   0.877  13.694
  712    HA   HIS  19           HA       HIS  19  24.014   2.476  13.455
  713    HB2  HIS  19           HB2      HIS  19  26.423   3.279  13.763
  714    HB3  HIS  19           HB1      HIS  19  26.630   2.970  12.041
  715    HD2  HIS  19           HD2      HIS  19  23.186   4.137  11.953
  716    HE1  HIS  19           HE1      HIS  19  25.351   7.756  12.187
  717    HE2  HIS  19           HE2      HIS  19  23.088   6.733  11.661
  718    H    PHE  20           HN       PHE  20  26.075   0.809  11.086
  719    HA   PHE  20           HA       PHE  20  24.420   1.561   8.860
  720    HB2  PHE  20           HB2      PHE  20  26.981   0.378   9.240
  721    HB3  PHE  20           HB1      PHE  20  26.022  -0.731   8.260
  722    HD1  PHE  20           HD1      PHE  20  26.400   3.002   8.551
  723    HD2  PHE  20           HD2      PHE  20  26.262  -0.431   5.971
  724    HE1  PHE  20           HE1      PHE  20  26.705   4.471   6.580
  725    HE2  PHE  20           HE2      PHE  20  26.567   1.041   3.999
  726    HZ   PHE  20           HZ       PHE  20  26.794   3.490   4.304
  727    H    MET  21           HN       MET  21  24.433  -1.002  11.185
  728    HA   MET  21           HA       MET  21  22.968  -2.903   9.632
  729    HB2  MET  21           HB2      MET  21  23.453  -2.564  12.594
  730    HB3  MET  21           HB1      MET  21  22.482  -3.880  11.936
  731    HG2  MET  21           HG2      MET  21  25.310  -3.301  11.036
  732    HG3  MET  21           HG1      MET  21  24.915  -4.464  12.300
  733    HE1  MET  21           HE1      MET  21  25.250  -5.146   7.987
  734    HE2  MET  21           HE2      MET  21  26.053  -4.080   9.136
  735    HE3  MET  21           HE3      MET  21  24.525  -3.589   8.411
  736    H    ALA  22           HN       ALA  22  21.949  -0.900  12.393
  737    HA   ALA  22           HA       ALA  22  19.182  -1.412  12.016
  738    HB1  ALA  22           HB1      ALA  22  20.213   1.058  13.368
  739    HB2  ALA  22           HB2      ALA  22  20.429  -0.527  14.109
  740    HB3  ALA  22           HB3      ALA  22  18.806   0.078  13.776
  741    H    TRP  23           HN       TRP  23  21.300   1.228  10.966
  742    HA   TRP  23           HA       TRP  23  19.298   2.922   9.950
  743    HB2  TRP  23           HB2      TRP  23  21.692   3.542  10.344
  744    HB3  TRP  23           HB1      TRP  23  22.111   2.632   8.890
  745    HD1  TRP  23           HD1      TRP  23  20.405   5.807  10.084
  746    HE1  TRP  23           HE1      TRP  23  19.970   7.340   8.056
  747    HE3  TRP  23           HE3      TRP  23  21.676   2.633   6.290
  748    HZ2  TRP  23           HZ2      TRP  23  20.138   7.232   5.202
  749    HZ3  TRP  23           HZ3      TRP  23  21.529   3.373   3.930
  750    HH2  TRP  23           HH2      TRP  23  20.763   5.666   3.381
  751    H    THR  24           HN       THR  24  21.121   0.271   8.469
  752    HA   THR  24           HA       THR  24  20.123   0.614   5.839
  753    HB   THR  24           HB       THR  24  21.263  -1.772   7.287
  754    HG1  THR  24           HG1      THR  24  22.203   0.010   5.299
  755   HG21  THR  24          HG21      THR  24  20.238  -1.499   4.462
  756   HG22  THR  24          HG22      THR  24  19.890  -2.765   5.641
  757   HG23  THR  24          HG23      THR  24  21.482  -2.672   4.889
  758    H    ILE  25           HN       ILE  25  19.016  -1.312   8.597
  759    HA   ILE  25           HA       ILE  25  16.939  -2.699   7.292
  760    HB   ILE  25           HB       ILE  25  17.257  -1.817  10.166
  761   HG12  ILE  25          HG12      ILE  25  17.476  -4.571   8.926
  762   HG13  ILE  25          HG11      ILE  25  18.865  -3.499   9.107
  763   HG21  ILE  25          HG21      ILE  25  15.143  -3.519   8.827
  764   HG22  ILE  25          HG22      ILE  25  14.910  -2.123   9.880
  765   HG23  ILE  25          HG23      ILE  25  15.499  -3.644  10.550
  766   HD11  ILE  25          HD11      ILE  25  18.288  -3.339  11.571
  767   HD12  ILE  25          HD12      ILE  25  18.832  -4.930  11.040
  768   HD13  ILE  25          HD13      ILE  25  17.114  -4.629  11.306
  769    H    GLY  26           HN       GLY  26  16.937   0.416   9.008
  770    HA2  GLY  26           HA2      GLY  26  14.176   0.965   8.744
  771    HA3  GLY  26           HA1      GLY  26  15.434   2.169   9.000
  772    H    HIS  27           HN       HIS  27  16.965   1.819   6.692
  773    HA   HIS  27           HA       HIS  27  15.652   3.417   4.827
  774    HB2  HIS  27           HB2      HIS  27  18.042   3.293   4.778
  775    HB3  HIS  27           HB1      HIS  27  18.008   1.545   4.536
  776    HD2  HIS  27           HD2      HIS  27  18.263   0.895   1.875
  777    HE1  HIS  27           HE1      HIS  27  16.750   4.470   0.217
  778    HE2  HIS  27           HE2      HIS  27  17.753   2.202  -0.328
  779    H    LEU  28           HN       LEU  28  16.089  -0.112   4.888
  780    HA   LEU  28           HA       LEU  28  14.685  -0.545   2.438
  781    HB2  LEU  28           HB2      LEU  28  15.862  -2.217   4.583
  782    HB3  LEU  28           HB1      LEU  28  14.535  -2.949   3.680
  783    HG   LEU  28           HG       LEU  28  16.836  -3.367   2.705
  784   HD11  LEU  28          HD11      LEU  28  15.068  -1.769   0.840
  785   HD12  LEU  28          HD12      LEU  28  14.611  -3.367   1.420
  786   HD13  LEU  28          HD13      LEU  28  16.072  -3.160   0.457
  787   HD21  LEU  28          HD21      LEU  28  16.672  -0.480   1.805
  788   HD22  LEU  28          HD22      LEU  28  18.033  -1.588   1.674
  789   HD23  LEU  28          HD23      LEU  28  17.567  -0.951   3.250
  790    H    ASN  29           HN       ASN  29  12.580  -0.804   2.044
  791    HA   ASN  29           HA       ASN  29  10.708  -0.242   4.172
  792    HB2  ASN  29           HB2      ASN  29  10.271  -0.904   1.249
  793    HB3  ASN  29           HB1      ASN  29   9.015  -0.374   2.367
  794   HD21  ASN  29          HD21      ASN  29  10.539   0.911  -0.102
  795   HD22  ASN  29          HD22      ASN  29  10.882   2.475   0.466
  796    H    GLN  30           HN       GLN  30   9.255  -1.614   5.104
  797    HA   GLN  30           HA       GLN  30   9.751  -4.480   4.715
  798    HB2  GLN  30           HB2      GLN  30   8.524  -2.824   6.888
  799    HB3  GLN  30           HB1      GLN  30   8.118  -4.536   6.768
  800    HG2  GLN  30           HG2      GLN  30  10.014  -4.386   8.229
  801    HG3  GLN  30           HG1      GLN  30  10.611  -5.006   6.690
  802   HE21  GLN  30          HE21      GLN  30  12.760  -4.129   6.900
  803   HE22  GLN  30          HE22      GLN  30  13.060  -2.460   6.883
  804    H    ILE  31           HN       ILE  31   8.476  -5.589   3.389
  805    HA   ILE  31           HA       ILE  31   5.697  -4.651   2.989
  806    HB   ILE  31           HB       ILE  31   7.460  -6.199   1.071
  807   HG12  ILE  31          HG12      ILE  31   6.473  -3.335   0.900
  808   HG13  ILE  31          HG11      ILE  31   8.084  -3.777   1.465
  809   HG21  ILE  31          HG21      ILE  31   4.736  -4.926   0.663
  810   HG22  ILE  31          HG22      ILE  31   4.993  -6.651   0.921
  811   HG23  ILE  31          HG23      ILE  31   5.645  -5.870  -0.517
  812   HD11  ILE  31          HD11      ILE  31   6.911  -4.384  -1.263
  813   HD12  ILE  31          HD12      ILE  31   8.480  -4.958  -0.697
  814   HD13  ILE  31          HD13      ILE  31   8.196  -3.230  -0.908
  815    H    LYS  32           HN       LYS  32   4.125  -5.988   3.608
  816    HA   LYS  32           HA       LYS  32   4.843  -8.731   4.390
  817    HB2  LYS  32           HB2      LYS  32   3.728  -7.366   6.092
  818    HB3  LYS  32           HB1      LYS  32   2.376  -7.084   4.996
  819    HG2  LYS  32           HG2      LYS  32   1.866  -9.473   4.950
  820    HG3  LYS  32           HG1      LYS  32   3.272  -9.815   5.959
  821    HD2  LYS  32           HD2      LYS  32   2.309  -8.502   7.795
  822    HD3  LYS  32           HD1      LYS  32   0.924  -8.083   6.786
  823    HE2  LYS  32           HE2      LYS  32   1.678 -10.945   7.412
  824    HE3  LYS  32           HE1      LYS  32   0.548 -10.018   8.398
  825    HZ1  LYS  32           HZ1      LYS  32  -0.000 -11.402   6.063
  826    HZ2  LYS  32           HZ2      LYS  32  -0.117  -9.759   5.653
  827    HZ3  LYS  32           HZ3      LYS  32  -1.047 -10.388   6.927
  828    H    ARG  33           HN       ARG  33   4.579 -10.194   2.827
  829    HA   ARG  33           HA       ARG  33   2.324  -9.879   0.950
  830    HB2  ARG  33           HB2      ARG  33   4.755 -10.115   0.131
  831    HB3  ARG  33           HB1      ARG  33   4.621 -11.802   0.628
  832    HG2  ARG  33           HG2      ARG  33   2.754 -12.168  -0.859
  833    HG3  ARG  33           HG1      ARG  33   2.657 -10.448  -1.237
  834    HD2  ARG  33           HD2      ARG  33   3.800 -11.640  -3.043
  835    HD3  ARG  33           HD1      ARG  33   4.919 -10.549  -2.230
  836    HE   ARG  33           HE       ARG  33   5.040 -13.133  -1.050
  837   HH11  ARG  33          HH11      ARG  33   5.914 -11.341  -3.900
  838   HH12  ARG  33          HH12      ARG  33   7.277 -12.333  -4.257
  839   HH21  ARG  33          HH21      ARG  33   6.839 -14.430  -1.534
  840   HH22  ARG  33          HH22      ARG  33   7.805 -14.077  -2.928
  841    H1   MET   1           HT1      MET   1  55.965   4.943   4.698
  842    H2   MET   1           HT2      MET   1  56.746   5.909   5.854
  843    H3   MET   1           HT3      MET   1  57.381   5.778   4.284
  844    HA   MET   1           HA       MET   1  54.835   7.087   5.070
  845    HB2  MET   1           HB2      MET   1  57.153   8.220   5.404
  846    HB3  MET   1           HB1      MET   1  57.186   8.323   3.643
  847    HG2  MET   1           HG2      MET   1  55.116   9.587   3.620
  848    HG3  MET   1           HG1      MET   1  54.915   9.365   5.358
  849    HE1  MET   1           HE1      MET   1  56.964   9.709   6.880
  850    HE2  MET   1           HE2      MET   1  55.912  11.097   7.149
  851    HE3  MET   1           HE3      MET   1  57.651  11.334   7.003
  852    H    PHE   2           HN       PHE   2  54.785   4.866   3.368
  853    HA   PHE   2           HA       PHE   2  54.789   5.906   0.634
  854    HB2  PHE   2           HB2      PHE   2  54.458   3.162   1.831
  855    HB3  PHE   2           HB1      PHE   2  54.088   3.480   0.137
  856    HD1  PHE   2           HD1      PHE   2  56.647   2.587   2.413
  857    HD2  PHE   2           HD2      PHE   2  55.946   4.827  -1.184
  858    HE1  PHE   2           HE1      PHE   2  59.060   2.449   1.857
  859    HE2  PHE   2           HE2      PHE   2  58.359   4.689  -1.740
  860    HZ   PHE   2           HZ       PHE   2  59.915   3.499  -0.219
  861    H    GLU   3           HN       GLU   3  52.567   4.773   3.120
  862    HA   GLU   3           HA       GLU   3  50.276   4.870   1.419
  863    HB2  GLU   3           HB2      GLU   3  48.993   4.435   3.453
  864    HB3  GLU   3           HB1      GLU   3  50.403   3.387   3.399
  865    HG2  GLU   3           HG2      GLU   3  51.617   4.945   4.875
  866    HG3  GLU   3           HG1      GLU   3  50.204   5.995   4.936
  867    HA   PRO   4           HA       PRO   4  49.032   9.092   1.607
  868    HB2  PRO   4           HB2      PRO   4  46.424   8.208   2.757
  869    HB3  PRO   4           HB1      PRO   4  46.750   9.163   1.299
  870    HG2  PRO   4           HG2      PRO   4  45.999   6.617   1.144
  871    HG3  PRO   4           HG1      PRO   4  47.179   7.308   0.015
  872    HD2  PRO   4           HD2      PRO   4  47.633   5.476   2.322
  873    HD3  PRO   4           HD1      PRO   4  48.482   5.576   0.765
  874    H    PHE   5           HN       PHE   5  48.103   7.180   4.460
  875    HA   PHE   5           HA       PHE   5  49.374   9.002   6.265
  876    HB2  PHE   5           HB2      PHE   5  46.567   9.423   5.638
  877    HB3  PHE   5           HB1      PHE   5  46.811   9.092   7.353
  878    HD1  PHE   5           HD1      PHE   5  46.914  11.593   4.840
  879    HD2  PHE   5           HD2      PHE   5  48.834  10.353   8.478
  880    HE1  PHE   5           HE1      PHE   5  47.787  13.892   5.163
  881    HE2  PHE   5           HE2      PHE   5  49.707  12.653   8.801
  882    HZ   PHE   5           HZ       PHE   5  49.179  14.425   7.141
  883    H    GLN   6           HN       GLN   6  46.454   6.982   6.561
  884    HA   GLN   6           HA       GLN   6  47.967   4.895   7.914
  885    HB2  GLN   6           HB2      GLN   6  46.292   6.856   9.329
  886    HB3  GLN   6           HB1      GLN   6  45.925   5.173   9.709
  887    HG2  GLN   6           HG2      GLN   6  48.189   4.737  10.366
  888    HG3  GLN   6           HG1      GLN   6  48.739   6.283   9.725
  889   HE21  GLN   6          HE21      GLN   6  49.496   6.166  12.231
  890   HE22  GLN   6          HE22      GLN   6  48.436   6.943  13.305
  891    H    ILE   7           HN       ILE   7  46.654   2.981   8.331
  892    HA   ILE   7           HA       ILE   7  45.026   2.267   6.161
  893    HB   ILE   7           HB       ILE   7  45.328   1.031   8.897
  894   HG12  ILE   7          HG12      ILE   7  46.347   0.091   6.204
  895   HG13  ILE   7          HG11      ILE   7  47.295   1.131   7.268
  896   HG21  ILE   7          HG21      ILE   7  43.197   0.301   8.069
  897   HG22  ILE   7          HG22      ILE   7  44.337  -1.001   7.725
  898   HG23  ILE   7          HG23      ILE   7  43.831   0.093   6.437
  899   HD11  ILE   7          HD11      ILE   7  47.372  -0.519   8.984
  900   HD12  ILE   7          HD12      ILE   7  47.709  -1.389   7.488
  901   HD13  ILE   7          HD13      ILE   7  46.108  -1.483   8.220
  902    H    LEU   8           HN       LEU   8  44.275   3.625   9.283
  903    HA   LEU   8           HA       LEU   8  41.462   3.114   9.250
  904    HB2  LEU   8           HB2      LEU   8  43.307   4.903  10.757
  905    HB3  LEU   8           HB1      LEU   8  41.599   5.350  10.752
  906    HG   LEU   8           HG       LEU   8  42.304   3.814  12.649
  907   HD11  LEU   8          HD11      LEU   8  40.254   2.626  12.591
  908   HD12  LEU   8          HD12      LEU   8  40.264   2.512  10.834
  909   HD13  LEU   8          HD13      LEU   8  39.941   4.059  11.616
  910   HD21  LEU   8          HD21      LEU   8  42.322   1.669  10.511
  911   HD22  LEU   8          HD22      LEU   8  42.834   1.541  12.191
  912   HD23  LEU   8          HD23      LEU   8  43.809   2.454  11.042
  913    H    SER   9           HN       SER   9  43.080   6.266   8.783
  914    HA   SER   9           HA       SER   9  40.958   7.671   7.738
  915    HB2  SER   9           HB2      SER   9  42.612   9.126   6.661
  916    HB3  SER   9           HB1      SER   9  43.160   8.666   8.270
  917    HG   SER   9           HG       SER   9  44.728   8.463   6.499
  918    H    ILE  10           HN       ILE  10  43.013   5.310   6.146
  919    HA   ILE  10           HA       ILE  10  42.129   5.856   3.484
  920    HB   ILE  10           HB       ILE  10  43.460   3.465   4.752
  921   HG12  ILE  10          HG12      ILE  10  44.533   5.404   2.697
  922   HG13  ILE  10          HG11      ILE  10  44.656   5.727   4.423
  923   HG21  ILE  10          HG21      ILE  10  42.219   2.589   2.899
  924   HG22  ILE  10          HG22      ILE  10  43.878   2.796   2.337
  925   HG23  ILE  10          HG23      ILE  10  42.639   3.968   1.885
  926   HD11  ILE  10          HD11      ILE  10  45.946   3.540   2.811
  927   HD12  ILE  10          HD12      ILE  10  45.667   3.301   4.530
  928   HD13  ILE  10          HD13      ILE  10  46.678   4.628   3.986
  929    H    CYS  11           HN       CYS  11  41.227   3.413   5.902
  930    HA   CYS  11           HA       CYS  11  39.303   2.063   4.353
  931    HB2  CYS  11           HB2      CYS  11  39.566   2.442   7.341
  932    HB3  CYS  11           HB1      CYS  11  38.353   1.396   6.606
  933    HG   CYS  11           HG       CYS  11  40.256  -0.240   6.820
  934    H    SER  12           HN       SER  12  38.937   4.751   6.675
  935    HA   SER  12           HA       SER  12  36.143   5.045   6.356
  936    HB2  SER  12           HB2      SER  12  38.279   6.984   7.256
  937    HB3  SER  12           HB1      SER  12  36.556   7.345   7.301
  938    HG   SER  12           HG       SER  12  38.004   5.994   9.060
  939    H    PHE  13           HN       PHE  13  38.894   6.227   4.544
  940    HA   PHE  13           HA       PHE  13  37.644   8.307   3.116
  941    HB2  PHE  13           HB2      PHE  13  40.071   7.992   3.115
  942    HB3  PHE  13           HB1      PHE  13  39.887   6.476   2.245
  943    HD1  PHE  13           HD1      PHE  13  39.425  10.141   2.012
  944    HD2  PHE  13           HD2      PHE  13  39.462   6.407  -0.110
  945    HE1  PHE  13           HE1      PHE  13  39.388  11.366  -0.144
  946    HE2  PHE  13           HE2      PHE  13  39.425   7.632  -2.266
  947    HZ   PHE  13           HZ       PHE  13  39.389  10.112  -2.283
  948    H    ILE  14           HN       ILE  14  38.095   4.870   2.271
  949    HA   ILE  14           HA       ILE  14  36.653   5.026  -0.181
  950    HB   ILE  14           HB       ILE  14  37.344   2.698   1.614
  951   HG12  ILE  14          HG12      ILE  14  38.420   3.508  -1.102
  952   HG13  ILE  14          HG11      ILE  14  39.181   3.969   0.422
  953   HG21  ILE  14          HG21      ILE  14  36.021   2.763  -1.112
  954   HG22  ILE  14          HG22      ILE  14  35.368   2.068   0.370
  955   HG23  ILE  14          HG23      ILE  14  36.752   1.317  -0.416
  956   HD11  ILE  14          HD11      ILE  14  40.252   1.949  -0.454
  957   HD12  ILE  14          HD12      ILE  14  38.688   1.138  -0.546
  958   HD13  ILE  14          HD13      ILE  14  39.370   1.561   1.024
  959    H    LEU  15           HN       LEU  15  35.741   4.156   3.122
  960    HA   LEU  15           HA       LEU  15  33.097   3.291   2.557
  961    HB2  LEU  15           HB2      LEU  15  34.502   4.336   4.994
  962    HB3  LEU  15           HB1      LEU  15  32.753   4.103   5.032
  963    HG   LEU  15           HG       LEU  15  34.600   1.929   4.051
  964   HD11  LEU  15          HD11      LEU  15  35.351   2.497   6.310
  965   HD12  LEU  15          HD12      LEU  15  34.463   0.974   6.349
  966   HD13  LEU  15          HD13      LEU  15  33.688   2.461   6.896
  967   HD21  LEU  15          HD21      LEU  15  32.653   0.532   4.817
  968   HD22  LEU  15          HD22      LEU  15  32.237   1.661   3.529
  969   HD23  LEU  15          HD23      LEU  15  31.790   2.023   5.195
  970    H    SER  16           HN       SER  16  34.096   6.409   3.986
  971    HA   SER  16           HA       SER  16  31.746   7.790   3.865
  972    HB2  SER  16           HB2      SER  16  33.774   8.766   4.813
  973    HB3  SER  16           HB1      SER  16  34.514   8.837   3.216
  974    HG   SER  16           HG       SER  16  33.586  10.712   3.081
  975    H    ALA  17           HN       ALA  17  34.035   7.168   1.218
  976    HA   ALA  17           HA       ALA  17  32.878   8.811  -0.748
  977    HB1  ALA  17           HB1      ALA  17  33.994   6.085  -1.373
  978    HB2  ALA  17           HB2      ALA  17  35.048   7.380  -0.804
  979    HB3  ALA  17           HB3      ALA  17  34.138   7.578  -2.301
  980    H    LEU  18           HN       LEU  18  32.339   5.309  -0.225
  981    HA   LEU  18           HA       LEU  18  30.135   5.158  -2.023
  982    HB2  LEU  18           HB2      LEU  18  31.407   3.384  -0.009
  983    HB3  LEU  18           HB1      LEU  18  29.718   3.042  -0.389
  984    HG   LEU  18           HG       LEU  18  31.424   1.843  -1.845
  985   HD11  LEU  18          HD11      LEU  18  29.644   3.715  -3.423
  986   HD12  LEU  18          HD12      LEU  18  28.986   2.397  -2.457
  987   HD13  LEU  18          HD13      LEU  18  30.077   2.050  -3.797
  988   HD21  LEU  18          HD21      LEU  18  32.670   3.067  -3.454
  989   HD22  LEU  18          HD22      LEU  18  32.878   3.985  -1.964
  990   HD23  LEU  18          HD23      LEU  18  31.739   4.538  -3.191
  991    H    HIS  19           HN       HIS  19  30.428   6.314   1.176
  992    HA   HIS  19           HA       HIS  19  27.781   5.820   2.070
  993    HB2  HIS  19           HB2      HIS  19  29.817   6.411   3.499
  994    HB3  HIS  19           HB1      HIS  19  29.554   8.079   2.992
  995    HD2  HIS  19           HD2      HIS  19  26.074   7.046   3.215
  996    HE1  HIS  19           HE1      HIS  19  27.049   7.774   7.260
  997    HE2  HIS  19           HE2      HIS  19  25.137   7.435   5.624
  998    H    PHE  20           HN       PHE  20  29.374   8.651   0.628
  999    HA   PHE  20           HA       PHE  20  26.955  10.207   0.597
 1000    HB2  PHE  20           HB2      PHE  20  29.730  10.676   0.186
 1001    HB3  PHE  20           HB1      PHE  20  28.880  11.200  -1.268
 1002    HD1  PHE  20           HD1      PHE  20  28.224  11.263   2.437
 1003    HD2  PHE  20           HD2      PHE  20  28.272  13.439  -1.266
 1004    HE1  PHE  20           HE1      PHE  20  27.440  13.294   3.621
 1005    HE2  PHE  20           HE2      PHE  20  27.488  15.471  -0.081
 1006    HZ   PHE  20           HZ       PHE  20  27.065  15.389   2.357
 1007    H    MET  21           HN       MET  21  28.453   7.888  -1.489
 1008    HA   MET  21           HA       MET  21  27.192   8.731  -3.919
 1009    HB2  MET  21           HB2      MET  21  28.466   6.144  -3.017
 1010    HB3  MET  21           HB1      MET  21  27.763   6.346  -4.622
 1011    HG2  MET  21           HG2      MET  21  29.867   8.202  -3.490
 1012    HG3  MET  21           HG1      MET  21  30.246   6.814  -4.508
 1013    HE1  MET  21           HE1      MET  21  29.382  10.930  -5.731
 1014    HE2  MET  21           HE2      MET  21  30.157  10.193  -4.332
 1015    HE3  MET  21           HE3      MET  21  28.406  10.371  -4.366
 1016    H    ALA  22           HN       ALA  22  26.557   5.911  -1.833
 1017    HA   ALA  22           HA       ALA  22  24.090   5.278  -3.085
 1018    HB1  ALA  22           HB1      ALA  22  24.732   4.507  -0.260
 1019    HB2  ALA  22           HB2      ALA  22  25.621   3.800  -1.608
 1020    HB3  ALA  22           HB3      ALA  22  23.873   3.584  -1.491
 1021    H    TRP  23           HN       TRP  23  24.904   7.137  -0.188
 1022    HA   TRP  23           HA       TRP  23  22.281   7.498   0.769
 1023    HB2  TRP  23           HB2      TRP  23  24.388   7.992   2.029
 1024    HB3  TRP  23           HB1      TRP  23  24.571   9.447   1.047
 1025    HD1  TRP  23           HD1      TRP  23  22.485   7.920   3.827
 1026    HE1  TRP  23           HE1      TRP  23  21.006   9.756   4.870
 1027    HE3  TRP  23           HE3      TRP  23  23.359  11.733   0.543
 1028    HZ2  TRP  23           HZ2      TRP  23  20.288  12.481   4.378
 1029    HZ3  TRP  23           HZ3      TRP  23  22.265  13.935   0.852
 1030    HH2  TRP  23           HH2      TRP  23  20.733  14.314   2.764
 1031    H    THR  24           HN       THR  24  24.228   9.348  -1.539
 1032    HA   THR  24           HA       THR  24  22.404  11.496  -1.859
 1033    HB   THR  24           HB       THR  24  24.582  10.394  -3.626
 1034    HG1  THR  24           HG1      THR  24  24.285  12.669  -1.969
 1035   HG21  THR  24          HG21      THR  24  22.688  12.703  -4.056
 1036   HG22  THR  24          HG22      THR  24  23.115  11.408  -5.176
 1037   HG23  THR  24          HG23      THR  24  24.290  12.667  -4.793
 1038    H    ILE  25           HN       ILE  25  22.823   8.411  -3.556
 1039    HA   ILE  25           HA       ILE  25  20.938   8.848  -5.608
 1040    HB   ILE  25           HB       ILE  25  21.878   6.314  -4.255
 1041   HG12  ILE  25          HG12      ILE  25  22.487   7.396  -7.016
 1042   HG13  ILE  25          HG11      ILE  25  23.482   7.775  -5.609
 1043   HG21  ILE  25          HG21      ILE  25  20.049   6.749  -6.627
 1044   HG22  ILE  25          HG22      ILE  25  19.752   5.765  -5.194
 1045   HG23  ILE  25          HG23      ILE  25  20.943   5.247  -6.388
 1046   HD11  ILE  25          HD11      ILE  25  23.688   5.270  -5.224
 1047   HD12  ILE  25          HD12      ILE  25  24.497   5.876  -6.670
 1048   HD13  ILE  25          HD13      ILE  25  22.945   5.047  -6.809
 1049    H    GLY  26           HN       GLY  26  20.581   7.418  -2.369
 1050    HA2  GLY  26           HA2      GLY  26  17.845   6.741  -2.581
 1051    HA3  GLY  26           HA1      GLY  26  18.719   7.008  -1.075
 1052    H    HIS  27           HN       HIS  27  19.472   9.678  -1.393
 1053    HA   HIS  27           HA       HIS  27  17.230  11.063  -0.472
 1054    HB2  HIS  27           HB2      HIS  27  19.408  11.927   0.016
 1055    HB3  HIS  27           HB1      HIS  27  19.813  12.044  -1.697
 1056    HD2  HIS  27           HD2      HIS  27  19.388  14.586  -2.662
 1057    HE1  HIS  27           HE1      HIS  27  16.462  15.821   0.122
 1058    HE2  HIS  27           HE2      HIS  27  17.853  16.548  -1.875
 1059    H    LEU  28           HN       LEU  28  18.665  10.941  -3.723
 1060    HA   LEU  28           HA       LEU  28  16.756  12.739  -4.862
 1061    HB2  LEU  28           HB2      LEU  28  18.983  11.043  -5.834
 1062    HB3  LEU  28           HB1      LEU  28  17.712  11.384  -7.008
 1063    HG   LEU  28           HG       LEU  28  19.602  13.071  -6.973
 1064   HD11  LEU  28          HD11      LEU  28  16.950  14.294  -6.177
 1065   HD12  LEU  28          HD12      LEU  28  17.188  13.505  -7.734
 1066   HD13  LEU  28          HD13      LEU  28  18.140  14.926  -7.308
 1067   HD21  LEU  28          HD21      LEU  28  18.333  14.022  -4.392
 1068   HD22  LEU  28          HD22      LEU  28  19.841  14.554  -5.127
 1069   HD23  LEU  28          HD23      LEU  28  19.735  12.953  -4.397
 1070    H    ASN  29           HN       ASN  29  14.804  12.367  -5.704
 1071    HA   ASN  29           HA       ASN  29  13.622   9.760  -5.318
 1072    HB2  ASN  29           HB2      ASN  29  12.497  12.311  -6.503
 1073    HB3  ASN  29           HB1      ASN  29  11.560  10.862  -6.147
 1074   HD21  ASN  29          HD21      ASN  29  11.769  13.767  -4.903
 1075   HD22  ASN  29          HD22      ASN  29  11.811  13.442  -3.238
 1076    H    GLN  30           HN       GLN  30  12.985   8.308  -6.859
 1077    HA   GLN  30           HA       GLN  30  14.153   8.687  -9.529
 1078    HB2  GLN  30           HB2      GLN  30  13.256   6.321  -7.920
 1079    HB3  GLN  30           HB1      GLN  30  13.337   6.188  -9.677
 1080    HG2  GLN  30           HG2      GLN  30  15.474   5.488  -8.851
 1081    HG3  GLN  30           HG1      GLN  30  15.703   7.104  -9.518
 1082   HE21  GLN  30          HE21      GLN  30  17.462   7.698  -8.110
 1083   HE22  GLN  30          HE22      GLN  30  17.252   7.902  -6.439
 1084    H    ILE  31           HN       ILE  31  12.907   9.407 -11.119
 1085    HA   ILE  31           HA       ILE  31   9.998   8.879 -10.990
 1086    HB   ILE  31           HB       ILE  31  11.438  11.196 -12.314
 1087   HG12  ILE  31          HG12      ILE  31   9.656  11.185  -9.856
 1088   HG13  ILE  31          HG11      ILE  31  11.418  11.179  -9.778
 1089   HG21  ILE  31          HG21      ILE  31   8.479  10.712 -11.851
 1090   HG22  ILE  31          HG22      ILE  31   9.293  10.460 -13.394
 1091   HG23  ILE  31          HG23      ILE  31   9.202  12.076 -12.703
 1092   HD11  ILE  31          HD11      ILE  31   9.690  13.302 -11.081
 1093   HD12  ILE  31          HD12      ILE  31  11.452  13.272 -11.132
 1094   HD13  ILE  31          HD13      ILE  31  10.620  13.475  -9.591
 1095    H    LYS  32           HN       LYS  32   9.163   7.678 -12.570
 1096    HA   LYS  32           HA       LYS  32  10.855   7.036 -14.887
 1097    HB2  LYS  32           HB2      LYS  32   9.986   5.136 -13.606
 1098    HB3  LYS  32           HB1      LYS  32   8.337   5.712 -13.851
 1099    HG2  LYS  32           HG2      LYS  32   8.559   5.437 -16.268
 1100    HG3  LYS  32           HG1      LYS  32  10.246   4.959 -16.080
 1101    HD2  LYS  32           HD2      LYS  32   9.574   2.984 -14.791
 1102    HD3  LYS  32           HD1      LYS  32   7.884   3.474 -14.896
 1103    HE2  LYS  32           HE2      LYS  32   9.597   2.974 -17.340
 1104    HE3  LYS  32           HE1      LYS  32   8.604   1.722 -16.593
 1105    HZ1  LYS  32           HZ1      LYS  32   7.799   3.650 -18.413
 1106    HZ2  LYS  32           HZ2      LYS  32   7.080   4.086 -16.939
 1107    HZ3  LYS  32           HZ3      LYS  32   6.820   2.540 -17.590
 1108    H    ARG  33           HN       ARG  33  10.555   8.359 -16.566
 1109    HA   ARG  33           HA       ARG  33   7.836   9.345 -17.140
 1110    HB2  ARG  33           HB2      ARG  33   9.850  10.930 -16.886
 1111    HB3  ARG  33           HB1      ARG  33  10.364  10.312 -18.456
 1112    HG2  ARG  33           HG2      ARG  33   8.315  11.045 -19.500
 1113    HG3  ARG  33           HG1      ARG  33   7.612  11.465 -17.937
 1114    HD2  ARG  33           HD2      ARG  33   8.422  13.481 -19.067
 1115    HD3  ARG  33           HD1      ARG  33   9.366  13.172 -17.612
 1116    HE   ARG  33           HE       ARG  33  10.608  11.954 -19.862
 1117   HH11  ARG  33          HH11      ARG  33   9.971  15.035 -18.374
 1118   HH12  ARG  33          HH12      ARG  33  11.379  15.782 -19.027
 1119   HH21  ARG  33          HH21      ARG  33  12.460  12.955 -20.713
 1120   HH22  ARG  33          HH22      ARG  33  12.789  14.616 -20.348
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  52.744  26.824   7.520
    2    H2   MET   1           HT2      MET   1  52.059  25.275   7.603
    3    H3   MET   1           HT3      MET   1  53.747  25.466   7.639
    4    HA   MET   1           HA       MET   1  52.771  24.975   9.841
    5    HB2  MET   1           HB2      MET   1  53.889  27.014  10.953
    6    HB3  MET   1           HB1      MET   1  54.893  26.023   9.894
    7    HG2  MET   1           HG2      MET   1  54.607  27.587   8.061
    8    HG3  MET   1           HG1      MET   1  53.445  28.528   8.995
    9    HE1  MET   1           HE1      MET   1  55.279  30.755  11.205
   10    HE2  MET   1           HE2      MET   1  54.257  29.382  11.625
   11    HE3  MET   1           HE3      MET   1  53.862  30.367  10.219
   12    H    PHE   2           HN       PHE   2  51.662  27.931   8.269
   13    HA   PHE   2           HA       PHE   2  50.136  29.029  10.337
   14    HB2  PHE   2           HB2      PHE   2  49.415  30.481   8.744
   15    HB3  PHE   2           HB1      PHE   2  50.635  29.700   7.738
   16    HD1  PHE   2           HD1      PHE   2  47.069  30.116   8.382
   17    HD2  PHE   2           HD2      PHE   2  49.982  27.873   6.158
   18    HE1  PHE   2           HE1      PHE   2  45.285  29.305   6.864
   19    HE2  PHE   2           HE2      PHE   2  48.194  27.062   4.639
   20    HZ   PHE   2           HZ       PHE   2  45.847  27.778   4.993
   21    H    GLU   3           HN       GLU   3  49.664  26.151   8.498
   22    HA   GLU   3           HA       GLU   3  46.896  25.920   8.476
   23    HB2  GLU   3           HB2      GLU   3  49.012  23.787   8.780
   24    HB3  GLU   3           HB1      GLU   3  47.308  23.449   8.479
   25    HG2  GLU   3           HG2      GLU   3  47.406  24.791   6.412
   26    HG3  GLU   3           HG1      GLU   3  49.115  25.111   6.705
   27    HA   PRO   4           HA       PRO   4  45.920  25.425  12.780
   28    HB2  PRO   4           HB2      PRO   4  43.479  24.222  12.580
   29    HB3  PRO   4           HB1      PRO   4  43.747  25.931  12.191
   30    HG2  PRO   4           HG2      PRO   4  43.428  23.606  10.378
   31    HG3  PRO   4           HG1      PRO   4  42.892  25.281  10.180
   32    HD2  PRO   4           HD2      PRO   4  45.144  24.199   8.969
   33    HD3  PRO   4           HD1      PRO   4  44.873  25.934   9.234
   34    H    PHE   5           HN       PHE   5  44.998  22.541  10.886
   35    HA   PHE   5           HA       PHE   5  46.395  20.869  12.876
   36    HB2  PHE   5           HB2      PHE   5  43.573  20.675  11.919
   37    HB3  PHE   5           HB1      PHE   5  44.456  19.175  12.204
   38    HD1  PHE   5           HD1      PHE   5  42.956  22.137  13.740
   39    HD2  PHE   5           HD2      PHE   5  45.363  18.652  14.447
   40    HE1  PHE   5           HE1      PHE   5  42.598  22.385  16.181
   41    HE2  PHE   5           HE2      PHE   5  45.006  18.898  16.888
   42    HZ   PHE   5           HZ       PHE   5  43.621  20.764  17.755
   43    H    GLN   6           HN       GLN   6  44.515  19.925  10.034
   44    HA   GLN   6           HA       GLN   6  46.895  19.473   8.437
   45    HB2  GLN   6           HB2      GLN   6  45.278  17.231   9.627
   46    HB3  GLN   6           HB1      GLN   6  46.148  17.020   8.107
   47    HG2  GLN   6           HG2      GLN   6  48.225  17.851   9.292
   48    HG3  GLN   6           HG1      GLN   6  47.314  17.763  10.800
   49   HE21  GLN   6          HE21      GLN   6  49.439  16.000   8.929
   50   HE22  GLN   6          HE22      GLN   6  49.018  14.438   9.442
   51    H    ILE   7           HN       ILE   7  46.347  18.707   6.264
   52    HA   ILE   7           HA       ILE   7  44.268  20.158   5.098
   53    HB   ILE   7           HB       ILE   7  44.721  18.861   3.070
   54   HG12  ILE   7          HG12      ILE   7  46.347  17.069   4.911
   55   HG13  ILE   7          HG11      ILE   7  44.835  16.624   4.122
   56   HG21  ILE   7          HG21      ILE   7  46.368  20.591   3.978
   57   HG22  ILE   7          HG22      ILE   7  47.027  19.430   2.826
   58   HG23  ILE   7          HG23      ILE   7  47.332  19.231   4.551
   59   HD11  ILE   7          HD11      ILE   7  47.507  17.180   2.836
   60   HD12  ILE   7          HD12      ILE   7  46.008  17.202   1.906
   61   HD13  ILE   7          HD13      ILE   7  46.520  15.724   2.719
   62    H    LEU   8           HN       LEU   8  44.340  16.909   6.392
   63    HA   LEU   8           HA       LEU   8  41.836  16.065   5.301
   64    HB2  LEU   8           HB2      LEU   8  43.619  14.501   6.100
   65    HB3  LEU   8           HB1      LEU   8  43.263  15.001   7.753
   66    HG   LEU   8           HG       LEU   8  40.859  14.321   7.335
   67   HD11  LEU   8          HD11      LEU   8  40.738  14.324   4.946
   68   HD12  LEU   8          HD12      LEU   8  40.620  12.633   5.430
   69   HD13  LEU   8          HD13      LEU   8  42.143  13.268   4.805
   70   HD21  LEU   8          HD21      LEU   8  43.044  12.226   7.114
   71   HD22  LEU   8          HD22      LEU   8  41.363  11.867   7.510
   72   HD23  LEU   8          HD23      LEU   8  42.333  12.857   8.600
   73    H    SER   9           HN       SER   9  42.851  17.691   8.208
   74    HA   SER   9           HA       SER   9  40.349  17.472   9.603
   75    HB2  SER   9           HB2      SER   9  42.699  19.332   9.980
   76    HB3  SER   9           HB1      SER   9  41.299  19.289  11.045
   77    HG   SER   9           HG       SER   9  43.432  17.629  10.921
   78    H    ILE  10           HN       ILE  10  41.867  19.947   7.567
   79    HA   ILE  10           HA       ILE  10  39.849  21.913   7.883
   80    HB   ILE  10           HB       ILE  10  41.848  21.433   5.664
   81   HG12  ILE  10          HG12      ILE  10  41.792  23.572   7.807
   82   HG13  ILE  10          HG11      ILE  10  42.625  22.032   8.027
   83   HG21  ILE  10          HG21      ILE  10  40.017  22.704   4.728
   84   HG22  ILE  10          HG22      ILE  10  41.321  23.836   5.083
   85   HG23  ILE  10          HG23      ILE  10  39.930  23.727   6.162
   86   HD11  ILE  10          HD11      ILE  10  44.051  22.466   6.112
   87   HD12  ILE  10          HD12      ILE  10  44.121  23.864   7.182
   88   HD13  ILE  10          HD13      ILE  10  43.143  23.926   5.717
   89    H    CYS  11           HN       CYS  11  40.356  19.382   5.435
   90    HA   CYS  11           HA       CYS  11  38.201  20.038   3.759
   91    HB2  CYS  11           HB2      CYS  11  39.541  17.394   4.355
   92    HB3  CYS  11           HB1      CYS  11  38.319  17.599   3.101
   93    HG   CYS  11           HG       CYS  11  39.938  18.916   1.695
   94    H    SER  12           HN       SER  12  38.366  17.668   6.442
   95    HA   SER  12           HA       SER  12  35.680  16.887   6.326
   96    HB2  SER  12           HB2      SER  12  37.559  17.004   8.690
   97    HB3  SER  12           HB1      SER  12  36.003  16.179   8.687
   98    HG   SER  12           HG       SER  12  38.394  15.533   7.415
   99    H    PHE  13           HN       PHE  13  37.245  19.574   8.010
  100    HA   PHE  13           HA       PHE  13  35.157  20.408   9.652
  101    HB2  PHE  13           HB2      PHE  13  37.663  21.347   9.025
  102    HB3  PHE  13           HB1      PHE  13  36.612  22.604   8.379
  103    HD1  PHE  13           HD1      PHE  13  37.567  20.737  11.419
  104    HD2  PHE  13           HD2      PHE  13  35.256  23.984   9.825
  105    HE1  PHE  13           HE1      PHE  13  37.175  21.582  13.716
  106    HE2  PHE  13           HE2      PHE  13  34.861  24.833  12.122
  107    HZ   PHE  13           HZ       PHE  13  35.822  23.631  14.068
  108    H    ILE  14           HN       ILE  14  35.935  21.669   6.389
  109    HA   ILE  14           HA       ILE  14  33.605  23.257   6.174
  110    HB   ILE  14           HB       ILE  14  34.153  23.277   3.726
  111   HG12  ILE  14          HG12      ILE  14  36.409  21.425   4.591
  112   HG13  ILE  14          HG11      ILE  14  35.050  20.961   3.582
  113   HG21  ILE  14          HG21      ILE  14  35.220  24.777   5.466
  114   HG22  ILE  14          HG22      ILE  14  36.179  24.536   4.006
  115   HG23  ILE  14          HG23      ILE  14  36.587  23.663   5.483
  116   HD11  ILE  14          HD11      ILE  14  35.735  22.761   1.959
  117   HD12  ILE  14          HD12      ILE  14  36.889  21.438   2.116
  118   HD13  ILE  14          HD13      ILE  14  37.198  22.976   2.921
  119    H    LEU  15           HN       LEU  15  34.315  19.938   5.146
  120    HA   LEU  15           HA       LEU  15  31.930  19.494   3.699
  121    HB2  LEU  15           HB2      LEU  15  33.824  17.605   5.120
  122    HB3  LEU  15           HB1      LEU  15  32.491  17.064   4.098
  123    HG   LEU  15           HG       LEU  15  34.583  19.005   3.098
  124   HD11  LEU  15          HD11      LEU  15  35.872  17.200   2.229
  125   HD12  LEU  15          HD12      LEU  15  34.617  16.021   2.611
  126   HD13  LEU  15          HD13      LEU  15  35.548  16.768   3.908
  127   HD21  LEU  15          HD21      LEU  15  32.521  18.889   1.793
  128   HD22  LEU  15          HD22      LEU  15  32.615  17.129   1.753
  129   HD23  LEU  15          HD23      LEU  15  33.816  18.098   0.898
  130    H    SER  16           HN       SER  16  32.692  19.448   7.079
  131    HA   SER  16           HA       SER  16  30.372  17.982   7.913
  132    HB2  SER  16           HB2      SER  16  32.254  19.783   9.438
  133    HB3  SER  16           HB1      SER  16  30.996  18.793  10.171
  134    HG   SER  16           HG       SER  16  32.033  16.968   9.415
  135    H    ALA  17           HN       ALA  17  31.282  21.418   7.801
  136    HA   ALA  17           HA       ALA  17  28.962  22.463   8.971
  137    HB1  ALA  17           HB1      ALA  17  29.518  24.530   7.594
  138    HB2  ALA  17           HB2      ALA  17  30.835  23.597   6.881
  139    HB3  ALA  17           HB3      ALA  17  30.824  23.927   8.613
  140    H    LEU  18           HN       LEU  18  29.692  21.732   5.556
  141    HA   LEU  18           HA       LEU  18  27.125  22.574   4.626
  142    HB2  LEU  18           HB2      LEU  18  29.181  22.494   3.211
  143    HB3  LEU  18           HB1      LEU  18  29.099  20.733   3.268
  144    HG   LEU  18           HG       LEU  18  26.749  20.904   2.354
  145   HD11  LEU  18          HD11      LEU  18  27.595  23.801   2.120
  146   HD12  LEU  18          HD12      LEU  18  26.140  23.156   2.880
  147   HD13  LEU  18          HD13      LEU  18  26.312  23.109   1.127
  148   HD21  LEU  18          HD21      LEU  18  27.494  21.170   0.079
  149   HD22  LEU  18          HD22      LEU  18  28.822  20.446   0.984
  150   HD23  LEU  18          HD23      LEU  18  28.860  22.164   0.587
  151    H    HIS  19           HN       HIS  19  28.449  19.651   5.910
  152    HA   HIS  19           HA       HIS  19  26.564  17.798   4.887
  153    HB2  HIS  19           HB2      HIS  19  28.495  16.835   5.802
  154    HB3  HIS  19           HB1      HIS  19  28.381  17.783   7.283
  155    HD2  HIS  19           HD2      HIS  19  26.682  16.717   9.251
  156    HE1  HIS  19           HE1      HIS  19  25.488  13.301   7.077
  157    HE2  HIS  19           HE2      HIS  19  25.411  14.438   9.347
  158    H    PHE  20           HN       PHE  20  26.701  19.485   8.016
  159    HA   PHE  20           HA       PHE  20  24.120  18.509   8.820
  160    HB2  PHE  20           HB2      PHE  20  26.310  19.787  10.064
  161    HB3  PHE  20           HB1      PHE  20  24.927  20.863  10.259
  162    HD1  PHE  20           HD1      PHE  20  26.364  17.602  11.105
  163    HD2  PHE  20           HD2      PHE  20  22.869  20.084  11.391
  164    HE1  PHE  20           HE1      PHE  20  25.458  16.121  12.875
  165    HE2  PHE  20           HE2      PHE  20  21.963  18.602  13.162
  166    HZ   PHE  20           HZ       PHE  20  23.261  16.623  13.905
  167    H    MET  21           HN       MET  21  25.303  21.233   7.013
  168    HA   MET  21           HA       MET  21  23.060  22.945   7.445
  169    HB2  MET  21           HB2      MET  21  25.380  22.826   5.607
  170    HB3  MET  21           HB1      MET  21  24.001  23.798   5.099
  171    HG2  MET  21           HG2      MET  21  24.056  25.000   7.258
  172    HG3  MET  21           HG1      MET  21  25.445  24.035   7.757
  173    HE1  MET  21           HE1      MET  21  26.649  26.231   8.307
  174    HE2  MET  21           HE2      MET  21  25.340  27.243   7.699
  175    HE3  MET  21           HE3      MET  21  26.993  27.536   7.164
  176    H    ALA  22           HN       ALA  22  24.021  21.039   4.584
  177    HA   ALA  22           HA       ALA  22  21.567  21.380   3.221
  178    HB1  ALA  22           HB1      ALA  22  23.887  19.515   2.915
  179    HB2  ALA  22           HB2      ALA  22  23.306  20.766   1.815
  180    HB3  ALA  22           HB3      ALA  22  22.418  19.252   1.974
  181    H    TRP  23           HN       TRP  23  22.742  18.864   5.404
  182    HA   TRP  23           HA       TRP  23  20.582  17.064   5.026
  183    HB2  TRP  23           HB2      TRP  23  22.784  16.498   6.073
  184    HB3  TRP  23           HB1      TRP  23  22.281  17.405   7.500
  185    HD1  TRP  23           HD1      TRP  23  20.462  14.802   5.275
  186    HE1  TRP  23           HE1      TRP  23  19.399  13.037   6.824
  187    HE3  TRP  23           HE3      TRP  23  21.996  16.572   9.814
  188    HZ2  TRP  23           HZ2      TRP  23  19.221  12.454   9.620
  189    HZ3  TRP  23           HZ3      TRP  23  21.364  15.395  11.901
  190    HH2  TRP  23           HH2      TRP  23  19.981  13.342  11.810
  191    H    THR  24           HN       THR  24  21.131  19.719   7.330
  192    HA   THR  24           HA       THR  24  18.839  19.259   8.933
  193    HB   THR  24           HB       THR  24  20.497  21.716   8.401
  194    HG1  THR  24           HG1      THR  24  21.281  19.864   9.635
  195   HG21  THR  24          HG21      THR  24  18.340  22.577   8.960
  196   HG22  THR  24          HG22      THR  24  19.287  22.623  10.446
  197   HG23  THR  24          HG23      THR  24  18.096  21.346  10.199
  198    H    ILE  25           HN       ILE  25  19.365  21.542   6.236
  199    HA   ILE  25           HA       ILE  25  16.773  22.617   6.237
  200    HB   ILE  25           HB       ILE  25  17.252  23.288   3.901
  201   HG12  ILE  25          HG12      ILE  25  19.766  21.624   4.269
  202   HG13  ILE  25          HG11      ILE  25  18.425  21.191   3.220
  203   HG21  ILE  25          HG21      ILE  25  19.626  23.562   5.769
  204   HG22  ILE  25          HG22      ILE  25  18.174  24.558   5.828
  205   HG23  ILE  25          HG23      ILE  25  19.239  24.632   4.424
  206   HD11  ILE  25          HD11      ILE  25  20.029  22.213   1.804
  207   HD12  ILE  25          HD12      ILE  25  20.292  23.535   2.940
  208   HD13  ILE  25          HD13      ILE  25  18.772  23.423   2.054
  209    H    GLY  26           HN       GLY  26  18.088  19.754   4.574
  210    HA2  GLY  26           HA2      GLY  26  15.780  19.160   3.058
  211    HA3  GLY  26           HA1      GLY  26  17.037  18.011   3.505
  212    H    HIS  27           HN       HIS  27  16.837  18.116   6.276
  213    HA   HIS  27           HA       HIS  27  14.797  16.273   6.797
  214    HB2  HIS  27           HB2      HIS  27  16.671  16.330   8.264
  215    HB3  HIS  27           HB1      HIS  27  16.430  18.041   8.618
  216    HD2  HIS  27           HD2      HIS  27  14.743  18.531  10.761
  217    HE1  HIS  27           HE1      HIS  27  13.198  14.623  11.182
  218    HE2  HIS  27           HE2      HIS  27  13.234  16.952  12.194
  219    H    LEU  28           HN       LEU  28  14.949  19.772   7.372
  220    HA   LEU  28           HA       LEU  28  12.514  20.049   8.740
  221    HB2  LEU  28           HB2      LEU  28  13.936  21.984   6.898
  222    HB3  LEU  28           HB1      LEU  28  12.608  22.414   7.976
  223    HG   LEU  28           HG       LEU  28  15.172  21.126   8.936
  224   HD11  LEU  28          HD11      LEU  28  15.593  23.361   7.917
  225   HD12  LEU  28          HD12      LEU  28  15.866  23.356   9.659
  226   HD13  LEU  28          HD13      LEU  28  14.387  24.055   9.001
  227   HD21  LEU  28          HD21      LEU  28  13.393  20.789  10.497
  228   HD22  LEU  28          HD22      LEU  28  12.799  22.436  10.279
  229   HD23  LEU  28          HD23      LEU  28  14.325  22.152  11.117
  230    H    ASN  29           HN       ASN  29  10.427  20.337   8.091
  231    HA   ASN  29           HA       ASN  29   9.834  19.669   5.288
  232    HB2  ASN  29           HB2      ASN  29   8.843  18.294   7.147
  233    HB3  ASN  29           HB1      ASN  29   7.937  19.723   7.641
  234   HD21  ASN  29          HD21      ASN  29   5.817  19.122   7.009
  235   HD22  ASN  29          HD22      ASN  29   5.393  18.723   5.415
  236    H    GLN  30           HN       GLN  30   9.404  21.310   3.971
  237    HA   GLN  30           HA       GLN  30   8.065  23.698   5.095
  238    HB2  GLN  30           HB2      GLN  30  10.032  23.507   2.803
  239    HB3  GLN  30           HB1      GLN  30   9.168  24.974   3.267
  240    HG2  GLN  30           HG2      GLN  30  10.153  24.720   5.577
  241    HG3  GLN  30           HG1      GLN  30  11.150  23.413   4.942
  242   HE21  GLN  30          HE21      GLN  30  13.175  24.559   5.153
  243   HE22  GLN  30          HE22      GLN  30  13.541  25.920   4.206
  244    H    ILE  31           HN       ILE  31   6.104  24.116   4.329
  245    HA   ILE  31           HA       ILE  31   5.374  23.120   1.648
  246    HB   ILE  31           HB       ILE  31   3.676  22.937   4.148
  247   HG12  ILE  31          HG12      ILE  31   4.719  20.719   2.369
  248   HG13  ILE  31          HG11      ILE  31   5.571  21.252   3.818
  249   HG21  ILE  31          HG21      ILE  31   2.139  21.695   2.558
  250   HG22  ILE  31          HG22      ILE  31   3.138  22.298   1.236
  251   HG23  ILE  31          HG23      ILE  31   2.260  23.430   2.263
  252   HD11  ILE  31          HD11      ILE  31   3.799  20.579   5.243
  253   HD12  ILE  31          HD12      ILE  31   3.951  19.263   4.079
  254   HD13  ILE  31          HD13      ILE  31   2.658  20.449   3.903
  255    H    LYS  32           HN       LYS  32   4.366  24.583   0.391
  256    HA   LYS  32           HA       LYS  32   3.999  27.267   1.404
  257    HB2  LYS  32           HB2      LYS  32   3.467  26.052  -1.317
  258    HB3  LYS  32           HB1      LYS  32   3.330  27.770  -0.941
  259    HG2  LYS  32           HG2      LYS  32   5.729  27.717  -0.174
  260    HG3  LYS  32           HG1      LYS  32   5.828  26.063  -0.779
  261    HD2  LYS  32           HD2      LYS  32   5.188  26.857  -3.034
  262    HD3  LYS  32           HD1      LYS  32   5.128  28.511  -2.426
  263    HE2  LYS  32           HE2      LYS  32   7.283  28.290  -3.414
  264    HE3  LYS  32           HE1      LYS  32   7.553  28.163  -1.676
  265    HZ1  LYS  32           HZ1      LYS  32   7.151  25.630  -2.212
  266    HZ2  LYS  32           HZ2      LYS  32   8.686  26.342  -2.365
  267    HZ3  LYS  32           HZ3      LYS  32   7.716  26.102  -3.739
  268    H    ARG  33           HN       ARG  33   2.279  27.477   2.736
  269    HA   ARG  33           HA       ARG  33  -0.305  26.327   1.920
  270    HB2  ARG  33           HB2      ARG  33  -1.023  26.787   4.206
  271    HB3  ARG  33           HB1      ARG  33   0.487  25.875   4.223
  272    HG2  ARG  33           HG2      ARG  33   1.743  27.995   4.511
  273    HG3  ARG  33           HG1      ARG  33   0.217  28.878   4.559
  274    HD2  ARG  33           HD2      ARG  33   0.935  26.638   6.463
  275    HD3  ARG  33           HD1      ARG  33   1.163  28.344   6.829
  276    HE   ARG  33           HE       ARG  33  -1.503  28.003   6.049
  277   HH11  ARG  33          HH11      ARG  33   0.661  26.979   8.587
  278   HH12  ARG  33          HH12      ARG  33  -0.594  26.841   9.767
  279   HH21  ARG  33          HH21      ARG  33  -3.124  27.814   7.616
  280   HH22  ARG  33          HH22      ARG  33  -2.722  27.310   9.223
  281    H1   MET   1           HT1      MET   1  44.674  21.117  32.418
  282    H2   MET   1           HT2      MET   1  44.527  20.853  30.748
  283    H3   MET   1           HT3      MET   1  45.992  21.415  31.399
  284    HA   MET   1           HA       MET   1  46.035  19.029  30.806
  285    HB2  MET   1           HB2      MET   1  46.852  18.314  33.144
  286    HB3  MET   1           HB1      MET   1  47.655  19.696  32.397
  287    HG2  MET   1           HG2      MET   1  46.317  21.248  33.696
  288    HG3  MET   1           HG1      MET   1  45.343  19.929  34.342
  289    HE1  MET   1           HE1      MET   1  47.134  18.433  37.129
  290    HE2  MET   1           HE2      MET   1  46.751  17.731  35.559
  291    HE3  MET   1           HE3      MET   1  45.629  18.867  36.304
  292    H    PHE   2           HN       PHE   2  43.663  19.990  33.234
  293    HA   PHE   2           HA       PHE   2  42.720  17.475  34.005
  294    HB2  PHE   2           HB2      PHE   2  41.108  18.651  35.093
  295    HB3  PHE   2           HB1      PHE   2  42.062  20.053  34.613
  296    HD1  PHE   2           HD1      PHE   2  38.989  18.167  34.073
  297    HD2  PHE   2           HD2      PHE   2  41.435  21.366  32.577
  298    HE1  PHE   2           HE1      PHE   2  37.089  18.977  32.704
  299    HE2  PHE   2           HE2      PHE   2  39.531  22.177  31.206
  300    HZ   PHE   2           HZ       PHE   2  37.359  20.982  31.269
  301    H    GLU   3           HN       GLU   3  42.458  19.129  30.991
  302    HA   GLU   3           HA       GLU   3  40.041  18.173  30.009
  303    HB2  GLU   3           HB2      GLU   3  42.638  18.722  28.566
  304    HB3  GLU   3           HB1      GLU   3  41.105  18.406  27.752
  305    HG2  GLU   3           HG2      GLU   3  40.088  20.322  28.926
  306    HG3  GLU   3           HG1      GLU   3  41.626  20.647  29.723
  307    HA   PRO   4           HA       PRO   4  40.826  13.826  29.550
  308    HB2  PRO   4           HB2      PRO   4  38.912  13.186  27.717
  309    HB3  PRO   4           HB1      PRO   4  38.537  13.584  29.404
  310    HG2  PRO   4           HG2      PRO   4  38.259  15.246  26.964
  311    HG3  PRO   4           HG1      PRO   4  37.247  15.181  28.414
  312    HD2  PRO   4           HD2      PRO   4  39.139  17.149  27.897
  313    HD3  PRO   4           HD1      PRO   4  38.502  16.751  29.508
  314    H    PHE   5           HN       PHE   5  40.144  15.377  26.406
  315    HA   PHE   5           HA       PHE   5  42.557  14.076  25.316
  316    HB2  PHE   5           HB2      PHE   5  39.752  13.972  24.293
  317    HB3  PHE   5           HB1      PHE   5  41.062  14.075  23.115
  318    HD1  PHE   5           HD1      PHE   5  39.434  11.999  25.649
  319    HD2  PHE   5           HD2      PHE   5  42.808  12.321  23.011
  320    HE1  PHE   5           HE1      PHE   5  39.904   9.583  25.955
  321    HE2  PHE   5           HE2      PHE   5  43.278   9.905  23.315
  322    HZ   PHE   5           HZ       PHE   5  41.826   8.534  24.787
  323    H    GLN   6           HN       GLN   6  40.138  16.100  23.704
  324    HA   GLN   6           HA       GLN   6  41.830  18.451  23.821
  325    HB2  GLN   6           HB2      GLN   6  41.434  16.848  21.304
  326    HB3  GLN   6           HB1      GLN   6  41.732  18.586  21.240
  327    HG2  GLN   6           HG2      GLN   6  43.775  18.189  22.683
  328    HG3  GLN   6           HG1      GLN   6  43.518  16.461  22.449
  329   HE21  GLN   6          HE21      GLN   6  45.251  19.025  21.217
  330   HE22  GLN   6          HE22      GLN   6  45.489  18.457  19.635
  331    H    ILE   7           HN       ILE   7  40.794  20.310  22.799
  332    HA   ILE   7           HA       ILE   7  38.118  20.609  23.535
  333    HB   ILE   7           HB       ILE   7  38.173  22.710  22.282
  334   HG12  ILE   7          HG12      ILE   7  40.770  21.636  21.127
  335   HG13  ILE   7          HG11      ILE   7  39.265  21.853  20.236
  336   HG21  ILE   7          HG21      ILE   7  39.482  22.385  24.451
  337   HG22  ILE   7          HG22      ILE   7  39.989  23.737  23.440
  338   HG23  ILE   7          HG23      ILE   7  40.924  22.242  23.447
  339   HD11  ILE   7          HD11      ILE   7  41.048  23.982  21.417
  340   HD12  ILE   7          HD12      ILE   7  39.376  24.317  20.966
  341   HD13  ILE   7          HD13      ILE   7  40.531  23.796  19.741
  342    H    LEU   8           HN       LEU   8  39.546  19.545  20.526
  343    HA   LEU   8           HA       LEU   8  37.162  19.703  18.956
  344    HB2  LEU   8           HB2      LEU   8  39.472  19.652  17.997
  345    HB3  LEU   8           HB1      LEU   8  39.596  17.962  18.488
  346    HG   LEU   8           HG       LEU   8  37.491  17.521  17.151
  347   HD11  LEU   8          HD11      LEU   8  36.543  19.709  16.960
  348   HD12  LEU   8          HD12      LEU   8  37.082  19.279  15.339
  349   HD13  LEU   8          HD13      LEU   8  38.045  20.380  16.324
  350   HD21  LEU   8          HD21      LEU   8  39.951  18.582  15.724
  351   HD22  LEU   8          HD22      LEU   8  38.689  17.625  14.946
  352   HD23  LEU   8          HD23      LEU   8  39.662  16.919  16.236
  353    H    SER   9           HN       SER   9  38.639  17.287  20.984
  354    HA   SER   9           HA       SER   9  36.953  15.107  20.181
  355    HB2  SER   9           HB2      SER   9  38.667  15.519  22.635
  356    HB3  SER   9           HB1      SER   9  37.801  14.029  22.282
  357    HG   SER   9           HG       SER   9  40.124  14.968  21.257
  358    H    ILE  10           HN       ILE  10  36.903  17.448  22.843
  359    HA   ILE  10           HA       ILE  10  34.660  16.368  24.194
  360    HB   ILE  10           HB       ILE  10  35.800  19.168  24.131
  361   HG12  ILE  10          HG12      ILE  10  35.904  17.070  26.312
  362   HG13  ILE  10          HG11      ILE  10  37.157  17.218  25.078
  363   HG21  ILE  10          HG21      ILE  10  33.480  19.346  24.786
  364   HG22  ILE  10          HG22      ILE  10  34.453  19.436  26.254
  365   HG23  ILE  10          HG23      ILE  10  33.618  17.939  25.840
  366   HD11  ILE  10          HD11      ILE  10  37.633  19.499  25.757
  367   HD12  ILE  10          HD12      ILE  10  37.686  18.470  27.187
  368   HD13  ILE  10          HD13      ILE  10  36.278  19.486  26.886
  369    H    CYS  11           HN       CYS  11  34.960  18.924  21.747
  370    HA   CYS  11           HA       CYS  11  32.260  19.700  21.667
  371    HB2  CYS  11           HB2      CYS  11  34.407  19.719  19.538
  372    HB3  CYS  11           HB1      CYS  11  32.816  20.448  19.318
  373    HG   CYS  11           HG       CYS  11  33.402  22.288  20.928
  374    H    SER  12           HN       SER  12  34.015  17.339  19.621
  375    HA   SER  12           HA       SER  12  31.795  16.523  18.122
  376    HB2  SER  12           HB2      SER  12  34.272  14.981  18.908
  377    HB3  SER  12           HB1      SER  12  33.111  14.458  17.690
  378    HG   SER  12           HG       SER  12  34.979  16.522  17.641
  379    H    PHE  13           HN       PHE  13  33.035  15.402  21.242
  380    HA   PHE  13           HA       PHE  13  31.511  13.101  21.578
  381    HB2  PHE  13           HB2      PHE  13  33.268  14.543  23.124
  382    HB3  PHE  13           HB1      PHE  13  31.749  14.726  24.001
  383    HD1  PHE  13           HD1      PHE  13  34.197  12.296  22.674
  384    HD2  PHE  13           HD2      PHE  13  30.660  12.841  25.048
  385    HE1  PHE  13           HE1      PHE  13  34.417   9.981  23.531
  386    HE2  PHE  13           HE2      PHE  13  30.879  10.525  25.906
  387    HZ   PHE  13           HZ       PHE  13  32.759   9.095  25.148
  388    H    ILE  14           HN       ILE  14  30.707  16.372  22.790
  389    HA   ILE  14           HA       ILE  14  28.103  15.691  23.657
  390    HB   ILE  14           HB       ILE  14  27.729  18.170  23.664
  391   HG12  ILE  14          HG12      ILE  14  30.565  18.232  22.559
  392   HG13  ILE  14          HG11      ILE  14  29.124  18.710  21.676
  393   HG21  ILE  14          HG21      ILE  14  28.875  16.870  25.510
  394   HG22  ILE  14          HG22      ILE  14  29.287  18.584  25.442
  395   HG23  ILE  14          HG23      ILE  14  30.413  17.381  24.815
  396   HD11  ILE  14          HD11      ILE  14  28.666  20.403  23.482
  397   HD12  ILE  14          HD12      ILE  14  30.124  20.714  22.541
  398   HD13  ILE  14          HD13      ILE  14  30.250  20.015  24.156
  399    H    LEU  15           HN       LEU  15  29.307  17.018  20.602
  400    HA   LEU  15           HA       LEU  15  26.790  17.543  19.421
  401    HB2  LEU  15           HB2      LEU  15  29.509  16.961  18.222
  402    HB3  LEU  15           HB1      LEU  15  28.112  17.460  17.270
  403    HG   LEU  15           HG       LEU  15  29.084  19.067  19.639
  404   HD11  LEU  15          HD11      LEU  15  30.434  20.404  18.205
  405   HD12  LEU  15          HD12      LEU  15  29.777  19.647  16.754
  406   HD13  LEU  15          HD13      LEU  15  30.857  18.739  17.810
  407   HD21  LEU  15          HD21      LEU  15  26.816  19.555  18.877
  408   HD22  LEU  15          HD22      LEU  15  27.376  19.690  17.211
  409   HD23  LEU  15          HD23      LEU  15  27.878  20.882  18.410
  410    H    SER  16           HN       SER  16  28.674  14.661  19.813
  411    HA   SER  16           HA       SER  16  27.306  13.106  17.824
  412    HB2  SER  16           HB2      SER  16  29.020  12.288  20.171
  413    HB3  SER  16           HB1      SER  16  28.431  11.191  18.925
  414    HG   SER  16           HG       SER  16  29.603  12.330  17.409
  415    H    ALA  17           HN       ALA  17  27.118  13.404  21.363
  416    HA   ALA  17           HA       ALA  17  25.162  11.451  21.806
  417    HB1  ALA  17           HB1      ALA  17  24.596  12.856  23.850
  418    HB2  ALA  17           HB2      ALA  17  25.781  14.026  23.269
  419    HB3  ALA  17           HB3      ALA  17  26.290  12.392  23.697
  420    H    LEU  18           HN       LEU  18  24.822  14.921  21.080
  421    HA   LEU  18           HA       LEU  18  21.963  14.850  21.118
  422    HB2  LEU  18           HB2      LEU  18  23.324  16.906  21.512
  423    HB3  LEU  18           HB1      LEU  18  23.764  16.891  19.803
  424    HG   LEU  18           HG       LEU  18  21.294  16.900  19.264
  425   HD11  LEU  18          HD11      LEU  18  21.158  17.310  22.260
  426   HD12  LEU  18          HD12      LEU  18  20.306  16.108  21.293
  427   HD13  LEU  18          HD13      LEU  18  19.856  17.807  21.180
  428   HD21  LEU  18          HD21      LEU  18  21.084  19.279  19.572
  429   HD22  LEU  18          HD22      LEU  18  22.793  18.935  19.305
  430   HD23  LEU  18          HD23      LEU  18  22.203  19.254  20.936
  431    H    HIS  19           HN       HIS  19  24.416  14.232  18.765
  432    HA   HIS  19           HA       HIS  19  22.891  14.582  16.401
  433    HB2  HIS  19           HB2      HIS  19  25.206  14.452  16.067
  434    HB3  HIS  19           HB1      HIS  19  25.361  12.995  17.043
  435    HD2  HIS  19           HD2      HIS  19  24.832  10.590  15.685
  436    HE1  HIS  19           HE1      HIS  19  23.957  12.323  11.936
  437    HE2  HIS  19           HE2      HIS  19  24.368  10.134  13.157
  438    H    PHE  20           HN       PHE  20  23.639  11.649  18.267
  439    HA   PHE  20           HA       PHE  20  21.892  10.016  16.672
  440    HB2  PHE  20           HB2      PHE  20  23.928   9.585  18.580
  441    HB3  PHE  20           HB1      PHE  20  22.459   8.871  19.248
  442    HD1  PHE  20           HD1      PHE  20  24.952   8.713  16.567
  443    HD2  PHE  20           HD2      PHE  20  21.236   7.113  18.014
  444    HE1  PHE  20           HE1      PHE  20  25.172   6.792  15.013
  445    HE2  PHE  20           HE2      PHE  20  21.458   5.194  16.460
  446    HZ   PHE  20           HZ       PHE  20  23.426   5.035  14.963
  447    H    MET  21           HN       MET  21  21.553  12.017  19.493
  448    HA   MET  21           HA       MET  21  19.221  10.757  20.548
  449    HB2  MET  21           HB2      MET  21  20.679  13.302  20.945
  450    HB3  MET  21           HB1      MET  21  18.997  13.250  21.469
  451    HG2  MET  21           HG2      MET  21  19.471  11.210  22.780
  452    HG3  MET  21           HG1      MET  21  21.157  11.273  22.267
  453    HE1  MET  21           HE1      MET  21  21.812  11.106  24.740
  454    HE2  MET  21           HE2      MET  21  20.146  11.174  25.313
  455    HE3  MET  21           HE3      MET  21  21.354  12.250  26.010
  456    H    ALA  22           HN       ALA  22  19.607  13.833  18.794
  457    HA   ALA  22           HA       ALA  22  16.837  14.226  18.357
  458    HB1  ALA  22           HB1      ALA  22  19.324  15.408  17.184
  459    HB2  ALA  22           HB2      ALA  22  18.068  16.182  18.150
  460    HB3  ALA  22           HB3      ALA  22  17.755  15.772  16.464
  461    H    TRP  23           HN       TRP  23  19.358  12.699  16.410
  462    HA   TRP  23           HA       TRP  23  17.799  12.347  14.065
  463    HB2  TRP  23           HB2      TRP  23  20.291  12.175  14.195
  464    HB3  TRP  23           HB1      TRP  23  20.093  10.631  15.023
  465    HD1  TRP  23           HD1      TRP  23  18.407  12.152  11.881
  466    HE1  TRP  23           HE1      TRP  23  18.500  10.395   9.998
  467    HE3  TRP  23           HE3      TRP  23  20.887   8.398  14.299
  468    HZ2  TRP  23           HZ2      TRP  23  19.491   7.747   9.574
  469    HZ3  TRP  23           HZ3      TRP  23  21.389   6.270  13.133
  470    HH2  TRP  23           HH2      TRP  23  20.694   5.939  10.775
  471    H    THR  24           HN       THR  24  18.357  10.294  16.916
  472    HA   THR  24           HA       THR  24  17.005   7.999  15.953
  473    HB   THR  24           HB       THR  24  17.609   8.996  18.730
  474    HG1  THR  24           HG1      THR  24  19.262   8.192  17.248
  475   HG21  THR  24          HG21      THR  24  15.639   7.671  19.000
  476   HG22  THR  24          HG22      THR  24  16.995   6.622  19.406
  477   HG23  THR  24          HG23      THR  24  16.204   6.473  17.837
  478    H    ILE  25           HN       ILE  25  15.888  10.614  18.109
  479    HA   ILE  25           HA       ILE  25  13.270   9.656  18.428
  480    HB   ILE  25           HB       ILE  25  12.689  11.982  19.051
  481   HG12  ILE  25          HG12      ILE  25  15.527  12.597  18.163
  482   HG13  ILE  25          HG11      ILE  25  14.079  13.114  17.314
  483   HG21  ILE  25          HG21      ILE  25  15.390  11.071  20.084
  484   HG22  ILE  25          HG22      ILE  25  13.835  10.466  20.650
  485   HG23  ILE  25          HG23      ILE  25  14.276  12.153  20.918
  486   HD11  ILE  25          HD11      ILE  25  14.735  14.969  18.641
  487   HD12  ILE  25          HD12      ILE  25  14.996  13.950  20.057
  488   HD13  ILE  25          HD13      ILE  25  13.358  14.245  19.472
  489    H    GLY  26           HN       GLY  26  14.661  11.777  15.933
  490    HA2  GLY  26           HA2      GLY  26  12.232  12.399  14.629
  491    HA3  GLY  26           HA1      GLY  26  13.834  12.473  13.902
  492    H    HIS  27           HN       HIS  27  14.600   9.810  14.131
  493    HA   HIS  27           HA       HIS  27  13.477   8.666  11.838
  494    HB2  HIS  27           HB2      HIS  27  15.652   7.961  12.501
  495    HB3  HIS  27           HB1      HIS  27  15.084   7.481  14.101
  496    HD2  HIS  27           HD2      HIS  27  14.194   4.862  14.251
  497    HE1  HIS  27           HE1      HIS  27  14.055   4.062  10.108
  498    HE2  HIS  27           HE2      HIS  27  13.792   3.044  12.419
  499    H    LEU  28           HN       LEU  28  12.840   8.050  15.274
  500    HA   LEU  28           HA       LEU  28  11.068   5.895  14.962
  501    HB2  LEU  28           HB2      LEU  28  11.150   8.049  17.087
  502    HB3  LEU  28           HB1      LEU  28  10.220   6.555  17.206
  503    HG   LEU  28           HG       LEU  28  13.209   6.617  16.737
  504   HD11  LEU  28          HD11      LEU  28  12.605   7.637  18.928
  505   HD12  LEU  28          HD12      LEU  28  13.460   6.106  19.114
  506   HD13  LEU  28          HD13      LEU  28  11.712   6.172  19.336
  507   HD21  LEU  28          HD21      LEU  28  12.263   4.538  16.032
  508   HD22  LEU  28          HD22      LEU  28  11.192   4.471  17.431
  509   HD23  LEU  28          HD23      LEU  28  12.928   4.240  17.637
  510    H    ASN  29           HN       ASN  29   8.891   5.747  14.627
  511    HA   ASN  29           HA       ASN  29   7.564   8.179  13.635
  512    HB2  ASN  29           HB2      ASN  29   7.718   6.143  12.167
  513    HB3  ASN  29           HB1      ASN  29   6.682   5.304  13.322
  514   HD21  ASN  29          HD21      ASN  29   4.733   5.162  12.128
  515   HD22  ASN  29          HD22      ASN  29   3.905   6.513  11.522
  516    H    GLN  30           HN       GLN  30   6.259   9.194  15.005
  517    HA   GLN  30           HA       GLN  30   4.788   7.580  17.002
  518    HB2  GLN  30           HB2      GLN  30   5.790  10.428  17.206
  519    HB3  GLN  30           HB1      GLN  30   4.774   9.631  18.407
  520    HG2  GLN  30           HG2      GLN  30   6.539   7.837  18.587
  521    HG3  GLN  30           HG1      GLN  30   7.571   8.834  17.563
  522   HE21  GLN  30          HE21      GLN  30   9.134   9.317  19.232
  523   HE22  GLN  30          HE22      GLN  30   8.746  10.280  20.576
  524    H    ILE  31           HN       ILE  31   2.650   7.579  16.814
  525    HA   ILE  31           HA       ILE  31   1.334   9.860  15.480
  526    HB   ILE  31           HB       ILE  31   0.749   6.927  15.005
  527   HG12  ILE  31          HG12      ILE  31   1.672   9.042  13.044
  528   HG13  ILE  31          HG11      ILE  31   2.795   7.975  13.887
  529   HG21  ILE  31          HG21      ILE  31  -0.838   7.910  13.286
  530   HG22  ILE  31          HG22      ILE  31  -0.579   9.477  14.051
  531   HG23  ILE  31          HG23      ILE  31  -1.319   8.162  14.964
  532   HD11  ILE  31          HD11      ILE  31   1.903   6.036  12.851
  533   HD12  ILE  31          HD12      ILE  31   1.999   7.224  11.552
  534   HD13  ILE  31          HD13      ILE  31   0.450   6.885  12.322
  535    H    LYS  32           HN       LYS  32  -0.418  10.620  16.524
  536    HA   LYS  32           HA       LYS  32  -1.139   9.444  19.065
  537    HB2  LYS  32           HB2      LYS  32  -2.234  11.840  17.574
  538    HB3  LYS  32           HB1      LYS  32  -2.703  11.376  19.210
  539    HG2  LYS  32           HG2      LYS  32  -0.276  11.517  19.866
  540    HG3  LYS  32           HG1      LYS  32   0.062  12.179  18.267
  541    HD2  LYS  32           HD2      LYS  32  -1.527  14.027  18.703
  542    HD3  LYS  32           HD1      LYS  32  -1.829  13.375  20.315
  543    HE2  LYS  32           HE2      LYS  32  -0.189  15.075  20.627
  544    HE3  LYS  32           HE1      LYS  32   0.697  13.553  20.698
  545    HZ1  LYS  32           HZ1      LYS  32   0.858  14.003  18.119
  546    HZ2  LYS  32           HZ2      LYS  32   1.979  14.661  19.213
  547    HZ3  LYS  32           HZ3      LYS  32   0.700  15.613  18.627
  548    H    ARG  33           HN       ARG  33  -2.268   7.581  18.885
  549    HA   ARG  33           HA       ARG  33  -4.542   7.465  17.018
  550    HB2  ARG  33           HB2      ARG  33  -4.506   5.056  17.412
  551    HB3  ARG  33           HB1      ARG  33  -2.896   5.614  16.953
  552    HG2  ARG  33           HG2      ARG  33  -2.265   5.712  19.351
  553    HG3  ARG  33           HG1      ARG  33  -3.858   5.090  19.781
  554    HD2  ARG  33           HD2      ARG  33  -1.922   3.652  17.953
  555    HD3  ARG  33           HD1      ARG  33  -2.063   3.329  19.677
  556    HE   ARG  33           HE       ARG  33  -4.627   3.119  18.572
  557   HH11  ARG  33          HH11      ARG  33  -1.514   1.559  18.345
  558   HH12  ARG  33          HH12      ARG  33  -2.181   0.015  17.949
  559   HH21  ARG  33          HH21      ARG  33  -5.471   1.085  18.054
  560   HH22  ARG  33          HH22      ARG  33  -4.405  -0.253  17.784
  561    H1   MET   1           HT1      MET   1  47.334  -4.876  27.240
  562    H2   MET   1           HT2      MET   1  46.756  -3.371  26.716
  563    H3   MET   1           HT3      MET   1  48.131  -3.458  27.710
  564    HA   MET   1           HA       MET   1  48.654  -3.007  25.349
  565    HB2  MET   1           HB2      MET   1  50.325  -4.965  25.196
  566    HB3  MET   1           HB1      MET   1  50.434  -3.919  26.613
  567    HG2  MET   1           HG2      MET   1  49.189  -5.511  27.956
  568    HG3  MET   1           HG1      MET   1  48.875  -6.517  26.543
  569    HE1  MET   1           HE1      MET   1  51.788  -8.606  25.945
  570    HE2  MET   1           HE2      MET   1  51.150  -7.296  24.955
  571    HE3  MET   1           HE3      MET   1  50.045  -8.317  25.871
  572    H    PHE   2           HN       PHE   2  46.988  -6.043  26.024
  573    HA   PHE   2           HA       PHE   2  47.079  -7.213  23.489
  574    HB2  PHE   2           HB2      PHE   2  45.626  -8.723  24.371
  575    HB3  PHE   2           HB1      PHE   2  45.949  -7.877  25.883
  576    HD1  PHE   2           HD1      PHE   2  43.519  -8.505  23.236
  577    HD2  PHE   2           HD2      PHE   2  44.375  -6.110  26.700
  578    HE1  PHE   2           HE1      PHE   2  41.139  -7.822  23.350
  579    HE2  PHE   2           HE2      PHE   2  41.993  -5.426  26.812
  580    HZ   PHE   2           HZ       PHE   2  40.376  -6.281  25.137
  581    H    GLU   3           HN       GLU   3  45.438  -4.386  24.584
  582    HA   GLU   3           HA       GLU   3  43.206  -4.331  22.930
  583    HB2  GLU   3           HB2      GLU   3  44.957  -2.065  23.895
  584    HB3  GLU   3           HB1      GLU   3  43.399  -1.838  23.100
  585    HG2  GLU   3           HG2      GLU   3  42.308  -3.190  24.850
  586    HG3  GLU   3           HG1      GLU   3  43.863  -3.401  25.653
  587    HA   PRO   4           HA       PRO   4  44.995  -3.858  18.892
  588    HB2  PRO   4           HB2      PRO   4  42.863  -2.815  17.546
  589    HB3  PRO   4           HB1      PRO   4  42.939  -4.508  18.070
  590    HG2  PRO   4           HG2      PRO   4  41.460  -2.226  19.253
  591    HG3  PRO   4           HG1      PRO   4  41.010  -3.934  19.142
  592    HD2  PRO   4           HD2      PRO   4  42.012  -2.717  21.429
  593    HD3  PRO   4           HD1      PRO   4  42.053  -4.463  21.109
  594    H    PHE   5           HN       PHE   5  42.959  -1.056  19.763
  595    HA   PHE   5           HA       PHE   5  45.176   0.719  18.963
  596    HB2  PHE   5           HB2      PHE   5  42.341   0.725  18.021
  597    HB3  PHE   5           HB1      PHE   5  43.131   2.280  18.279
  598    HD1  PHE   5           HD1      PHE   5  43.029  -0.759  16.243
  599    HD2  PHE   5           HD2      PHE   5  45.173   2.882  17.016
  600    HE1  PHE   5           HE1      PHE   5  44.232  -1.009  14.088
  601    HE2  PHE   5           HE2      PHE   5  46.375   2.633  14.862
  602    HZ   PHE   5           HZ       PHE   5  45.904   0.688  13.397
  603    H    GLN   6           HN       GLN   6  41.914   1.516  20.069
  604    HA   GLN   6           HA       GLN   6  42.820   2.100  22.763
  605    HB2  GLN   6           HB2      GLN   6  42.123   4.249  20.773
  606    HB3  GLN   6           HB1      GLN   6  41.887   4.499  22.503
  607    HG2  GLN   6           HG2      GLN   6  44.304   3.815  22.831
  608    HG3  GLN   6           HG1      GLN   6  44.480   3.858  21.077
  609   HE21  GLN   6          HE21      GLN   6  44.949   5.735  23.792
  610   HE22  GLN   6          HE22      GLN   6  44.833   7.273  23.080
  611    H    ILE   7           HN       ILE   7  41.031   2.811  24.145
  612    HA   ILE   7           HA       ILE   7  38.756   1.221  23.867
  613    HB   ILE   7           HB       ILE   7  37.821   2.524  25.717
  614   HG12  ILE   7          HG12      ILE   7  40.125   4.431  25.173
  615   HG13  ILE   7          HG11      ILE   7  38.420   4.774  24.879
  616   HG21  ILE   7          HG21      ILE   7  39.773   0.909  26.040
  617   HG22  ILE   7          HG22      ILE   7  39.542   2.102  27.318
  618   HG23  ILE   7          HG23      ILE   7  40.813   2.331  26.116
  619   HD11  ILE   7          HD11      ILE   7  39.808   4.375  27.529
  620   HD12  ILE   7          HD12      ILE   7  38.055   4.249  27.372
  621   HD13  ILE   7          HD13      ILE   7  38.867   5.765  26.985
  622    H    LEU   8           HN       LEU   8  39.409   4.482  22.778
  623    HA   LEU   8           HA       LEU   8  36.712   5.154  22.116
  624    HB2  LEU   8           HB2      LEU   8  38.524   6.834  22.503
  625    HB3  LEU   8           HB1      LEU   8  39.264   6.328  20.984
  626    HG   LEU   8           HG       LEU   8  37.059   6.850  19.851
  627   HD11  LEU   8          HD11      LEU   8  35.526   6.819  21.685
  628   HD12  LEU   8          HD12      LEU   8  35.630   8.504  21.179
  629   HD13  LEU   8          HD13      LEU   8  36.502   7.957  22.612
  630   HD21  LEU   8          HD21      LEU   8  38.550   9.078  21.275
  631   HD22  LEU   8          HD22      LEU   8  37.431   9.332  19.936
  632   HD23  LEU   8          HD23      LEU   8  38.915   8.414  19.683
  633    H    SER   9           HN       SER   9  39.363   3.622  20.456
  634    HA   SER   9           HA       SER   9  38.196   3.695  17.832
  635    HB2  SER   9           HB2      SER   9  40.404   1.996  19.000
  636    HB3  SER   9           HB1      SER   9  39.925   1.956  17.308
  637    HG   SER   9           HG       SER   9  41.450   3.755  18.637
  638    H    ILE  10           HN       ILE  10  38.319   1.304  20.447
  639    HA   ILE  10           HA       ILE  10  37.016  -0.786  19.043
  640    HB   ILE  10           HB       ILE  10  37.244  -0.196  22.000
  641   HG12  ILE  10          HG12      ILE  10  38.609  -2.316  20.322
  642   HG13  ILE  10          HG11      ILE  10  39.319  -0.727  20.604
  643   HG21  ILE  10          HG21      ILE  10  35.293  -1.588  21.690
  644   HG22  ILE  10          HG22      ILE  10  36.608  -2.634  22.225
  645   HG23  ILE  10          HG23      ILE  10  36.140  -2.604  20.524
  646   HD11  ILE  10          HD11      ILE  10  39.320  -1.093  23.005
  647   HD12  ILE  10          HD12      ILE  10  40.102  -2.471  22.232
  648   HD13  ILE  10          HD13      ILE  10  38.443  -2.611  22.811
  649    H    CYS  11           HN       CYS  11  35.799   1.752  21.221
  650    HA   CYS  11           HA       CYS  11  33.110   0.943  21.280
  651    HB2  CYS  11           HB2      CYS  11  34.386   3.671  21.531
  652    HB3  CYS  11           HB1      CYS  11  32.669   3.377  21.803
  653    HG   CYS  11           HG       CYS  11  33.185   2.155  23.940
  654    H    SER  12           HN       SER  12  34.725   3.345  19.166
  655    HA   SER  12           HA       SER  12  32.474   3.952  17.621
  656    HB2  SER  12           HB2      SER  12  35.401   3.978  16.870
  657    HB3  SER  12           HB1      SER  12  34.115   4.699  15.907
  658    HG   SER  12           HG       SER  12  35.204   5.483  18.349
  659    H    PHE  13           HN       PHE  13  34.884   1.384  17.301
  660    HA   PHE  13           HA       PHE  13  34.257   0.434  14.759
  661    HB2  PHE  13           HB2      PHE  13  35.929  -0.348  16.796
  662    HB3  PHE  13           HB1      PHE  13  34.773  -1.676  16.718
  663    HD1  PHE  13           HD1      PHE  13  37.264   0.273  14.812
  664    HD2  PHE  13           HD2      PHE  13  34.636  -3.122  14.787
  665    HE1  PHE  13           HE1      PHE  13  38.383  -0.575  12.769
  666    HE2  PHE  13           HE2      PHE  13  35.755  -3.974  12.742
  667    HZ   PHE  13           HZ       PHE  13  37.628  -2.699  11.734
  668    H    ILE  14           HN       ILE  14  32.982  -0.802  17.871
  669    HA   ILE  14           HA       ILE  14  31.087  -2.539  16.691
  670    HB   ILE  14           HB       ILE  14  30.052  -2.545  18.976
  671   HG12  ILE  14          HG12      ILE  14  32.265  -0.544  19.582
  672   HG13  ILE  14          HG11      ILE  14  30.547  -0.178  19.559
  673   HG21  ILE  14          HG21      ILE  14  32.033  -3.959  18.276
  674   HG22  ILE  14          HG22      ILE  14  31.904  -3.668  20.011
  675   HG23  ILE  14          HG23      ILE  14  33.069  -2.758  19.047
  676   HD11  ILE  14          HD11      ILE  14  30.221  -1.946  21.323
  677   HD12  ILE  14          HD12      ILE  14  31.162  -0.551  21.850
  678   HD13  ILE  14          HD13      ILE  14  31.979  -2.059  21.439
  679    H    LEU  15           HN       LEU  15  30.846   0.811  17.836
  680    HA   LEU  15           HA       LEU  15  28.050   1.087  17.540
  681    HB2  LEU  15           HB2      LEU  15  30.306   3.108  17.486
  682    HB3  LEU  15           HB1      LEU  15  28.599   3.553  17.483
  683    HG   LEU  15           HG       LEU  15  29.775   1.739  19.600
  684   HD11  LEU  15          HD11      LEU  15  30.179   3.612  21.012
  685   HD12  LEU  15          HD12      LEU  15  29.337   4.714  19.922
  686   HD13  LEU  15          HD13      LEU  15  30.902   4.045  19.463
  687   HD21  LEU  15          HD21      LEU  15  27.340   1.709  19.400
  688   HD22  LEU  15          HD22      LEU  15  27.289   3.471  19.430
  689   HD23  LEU  15          HD23      LEU  15  27.786   2.577  20.867
  690    H    SER  16           HN       SER  16  30.694   1.215  15.301
  691    HA   SER  16           HA       SER  16  29.271   2.536  13.189
  692    HB2  SER  16           HB2      SER  16  31.788   0.868  13.165
  693    HB3  SER  16           HB1      SER  16  31.174   1.782  11.790
  694    HG   SER  16           HG       SER  16  31.446   3.663  12.955
  695    H    ALA  17           HN       ALA  17  30.116  -0.836  13.934
  696    HA   ALA  17           HA       ALA  17  29.029  -2.014  11.636
  697    HB1  ALA  17           HB1      ALA  17  28.761  -4.055  13.129
  698    HB2  ALA  17           HB2      ALA  17  29.327  -3.049  14.463
  699    HB3  ALA  17           HB3      ALA  17  30.381  -3.360  13.084
  700    H    LEU  18           HN       LEU  18  27.515  -1.268  14.780
  701    HA   LEU  18           HA       LEU  18  24.958  -2.282  14.004
  702    HB2  LEU  18           HB2      LEU  18  25.738  -2.085  16.368
  703    HB3  LEU  18           HB1      LEU  18  25.610  -0.331  16.218
  704    HG   LEU  18           HG       LEU  18  23.196  -0.658  15.540
  705   HD11  LEU  18          HD11      LEU  18  23.890  -3.497  16.328
  706   HD12  LEU  18          HD12      LEU  18  23.156  -2.940  14.824
  707   HD13  LEU  18          HD13      LEU  18  22.231  -2.896  16.323
  708   HD21  LEU  18          HD21      LEU  18  22.435  -0.895  17.813
  709   HD22  LEU  18          HD22      LEU  18  24.000  -0.083  17.867
  710   HD23  LEU  18          HD23      LEU  18  23.883  -1.798  18.259
  711    H    HIS  19           HN       HIS  19  26.621   0.732  13.684
  712    HA   HIS  19           HA       HIS  19  24.400   2.449  13.308
  713    HB2  HIS  19           HB2      HIS  19  26.431   3.543  13.712
  714    HB3  HIS  19           HB1      HIS  19  27.290   2.605  12.491
  715    HD2  HIS  19           HD2      HIS  19  27.058   3.580   9.864
  716    HE1  HIS  19           HE1      HIS  19  24.606   6.893  10.777
  717    HE2  HIS  19           HE2      HIS  19  25.975   5.774   8.954
  718    H    PHE  20           HN       PHE  20  26.488   0.809  10.946
  719    HA   PHE  20           HA       PHE  20  24.863   1.626   8.723
  720    HB2  PHE  20           HB2      PHE  20  27.430   0.504   9.085
  721    HB3  PHE  20           HB1      PHE  20  26.509  -0.660   8.133
  722    HD1  PHE  20           HD1      PHE  20  27.978   2.696   8.211
  723    HD2  PHE  20           HD2      PHE  20  25.500  -0.006   5.972
  724    HE1  PHE  20           HE1      PHE  20  28.209   4.141   6.208
  725    HE2  PHE  20           HE2      PHE  20  25.732   1.439   3.970
  726    HZ   PHE  20           HZ       PHE  20  27.076   3.515   4.090
  727    H    MET  21           HN       MET  21  24.870  -1.036  10.962
  728    HA   MET  21           HA       MET  21  23.440  -2.882   9.320
  729    HB2  MET  21           HB2      MET  21  24.175  -2.634  12.178
  730    HB3  MET  21           HB1      MET  21  22.826  -3.696  11.785
  731    HG2  MET  21           HG2      MET  21  24.236  -4.874  10.133
  732    HG3  MET  21           HG1      MET  21  25.590  -3.818  10.536
  733    HE1  MET  21           HE1      MET  21  27.002  -5.928  10.891
  734    HE2  MET  21           HE2      MET  21  25.649  -7.025  10.623
  735    HE3  MET  21           HE3      MET  21  26.661  -7.217  12.052
  736    H    ALA  22           HN       ALA  22  22.375  -0.943  12.122
  737    HA   ALA  22           HA       ALA  22  19.619  -1.453  11.745
  738    HB1  ALA  22           HB1      ALA  22  21.178   0.553  13.325
  739    HB2  ALA  22           HB2      ALA  22  20.123  -0.740  13.894
  740    HB3  ALA  22           HB3      ALA  22  19.428   0.716  13.184
  741    H    TRP  23           HN       TRP  23  21.728   1.153  10.632
  742    HA   TRP  23           HA       TRP  23  19.679   2.808   9.577
  743    HB2  TRP  23           HB2      TRP  23  22.031   3.522  10.047
  744    HB3  TRP  23           HB1      TRP  23  22.541   2.598   8.634
  745    HD1  TRP  23           HD1      TRP  23  19.606   5.059   9.235
  746    HE1  TRP  23           HE1      TRP  23  19.593   6.768   7.305
  747    HE3  TRP  23           HE3      TRP  23  23.661   3.434   6.587
  748    HZ2  TRP  23           HZ2      TRP  23  21.101   7.366   4.951
  749    HZ3  TRP  23           HZ3      TRP  23  24.348   4.590   4.506
  750    HH2  TRP  23           HH2      TRP  23  23.074   6.552   3.684
  751    H    THR  24           HN       THR  24  21.653   0.215   8.149
  752    HA   THR  24           HA       THR  24  20.768   0.542   5.478
  753    HB   THR  24           HB       THR  24  21.907  -1.809   6.976
  754    HG1  THR  24           HG1      THR  24  23.166   0.107   6.400
  755   HG21  THR  24          HG21      THR  24  20.573  -2.799   5.259
  756   HG22  THR  24          HG22      THR  24  22.226  -2.774   4.646
  757   HG23  THR  24          HG23      THR  24  21.059  -1.577   4.084
  758    H    ILE  25           HN       ILE  25  19.691  -1.728   8.017
  759    HA   ILE  25           HA       ILE  25  17.688  -2.967   6.491
  760    HB   ILE  25           HB       ILE  25  16.701  -3.628   8.664
  761   HG12  ILE  25          HG12      ILE  25  18.830  -1.803   9.832
  762   HG13  ILE  25          HG11      ILE  25  17.106  -1.465   9.847
  763   HG21  ILE  25          HG21      ILE  25  19.731  -3.731   8.607
  764   HG22  ILE  25          HG22      ILE  25  18.666  -4.819   7.722
  765   HG23  ILE  25          HG23      ILE  25  18.676  -4.835   9.485
  766   HD11  ILE  25          HD11      ILE  25  17.593  -2.396  11.977
  767   HD12  ILE  25          HD12      ILE  25  18.550  -3.694  11.265
  768   HD13  ILE  25          HD13      ILE  25  16.798  -3.675  11.059
  769    H    GLY  26           HN       GLY  26  17.571  -0.040   8.521
  770    HA2  GLY  26           HA2      GLY  26  14.787   0.390   8.322
  771    HA3  GLY  26           HA1      GLY  26  15.992   1.622   8.687
  772    H    HIS  27           HN       HIS  27  17.509   1.534   6.359
  773    HA   HIS  27           HA       HIS  27  16.095   3.245   4.659
  774    HB2  HIS  27           HB2      HIS  27  18.474   3.323   4.618
  775    HB3  HIS  27           HB1      HIS  27  18.593   1.603   4.242
  776    HD2  HIS  27           HD2      HIS  27  18.569   1.028   1.533
  777    HE1  HIS  27           HE1      HIS  27  17.374   4.832   0.146
  778    HE2  HIS  27           HE2      HIS  27  18.143   2.520  -0.568
  779    H    LEU  28           HN       LEU  28  16.762  -0.229   4.397
  780    HA   LEU  28           HA       LEU  28  15.662  -0.648   1.849
  781    HB2  LEU  28           HB2      LEU  28  15.793  -2.506   4.235
  782    HB3  LEU  28           HB1      LEU  28  15.409  -3.010   2.588
  783    HG   LEU  28           HG       LEU  28  17.956  -1.551   3.324
  784   HD11  LEU  28          HD11      LEU  28  17.808  -3.762   4.462
  785   HD12  LEU  28          HD12      LEU  28  19.071  -3.725   3.232
  786   HD13  LEU  28          HD13      LEU  28  17.534  -4.523   2.895
  787   HD21  LEU  28          HD21      LEU  28  17.461  -1.314   0.998
  788   HD22  LEU  28          HD22      LEU  28  16.950  -2.998   0.866
  789   HD23  LEU  28          HD23      LEU  28  18.653  -2.609   1.105
  790    H    ASN  29           HN       ASN  29  13.623  -1.075   1.120
  791    HA   ASN  29           HA       ASN  29  11.427  -0.471   2.983
  792    HB2  ASN  29           HB2      ASN  29  11.678   0.857   0.864
  793    HB3  ASN  29           HB1      ASN  29  11.336  -0.621  -0.034
  794   HD21  ASN  29          HD21      ASN  29   9.233  -0.172  -0.822
  795   HD22  ASN  29          HD22      ASN  29   7.911   0.185   0.181
  796    H    GLN  30           HN       GLN  30  10.383  -2.149   3.825
  797    HA   GLN  30           HA       GLN  30  10.127  -4.605   2.195
  798    HB2  GLN  30           HB2      GLN  30  10.299  -4.313   5.202
  799    HB3  GLN  30           HB1      GLN  30   9.973  -5.826   4.357
  800    HG2  GLN  30           HG2      GLN  30  12.136  -5.493   3.100
  801    HG3  GLN  30           HG1      GLN  30  12.474  -4.128   4.163
  802   HE21  GLN  30          HE21      GLN  30  14.275  -5.135   5.257
  803   HE22  GLN  30          HE22      GLN  30  14.074  -6.479   6.275
  804    H    ILE  31           HN       ILE  31   8.128  -5.158   1.641
  805    HA   ILE  31           HA       ILE  31   5.876  -4.231   3.308
  806    HB   ILE  31           HB       ILE  31   6.021  -4.133   0.286
  807   HG12  ILE  31          HG12      ILE  31   5.657  -1.871   2.267
  808   HG13  ILE  31          HG11      ILE  31   7.237  -2.337   1.638
  809   HG21  ILE  31          HG21      ILE  31   3.769  -3.004   0.592
  810   HG22  ILE  31          HG22      ILE  31   3.802  -3.556   2.266
  811   HG23  ILE  31          HG23      ILE  31   3.784  -4.730   0.952
  812   HD11  ILE  31          HD11      ILE  31   6.645  -1.761  -0.585
  813   HD12  ILE  31          HD12      ILE  31   5.992  -0.449   0.396
  814   HD13  ILE  31          HD13      ILE  31   4.923  -1.716  -0.205
  815    H    LYS  32           HN       LYS  32   4.400  -5.769   3.752
  816    HA   LYS  32           HA       LYS  32   4.867  -8.460   2.805
  817    HB2  LYS  32           HB2      LYS  32   2.736  -7.307   4.619
  818    HB3  LYS  32           HB1      LYS  32   2.951  -9.027   4.289
  819    HG2  LYS  32           HG2      LYS  32   5.318  -8.815   5.119
  820    HG3  LYS  32           HG1      LYS  32   4.941  -7.163   5.610
  821    HD2  LYS  32           HD2      LYS  32   3.117  -8.015   7.050
  822    HD3  LYS  32           HD1      LYS  32   3.527  -9.665   6.580
  823    HE2  LYS  32           HE2      LYS  32   4.635  -9.318   8.658
  824    HE3  LYS  32           HE1      LYS  32   5.891  -9.159   7.430
  825    HZ1  LYS  32           HZ1      LYS  32   5.104  -6.660   7.538
  826    HZ2  LYS  32           HZ2      LYS  32   6.277  -7.275   8.601
  827    HZ3  LYS  32           HZ3      LYS  32   4.665  -7.110   9.113
  828    H    ARG  33           HN       ARG  33   4.311  -8.767   0.714
  829    HA   ARG  33           HA       ARG  33   1.697  -7.790  -0.223
  830    HB2  ARG  33           HB2      ARG  33   2.527  -8.275  -2.468
  831    HB3  ARG  33           HB1      ARG  33   3.687  -7.267  -1.602
  832    HG2  ARG  33           HG2      ARG  33   4.984  -9.299  -1.009
  833    HG3  ARG  33           HG1      ARG  33   3.847 -10.277  -1.938
  834    HD2  ARG  33           HD2      ARG  33   5.438  -7.977  -3.095
  835    HD3  ARG  33           HD1      ARG  33   5.937  -9.662  -3.197
  836    HE   ARG  33           HE       ARG  33   3.325  -9.499  -4.190
  837   HH11  ARG  33          HH11      ARG  33   6.519  -8.317  -4.945
  838   HH12  ARG  33          HH12      ARG  33   6.223  -8.247  -6.646
  839   HH21  ARG  33          HH21      ARG  33   2.968  -9.401  -6.421
  840   HH22  ARG  33          HH22      ARG  33   4.228  -8.857  -7.479
  841    H1   MET   1           HT1      MET   1  55.173   0.590   2.364
  842    H2   MET   1           HT2      MET   1  54.041   0.857   3.600
  843    H3   MET   1           HT3      MET   1  55.632   0.398   3.984
  844    HA   MET   1           HA       MET   1  55.183   2.786   4.363
  845    HB2  MET   1           HB2      MET   1  57.198   3.539   2.942
  846    HB3  MET   1           HB1      MET   1  57.466   2.226   4.089
  847    HG2  MET   1           HG2      MET   1  57.258   0.569   2.328
  848    HG3  MET   1           HG1      MET   1  56.796   1.809   1.163
  849    HE1  MET   1           HE1      MET   1  59.815   3.405  -0.077
  850    HE2  MET   1           HE2      MET   1  58.536   4.094   0.918
  851    HE3  MET   1           HE3      MET   1  58.141   2.874  -0.289
  852    H    PHE   2           HN       PHE   2  54.791   1.634   1.051
  853    HA   PHE   2           HA       PHE   2  54.366   4.068  -0.254
  854    HB2  PHE   2           HB2      PHE   2  53.793   2.769  -2.029
  855    HB3  PHE   2           HB1      PHE   2  54.343   1.443  -1.005
  856    HD1  PHE   2           HD1      PHE   2  51.463   3.106  -2.503
  857    HD2  PHE   2           HD2      PHE   2  52.692   0.105   0.316
  858    HE1  PHE   2           HE1      PHE   2  49.168   2.168  -2.501
  859    HE2  PHE   2           HE2      PHE   2  50.393  -0.831   0.318
  860    HZ   PHE   2           HZ       PHE   2  48.632   0.201  -1.091
  861    H    GLU   3           HN       GLU   3  52.441   2.424   2.087
  862    HA   GLU   3           HA       GLU   3  49.870   3.210   1.383
  863    HB2  GLU   3           HB2      GLU   3  51.106   2.860   4.117
  864    HB3  GLU   3           HB1      GLU   3  49.378   3.066   3.834
  865    HG2  GLU   3           HG2      GLU   3  49.377   1.074   2.379
  866    HG3  GLU   3           HG1      GLU   3  51.101   0.860   2.678
  867    HA   PRO   4           HA       PRO   4  49.986   7.607   1.989
  868    HB2  PRO   4           HB2      PRO   4  47.323   8.117   2.293
  869    HB3  PRO   4           HB1      PRO   4  48.053   7.687   0.736
  870    HG2  PRO   4           HG2      PRO   4  46.472   6.016   2.607
  871    HG3  PRO   4           HG1      PRO   4  46.515   6.007   0.838
  872    HD2  PRO   4           HD2      PRO   4  47.834   4.175   2.447
  873    HD3  PRO   4           HD1      PRO   4  48.272   4.537   0.765
  874    H    PHE   5           HN       PHE   5  47.640   6.050   4.181
  875    HA   PHE   5           HA       PHE   5  48.855   7.521   6.433
  876    HB2  PHE   5           HB2      PHE   5  45.997   7.430   5.571
  877    HB3  PHE   5           HB1      PHE   5  46.341   7.431   7.301
  878    HD1  PHE   5           HD1      PHE   5  46.448   9.368   4.198
  879    HD2  PHE   5           HD2      PHE   5  47.577   9.305   8.341
  880    HE1  PHE   5           HE1      PHE   5  46.874  11.812   4.119
  881    HE2  PHE   5           HE2      PHE   5  48.004  11.746   8.264
  882    HZ   PHE   5           HZ       PHE   5  47.650  13.003   6.157
  883    H    GLN   6           HN       GLN   6  46.064   5.343   6.381
  884    HA   GLN   6           HA       GLN   6  47.609   3.117   7.414
  885    HB2  GLN   6           HB2      GLN   6  45.698   4.706   9.113
  886    HB3  GLN   6           HB1      GLN   6  45.996   2.996   9.429
  887    HG2  GLN   6           HG2      GLN   6  48.469   3.532   9.471
  888    HG3  GLN   6           HG1      GLN   6  48.028   5.239   9.416
  889   HE21  GLN   6          HE21      GLN   6  48.812   2.813  11.567
  890   HE22  GLN   6          HE22      GLN   6  48.028   3.413  12.948
  891    H    ILE   7           HN       ILE   7  46.265   1.196   7.711
  892    HA   ILE   7           HA       ILE   7  44.586   0.701   5.536
  893    HB   ILE   7           HB       ILE   7  43.986  -1.382   6.678
  894   HG12  ILE   7          HG12      ILE   7  45.324  -0.116   9.097
  895   HG13  ILE   7          HG11      ILE   7  43.597  -0.430   8.928
  896   HG21  ILE   7          HG21      ILE   7  46.310  -0.986   5.697
  897   HG22  ILE   7          HG22      ILE   7  46.188  -2.288   6.881
  898   HG23  ILE   7          HG23      ILE   7  46.862  -0.726   7.351
  899   HD11  ILE   7          HD11      ILE   7  45.838  -2.439   9.149
  900   HD12  ILE   7          HD12      ILE   7  44.249  -2.887   8.530
  901   HD13  ILE   7          HD13      ILE   7  44.413  -2.273  10.175
  902    H    LEU   8           HN       LEU   8  43.866   1.888   8.748
  903    HA   LEU   8           HA       LEU   8  41.029   1.570   8.588
  904    HB2  LEU   8           HB2      LEU   8  42.298   1.799  10.731
  905    HB3  LEU   8           HB1      LEU   8  42.602   3.488  10.328
  906    HG   LEU   8           HG       LEU   8  40.095   3.786  10.121
  907   HD11  LEU   8          HD11      LEU   8  39.339   1.539   9.815
  908   HD12  LEU   8          HD12      LEU   8  38.777   2.017  11.416
  909   HD13  LEU   8          HD13      LEU   8  40.195   0.980  11.253
  910   HD21  LEU   8          HD21      LEU   8  41.264   2.916  12.784
  911   HD22  LEU   8          HD22      LEU   8  39.738   3.784  12.608
  912   HD23  LEU   8          HD23      LEU   8  41.250   4.550  12.121
  913    H    SER   9           HN       SER   9  43.298   4.071   7.725
  914    HA   SER   9           HA       SER   9  41.355   6.130   7.250
  915    HB2  SER   9           HB2      SER   9  44.214   5.820   6.328
  916    HB3  SER   9           HB1      SER   9  43.233   7.247   6.021
  917    HG   SER   9           HG       SER   9  44.532   6.491   8.271
  918    H    ILE  10           HN       ILE  10  43.032   3.765   5.208
  919    HA   ILE  10           HA       ILE  10  41.994   4.670   2.733
  920    HB   ILE  10           HB       ILE  10  43.014   1.960   3.602
  921   HG12  ILE  10          HG12      ILE  10  44.293   4.045   1.816
  922   HG13  ILE  10          HG11      ILE  10  44.564   3.993   3.559
  923   HG21  ILE  10          HG21      ILE  10  41.564   1.609   1.702
  924   HG22  ILE  10          HG22      ILE  10  43.224   1.579   1.112
  925   HG23  ILE  10          HG23      ILE  10  42.229   3.015   0.872
  926   HD11  ILE  10          HD11      ILE  10  45.475   1.750   3.408
  927   HD12  ILE  10          HD12      ILE  10  46.314   2.765   2.238
  928   HD13  ILE  10          HD13      ILE  10  45.058   1.652   1.697
  929    H    CYS  11           HN       CYS  11  40.898   2.162   5.000
  930    HA   CYS  11           HA       CYS  11  38.737   1.196   3.487
  931    HB2  CYS  11           HB2      CYS  11  39.178   1.347   6.474
  932    HB3  CYS  11           HB1      CYS  11  37.812   0.509   5.738
  933    HG   CYS  11           HG       CYS  11  39.341  -1.299   4.887
  934    H    SER  12           HN       SER  12  38.787   3.690   6.058
  935    HA   SER  12           HA       SER  12  36.074   4.358   5.890
  936    HB2  SER  12           HB2      SER  12  38.443   6.068   6.664
  937    HB3  SER  12           HB1      SER  12  36.760   6.518   6.917
  938    HG   SER  12           HG       SER  12  38.325   4.583   8.172
  939    H    PHE  13           HN       PHE  13  38.876   5.538   4.075
  940    HA   PHE  13           HA       PHE  13  37.737   7.723   2.781
  941    HB2  PHE  13           HB2      PHE  13  40.142   6.399   2.665
  942    HB3  PHE  13           HB1      PHE  13  39.465   6.099   1.066
  943    HD1  PHE  13           HD1      PHE  13  40.497   8.709   3.467
  944    HD2  PHE  13           HD2      PHE  13  39.117   7.893  -0.516
  945    HE1  PHE  13           HE1      PHE  13  41.064  11.027   2.798
  946    HE2  PHE  13           HE2      PHE  13  39.682  10.213  -1.189
  947    HZ   PHE  13           HZ       PHE  13  40.657  11.780   0.469
  948    H    ILE  14           HN       ILE  14  37.993   4.389   1.497
  949    HA   ILE  14           HA       ILE  14  36.397   4.877  -0.786
  950    HB   ILE  14           HB       ILE  14  36.231   2.376  -0.892
  951   HG12  ILE  14          HG12      ILE  14  37.840   2.528   1.688
  952   HG13  ILE  14          HG11      ILE  14  36.186   1.954   1.559
  953   HG21  ILE  14          HG21      ILE  14  38.184   3.740  -1.752
  954   HG22  ILE  14          HG22      ILE  14  38.563   2.061  -1.367
  955   HG23  ILE  14          HG23      ILE  14  39.024   3.348  -0.252
  956   HD11  ILE  14          HD11      ILE  14  36.994   0.219  -0.079
  957   HD12  ILE  14          HD12      ILE  14  37.608   0.020   1.561
  958   HD13  ILE  14          HD13      ILE  14  38.641   0.715   0.312
  959    H    LEU  15           HN       LEU  15  35.596   3.660   2.444
  960    HA   LEU  15           HA       LEU  15  32.907   2.969   1.911
  961    HB2  LEU  15           HB2      LEU  15  34.329   3.758   4.467
  962    HB3  LEU  15           HB1      LEU  15  32.669   3.165   4.418
  963    HG   LEU  15           HG       LEU  15  34.953   1.615   3.184
  964   HD11  LEU  15          HD11      LEU  15  35.246   0.393   5.205
  965   HD12  LEU  15          HD12      LEU  15  33.810   1.108   5.937
  966   HD13  LEU  15          HD13      LEU  15  35.255   2.088   5.691
  967   HD21  LEU  15          HD21      LEU  15  32.711   0.966   2.464
  968   HD22  LEU  15          HD22      LEU  15  32.168   0.886   4.140
  969   HD23  LEU  15          HD23      LEU  15  33.353  -0.274   3.539
  970    H    SER  16           HN       SER  16  34.496   5.976   2.585
  971    HA   SER  16           HA       SER  16  32.136   7.450   3.279
  972    HB2  SER  16           HB2      SER  16  34.870   8.366   2.378
  973    HB3  SER  16           HB1      SER  16  33.596   9.430   2.969
  974    HG   SER  16           HG       SER  16  33.680   8.383   4.940
  975    H    ALA  17           HN       ALA  17  34.116   7.105   0.347
  976    HA   ALA  17           HA       ALA  17  32.714   8.907  -1.274
  977    HB1  ALA  17           HB1      ALA  17  33.562   7.447  -3.177
  978    HB2  ALA  17           HB2      ALA  17  34.222   6.371  -1.946
  979    HB3  ALA  17           HB3      ALA  17  34.799   8.033  -2.065
  980    H    LEU  18           HN       LEU  18  32.190   5.424  -0.724
  981    HA   LEU  18           HA       LEU  18  29.928   5.289  -2.465
  982    HB2  LEU  18           HB2      LEU  18  31.359   3.334  -1.867
  983    HB3  LEU  18           HB1      LEU  18  30.689   3.396  -0.235
  984    HG   LEU  18           HG       LEU  18  28.391   3.215  -1.271
  985   HD11  LEU  18          HD11      LEU  18  30.093   2.765  -3.733
  986   HD12  LEU  18          HD12      LEU  18  28.771   3.912  -3.526
  987   HD13  LEU  18          HD13      LEU  18  28.432   2.186  -3.617
  988   HD21  LEU  18          HD21      LEU  18  28.533   0.821  -1.524
  989   HD22  LEU  18          HD22      LEU  18  29.717   1.293  -0.305
  990   HD23  LEU  18          HD23      LEU  18  30.242   0.916  -1.946
  991    H    HIS  19           HN       HIS  19  30.443   6.100   0.853
  992    HA   HIS  19           HA       HIS  19  27.826   5.665   1.851
  993    HB2  HIS  19           HB2      HIS  19  29.468   5.963   3.495
  994    HB3  HIS  19           HB1      HIS  19  30.101   7.420   2.735
  995    HD2  HIS  19           HD2      HIS  19  28.737   9.790   3.387
  996    HE1  HIS  19           HE1      HIS  19  25.882   8.029   5.950
  997    HE2  HIS  19           HE2      HIS  19  26.828  10.231   5.111
  998    H    PHE  20           HN       PHE  20  29.389   8.630   0.664
  999    HA   PHE  20           HA       PHE  20  26.950  10.143   0.811
 1000    HB2  PHE  20           HB2      PHE  20  29.697  10.704   0.480
 1001    HB3  PHE  20           HB1      PHE  20  28.888  11.305  -0.966
 1002    HD1  PHE  20           HD1      PHE  20  29.266  11.666   2.658
 1003    HD2  PHE  20           HD2      PHE  20  27.072  12.983  -0.793
 1004    HE1  PHE  20           HE1      PHE  20  28.415  13.609   3.941
 1005    HE2  PHE  20           HE2      PHE  20  26.219  14.926   0.492
 1006    HZ   PHE  20           HZ       PHE  20  26.897  15.240   2.861
 1007    H    MET  21           HN       MET  21  28.478   8.097  -1.550
 1008    HA   MET  21           HA       MET  21  27.179   9.178  -3.849
 1009    HB2  MET  21           HB2      MET  21  28.720   6.743  -3.173
 1010    HB3  MET  21           HB1      MET  21  27.684   6.667  -4.595
 1011    HG2  MET  21           HG2      MET  21  28.736   8.726  -5.468
 1012    HG3  MET  21           HG1      MET  21  29.782   8.791  -4.049
 1013    HE1  MET  21           HE1      MET  21  31.776   8.981  -5.646
 1014    HE2  MET  21           HE2      MET  21  30.790   8.793  -7.093
 1015    HE3  MET  21           HE3      MET  21  32.229   7.800  -6.882
 1016    H    ALA  22           HN       ALA  22  26.597   6.151  -2.057
 1017    HA   ALA  22           HA       ALA  22  24.144   5.561  -3.340
 1018    HB1  ALA  22           HB1      ALA  22  25.491   4.576  -0.855
 1019    HB2  ALA  22           HB2      ALA  22  25.109   3.704  -2.340
 1020    HB3  ALA  22           HB3      ALA  22  23.827   4.105  -1.198
 1021    H    TRP  23           HN       TRP  23  24.911   7.282  -0.352
 1022    HA   TRP  23           HA       TRP  23  22.243   7.536   0.576
 1023    HB2  TRP  23           HB2      TRP  23  24.308   7.884   1.950
 1024    HB3  TRP  23           HB1      TRP  23  24.561   9.405   1.093
 1025    HD1  TRP  23           HD1      TRP  23  21.417   7.786   2.687
 1026    HE1  TRP  23           HE1      TRP  23  20.264   9.564   4.156
 1027    HE3  TRP  23           HE3      TRP  23  24.639  11.697   2.034
 1028    HZ2  TRP  23           HZ2      TRP  23  20.657  12.284   4.948
 1029    HZ3  TRP  23           HZ3      TRP  23  24.222  13.869   3.154
 1030    HH2  TRP  23           HH2      TRP  23  22.237  14.167   4.608
 1031    H    THR  24           HN       THR  24  24.288   9.609  -1.474
 1032    HA   THR  24           HA       THR  24  22.507  11.806  -1.628
 1033    HB   THR  24           HB       THR  24  24.708  10.832  -3.439
 1034    HG1  THR  24           HG1      THR  24  25.093  11.771  -1.305
 1035   HG21  THR  24          HG21      THR  24  23.225  12.004  -4.899
 1036   HG22  THR  24          HG22      THR  24  24.494  13.148  -4.466
 1037   HG23  THR  24          HG23      THR  24  22.913  13.250  -3.693
 1038    H    ILE  25           HN       ILE  25  23.047   9.097  -3.891
 1039    HA   ILE  25           HA       ILE  25  21.095   9.861  -5.759
 1040    HB   ILE  25           HB       ILE  25  21.125   7.493  -6.486
 1041   HG12  ILE  25          HG12      ILE  25  22.897   7.094  -4.052
 1042   HG13  ILE  25          HG11      ILE  25  21.258   6.481  -4.207
 1043   HG21  ILE  25          HG21      ILE  25  23.855   8.588  -5.749
 1044   HG22  ILE  25          HG22      ILE  25  22.919   9.074  -7.159
 1045   HG23  ILE  25          HG23      ILE  25  23.519   7.422  -7.027
 1046   HD11  ILE  25          HD11      ILE  25  22.675   4.666  -4.787
 1047   HD12  ILE  25          HD12      ILE  25  23.674   5.688  -5.820
 1048   HD13  ILE  25          HD13      ILE  25  22.028   5.282  -6.309
 1049    H    GLY  26           HN       GLY  26  20.823   7.865  -2.823
 1050    HA2  GLY  26           HA2      GLY  26  18.134   7.081  -3.200
 1051    HA3  GLY  26           HA1      GLY  26  18.981   7.131  -1.657
 1052    H    HIS  27           HN       HIS  27  19.590   9.840  -1.515
 1053    HA   HIS  27           HA       HIS  27  17.259  10.920  -0.409
 1054    HB2  HIS  27           HB2      HIS  27  19.358  11.774   0.319
 1055    HB3  HIS  27           HB1      HIS  27  19.835  12.199  -1.325
 1056    HD2  HIS  27           HD2      HIS  27  19.077  14.746  -2.104
 1057    HE1  HIS  27           HE1      HIS  27  16.441  15.565   1.092
 1058    HE2  HIS  27           HE2      HIS  27  17.562  16.544  -0.967
 1059    H    LEU  28           HN       LEU  28  18.775  11.461  -3.570
 1060    HA   LEU  28           HA       LEU  28  17.059  13.483  -4.489
 1061    HB2  LEU  28           HB2      LEU  28  18.508  11.320  -6.033
 1062    HB3  LEU  28           HB1      LEU  28  17.761  12.745  -6.758
 1063    HG   LEU  28           HG       LEU  28  19.870  12.897  -4.593
 1064   HD11  LEU  28          HD11      LEU  28  20.754  11.819  -6.659
 1065   HD12  LEU  28          HD12      LEU  28  21.469  13.406  -6.372
 1066   HD13  LEU  28          HD13      LEU  28  20.208  13.214  -7.591
 1067   HD21  LEU  28          HD21      LEU  28  18.582  14.908  -4.697
 1068   HD22  LEU  28          HD22      LEU  28  18.567  14.890  -6.461
 1069   HD23  LEU  28          HD23      LEU  28  20.063  15.240  -5.594
 1070    H    ASN  29           HN       ASN  29  15.105  13.476  -5.517
 1071    HA   ASN  29           HA       ASN  29  13.587  10.956  -5.399
 1072    HB2  ASN  29           HB2      ASN  29  12.719  13.010  -4.236
 1073    HB3  ASN  29           HB1      ASN  29  12.540  13.761  -5.821
 1074   HD21  ASN  29          HD21      ASN  29  10.261  13.774  -6.035
 1075   HD22  ASN  29          HD22      ASN  29   9.305  12.373  -5.977
 1076    H    GLN  30           HN       GLN  30  13.397   9.842  -7.226
 1077    HA   GLN  30           HA       GLN  30  13.349  11.331  -9.782
 1078    HB2  GLN  30           HB2      GLN  30  14.427   8.561  -9.204
 1079    HB3  GLN  30           HB1      GLN  30  14.287   9.270 -10.813
 1080    HG2  GLN  30           HG2      GLN  30  15.711  11.188 -10.002
 1081    HG3  GLN  30           HG1      GLN  30  15.977  10.282  -8.513
 1082   HE21  GLN  30          HE21      GLN  30  18.249   9.891  -8.887
 1083   HE22  GLN  30          HE22      GLN  30  18.797   8.892 -10.145
 1084    H    ILE  31           HN       ILE  31  11.533  11.174 -10.914
 1085    HA   ILE  31           HA       ILE  31   9.803   8.816 -10.515
 1086    HB   ILE  31           HB       ILE  31   8.894  11.703 -10.631
 1087   HG12  ILE  31          HG12      ILE  31   8.577   9.677  -8.402
 1088   HG13  ILE  31          HG11      ILE  31   9.917  10.821  -8.462
 1089   HG21  ILE  31          HG21      ILE  31   6.649  10.621 -10.150
 1090   HG22  ILE  31          HG22      ILE  31   7.399   9.069 -10.530
 1091   HG23  ILE  31          HG23      ILE  31   7.282  10.319 -11.769
 1092   HD11  ILE  31          HD11      ILE  31   8.474  12.692  -8.259
 1093   HD12  ILE  31          HD12      ILE  31   7.838  11.520  -7.105
 1094   HD13  ILE  31          HD13      ILE  31   7.046  11.741  -8.663
 1095    H    LYS  32           HN       LYS  32   9.068   7.923 -12.360
 1096    HA   LYS  32           HA       LYS  32   9.950   9.023 -14.884
 1097    HB2  LYS  32           HB2      LYS  32   8.311   6.566 -14.223
 1098    HB3  LYS  32           HB1      LYS  32   8.890   6.981 -15.835
 1099    HG2  LYS  32           HG2      LYS  32  11.230   7.010 -14.907
 1100    HG3  LYS  32           HG1      LYS  32  10.579   6.390 -13.391
 1101    HD2  LYS  32           HD2      LYS  32   9.668   4.427 -14.592
 1102    HD3  LYS  32           HD1      LYS  32  10.355   5.039 -16.096
 1103    HE2  LYS  32           HE2      LYS  32  11.945   3.463 -15.286
 1104    HE3  LYS  32           HE1      LYS  32  12.614   5.044 -14.884
 1105    HZ1  LYS  32           HZ1      LYS  32  11.223   4.625 -12.703
 1106    HZ2  LYS  32           HZ2      LYS  32  12.806   4.036 -12.878
 1107    HZ3  LYS  32           HZ3      LYS  32  11.480   3.004 -13.128
 1108    H    ARG  33           HN       ARG  33   8.842  10.801 -15.504
 1109    HA   ARG  33           HA       ARG  33   5.901  10.767 -15.372
 1110    HB2  ARG  33           HB2      ARG  33   6.039  13.170 -15.793
 1111    HB3  ARG  33           HB1      ARG  33   7.078  12.735 -14.434
 1112    HG2  ARG  33           HG2      ARG  33   9.025  12.659 -15.970
 1113    HG3  ARG  33           HG1      ARG  33   7.979  13.159 -17.299
 1114    HD2  ARG  33           HD2      ARG  33   8.358  14.751 -14.753
 1115    HD3  ARG  33           HD1      ARG  33   9.256  15.048 -16.238
 1116    HE   ARG  33           HE       ARG  33   6.533  15.079 -16.885
 1117   HH11  ARG  33          HH11      ARG  33   8.807  16.865 -14.931
 1118   HH12  ARG  33          HH12      ARG  33   7.953  18.359 -15.087
 1119   HH21  ARG  33          HH21      ARG  33   5.438  17.050 -17.071
 1120   HH22  ARG  33          HH22      ARG  33   6.059  18.466 -16.290
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  53.898  27.365  12.363
    2    H2   MET   1           HT2      MET   1  53.823  27.452  10.668
    3    H3   MET   1           HT3      MET   1  54.347  26.024  11.426
    4    HA   MET   1           HA       MET   1  52.255  25.328  11.148
    5    HB2  MET   1           HB2      MET   1  52.580  26.050  13.638
    6    HB3  MET   1           HB1      MET   1  51.455  27.346  13.231
    7    HG2  MET   1           HG2      MET   1  50.099  25.295  12.162
    8    HG3  MET   1           HG1      MET   1  50.979  24.408  13.406
    9    HE1  MET   1           HE1      MET   1  49.329  28.146  13.313
   10    HE2  MET   1           HE2      MET   1  47.735  27.550  13.768
   11    HE3  MET   1           HE3      MET   1  48.539  26.896  12.343
   12    H    PHE   2           HN       PHE   2  51.181  25.776   9.322
   13    HA   PHE   2           HA       PHE   2  50.248  28.520   8.829
   14    HB2  PHE   2           HB2      PHE   2  51.510  27.399   7.027
   15    HB3  PHE   2           HB1      PHE   2  50.299  26.118   6.990
   16    HD1  PHE   2           HD1      PHE   2  50.703  29.815   6.639
   17    HD2  PHE   2           HD2      PHE   2  48.337  26.357   5.700
   18    HE1  PHE   2           HE1      PHE   2  49.303  31.186   5.119
   19    HE2  PHE   2           HE2      PHE   2  46.935  27.727   4.180
   20    HZ   PHE   2           HZ       PHE   2  47.419  30.142   3.889
   21    H    GLU   3           HN       GLU   3  49.037  25.168   8.751
   22    HA   GLU   3           HA       GLU   3  46.300  26.164   8.756
   23    HB2  GLU   3           HB2      GLU   3  47.392  23.354   8.571
   24    HB3  GLU   3           HB1      GLU   3  45.682  23.769   8.491
   25    HG2  GLU   3           HG2      GLU   3  46.098  23.831   6.244
   26    HG3  GLU   3           HG1      GLU   3  46.639  25.467   6.621
   27    HA   PRO   4           HA       PRO   4  45.424  25.643  13.045
   28    HB2  PRO   4           HB2      PRO   4  43.156  23.846  12.325
   29    HB3  PRO   4           HB1      PRO   4  43.151  25.351  13.265
   30    HG2  PRO   4           HG2      PRO   4  42.207  25.288  10.791
   31    HG3  PRO   4           HG1      PRO   4  43.124  26.681  11.388
   32    HD2  PRO   4           HD2      PRO   4  44.031  24.485   9.552
   33    HD3  PRO   4           HD1      PRO   4  44.420  26.219   9.521
   34    H    PHE   5           HN       PHE   5  45.149  22.651  11.140
   35    HA   PHE   5           HA       PHE   5  46.700  21.235  13.193
   36    HB2  PHE   5           HB2      PHE   5  43.886  20.685  12.444
   37    HB3  PHE   5           HB1      PHE   5  44.946  19.279  12.546
   38    HD1  PHE   5           HD1      PHE   5  43.581  22.172  14.416
   39    HD2  PHE   5           HD2      PHE   5  45.838  18.525  14.646
   40    HE1  PHE   5           HE1      PHE   5  43.442  22.242  16.891
   41    HE2  PHE   5           HE2      PHE   5  45.701  18.596  17.121
   42    HZ   PHE   5           HZ       PHE   5  44.503  20.454  18.242
   43    H    GLN   6           HN       GLN   6  44.872  19.945  10.459
   44    HA   GLN   6           HA       GLN   6  47.283  19.701   8.836
   45    HB2  GLN   6           HB2      GLN   6  46.017  17.456  10.282
   46    HB3  GLN   6           HB1      GLN   6  46.359  17.157   8.579
   47    HG2  GLN   6           HG2      GLN   6  48.389  18.254  10.545
   48    HG3  GLN   6           HG1      GLN   6  48.258  16.550  10.111
   49   HE21  GLN   6          HE21      GLN   6  48.787  15.945   7.862
   50   HE22  GLN   6          HE22      GLN   6  49.709  16.985   6.886
   51    H    ILE   7           HN       ILE   7  46.745  18.682   6.692
   52    HA   ILE   7           HA       ILE   7  44.643  20.075   5.450
   53    HB   ILE   7           HB       ILE   7  46.246  17.663   4.574
   54   HG12  ILE   7          HG12      ILE   7  46.335  20.527   3.596
   55   HG13  ILE   7          HG11      ILE   7  47.343  19.949   4.923
   56   HG21  ILE   7          HG21      ILE   7  44.155  19.290   3.114
   57   HG22  ILE   7          HG22      ILE   7  44.219  17.539   3.319
   58   HG23  ILE   7          HG23      ILE   7  45.382  18.347   2.267
   59   HD11  ILE   7          HD11      ILE   7  47.351  19.023   2.043
   60   HD12  ILE   7          HD12      ILE   7  48.120  18.097   3.335
   61   HD13  ILE   7          HD13      ILE   7  48.683  19.726   2.962
   62    H    LEU   8           HN       LEU   8  44.873  16.745   6.603
   63    HA   LEU   8           HA       LEU   8  42.374  15.845   5.608
   64    HB2  LEU   8           HB2      LEU   8  44.245  14.374   6.434
   65    HB3  LEU   8           HB1      LEU   8  43.799  14.837   8.077
   66    HG   LEU   8           HG       LEU   8  41.526  13.964   6.422
   67   HD11  LEU   8          HD11      LEU   8  43.570  11.907   7.302
   68   HD12  LEU   8          HD12      LEU   8  43.410  12.468   5.637
   69   HD13  LEU   8          HD13      LEU   8  42.075  11.617   6.414
   70   HD21  LEU   8          HD21      LEU   8  40.996  12.738   8.491
   71   HD22  LEU   8          HD22      LEU   8  41.418  14.411   8.859
   72   HD23  LEU   8          HD23      LEU   8  42.592  13.123   9.139
   73    H    SER   9           HN       SER   9  43.339  17.500   8.530
   74    HA   SER   9           HA       SER   9  40.839  17.200   9.917
   75    HB2  SER   9           HB2      SER   9  43.126  19.136  10.306
   76    HB3  SER   9           HB1      SER   9  41.734  19.025  11.378
   77    HG   SER   9           HG       SER   9  43.660  17.736  11.938
   78    H    ILE  10           HN       ILE  10  42.277  19.715   7.865
   79    HA   ILE  10           HA       ILE  10  40.214  21.628   8.199
   80    HB   ILE  10           HB       ILE  10  42.297  21.186   6.071
   81   HG12  ILE  10          HG12      ILE  10  42.756  22.103   8.453
   82   HG13  ILE  10          HG11      ILE  10  43.388  23.022   7.088
   83   HG21  ILE  10          HG21      ILE  10  40.535  22.164   4.822
   84   HG22  ILE  10          HG22      ILE  10  41.548  23.526   5.294
   85   HG23  ILE  10          HG23      ILE  10  40.044  23.203   6.159
   86   HD11  ILE  10          HD11      ILE  10  40.648  23.664   8.171
   87   HD12  ILE  10          HD12      ILE  10  41.777  24.706   7.309
   88   HD13  ILE  10          HD13      ILE  10  42.082  24.275   8.985
   89    H    CYS  11           HN       CYS  11  40.735  19.072   5.777
   90    HA   CYS  11           HA       CYS  11  38.542  19.707   4.136
   91    HB2  CYS  11           HB2      CYS  11  39.950  17.094   4.699
   92    HB3  CYS  11           HB1      CYS  11  38.680  17.262   3.487
   93    HG   CYS  11           HG       CYS  11  41.075  19.212   3.241
   94    H    SER  12           HN       SER  12  38.794  17.335   6.809
   95    HA   SER  12           HA       SER  12  36.130  16.496   6.746
   96    HB2  SER  12           HB2      SER  12  38.077  16.684   9.052
   97    HB3  SER  12           HB1      SER  12  36.503  15.899   9.165
   98    HG   SER  12           HG       SER  12  38.776  14.924   8.199
   99    H    PHE  13           HN       PHE  13  37.621  19.263   8.355
  100    HA   PHE  13           HA       PHE  13  35.436  20.066   9.926
  101    HB2  PHE  13           HB2      PHE  13  37.991  21.132   9.128
  102    HB3  PHE  13           HB1      PHE  13  36.763  22.396   9.046
  103    HD1  PHE  13           HD1      PHE  13  38.914  20.528  11.206
  104    HD2  PHE  13           HD2      PHE  13  35.152  22.597  11.073
  105    HE1  PHE  13           HE1      PHE  13  38.933  20.724  13.679
  106    HE2  PHE  13           HE2      PHE  13  35.170  22.792  13.543
  107    HZ   PHE  13           HZ       PHE  13  37.060  21.856  14.848
  108    H    ILE  14           HN       ILE  14  36.398  21.126   6.649
  109    HA   ILE  14           HA       ILE  14  34.197  22.857   6.246
  110    HB   ILE  14           HB       ILE  14  35.964  21.402   4.263
  111   HG12  ILE  14          HG12      ILE  14  36.013  24.311   5.104
  112   HG13  ILE  14          HG11      ILE  14  36.976  23.083   5.924
  113   HG21  ILE  14          HG21      ILE  14  35.158  23.283   2.739
  114   HG22  ILE  14          HG22      ILE  14  33.900  23.593   3.937
  115   HG23  ILE  14          HG23      ILE  14  33.963  22.039   3.106
  116   HD11  ILE  14          HD11      ILE  14  37.838  22.463   3.558
  117   HD12  ILE  14          HD12      ILE  14  38.444  23.948   4.288
  118   HD13  ILE  14          HD13      ILE  14  37.178  24.022   3.064
  119    H    LEU  15           HN       LEU  15  34.747  19.448   5.485
  120    HA   LEU  15           HA       LEU  15  32.392  19.019   3.992
  121    HB2  LEU  15           HB2      LEU  15  34.174  17.201   5.596
  122    HB3  LEU  15           HB1      LEU  15  32.709  16.593   4.823
  123    HG   LEU  15           HG       LEU  15  34.784  18.185   3.310
  124   HD11  LEU  15          HD11      LEU  15  35.501  15.906   2.444
  125   HD12  LEU  15          HD12      LEU  15  34.591  15.202   3.781
  126   HD13  LEU  15          HD13      LEU  15  35.966  16.256   4.108
  127   HD21  LEU  15          HD21      LEU  15  33.689  16.858   1.407
  128   HD22  LEU  15          HD22      LEU  15  32.687  18.095   2.158
  129   HD23  LEU  15          HD23      LEU  15  32.451  16.398   2.574
  130    H    SER  16           HN       SER  16  33.012  18.033   7.358
  131    HA   SER  16           HA       SER  16  30.507  17.299   8.130
  132    HB2  SER  16           HB2      SER  16  32.476  18.907   9.774
  133    HB3  SER  16           HB1      SER  16  31.102  18.019  10.424
  134    HG   SER  16           HG       SER  16  33.246  16.936  10.356
  135    H    ALA  17           HN       ALA  17  31.767  20.613   7.931
  136    HA   ALA  17           HA       ALA  17  29.581  21.958   9.050
  137    HB1  ALA  17           HB1      ALA  17  31.741  23.026   8.478
  138    HB2  ALA  17           HB2      ALA  17  30.373  23.907   7.799
  139    HB3  ALA  17           HB3      ALA  17  31.350  22.866   6.766
  140    H    LEU  18           HN       LEU  18  30.249  21.520   5.555
  141    HA   LEU  18           HA       LEU  18  27.685  22.372   4.710
  142    HB2  LEU  18           HB2      LEU  18  30.012  21.000   3.485
  143    HB3  LEU  18           HB1      LEU  18  28.461  20.771   2.678
  144    HG   LEU  18           HG       LEU  18  29.821  22.777   1.901
  145   HD11  LEU  18          HD11      LEU  18  27.128  23.523   3.063
  146   HD12  LEU  18          HD12      LEU  18  27.292  22.445   1.677
  147   HD13  LEU  18          HD13      LEU  18  27.871  24.106   1.574
  148   HD21  LEU  18          HD21      LEU  18  30.062  24.666   3.288
  149   HD22  LEU  18          HD22      LEU  18  30.413  23.334   4.387
  150   HD23  LEU  18          HD23      LEU  18  28.831  24.115   4.425
  151    H    HIS  19           HN       HIS  19  28.762  19.430   6.078
  152    HA   HIS  19           HA       HIS  19  26.852  17.675   4.940
  153    HB2  HIS  19           HB2      HIS  19  29.028  17.064   6.143
  154    HB3  HIS  19           HB1      HIS  19  28.141  17.336   7.643
  155    HD2  HIS  19           HD2      HIS  19  25.281  15.907   6.733
  156    HE1  HIS  19           HE1      HIS  19  27.671  12.493   6.057
  157    HE2  HIS  19           HE2      HIS  19  25.293  13.318   6.399
  158    H    PHE  20           HN       PHE  20  26.996  19.407   8.046
  159    HA   PHE  20           HA       PHE  20  24.397  18.492   8.838
  160    HB2  PHE  20           HB2      PHE  20  26.574  19.905  10.034
  161    HB3  PHE  20           HB1      PHE  20  25.102  20.852  10.252
  162    HD1  PHE  20           HD1      PHE  20  26.976  18.004  11.375
  163    HD2  PHE  20           HD2      PHE  20  23.004  19.617  11.103
  164    HE1  PHE  20           HE1      PHE  20  26.217  16.437  13.144
  165    HE2  PHE  20           HE2      PHE  20  22.247  18.052  12.870
  166    HZ   PHE  20           HZ       PHE  20  23.845  16.462  13.888
  167    H    MET  21           HN       MET  21  25.615  21.122   6.917
  168    HA   MET  21           HA       MET  21  23.398  22.885   7.265
  169    HB2  MET  21           HB2      MET  21  25.497  22.607   5.111
  170    HB3  MET  21           HB1      MET  21  24.285  23.891   5.127
  171    HG2  MET  21           HG2      MET  21  26.076  23.340   7.494
  172    HG3  MET  21           HG1      MET  21  26.530  24.462   6.214
  173    HE1  MET  21           HE1      MET  21  24.385  26.067   5.269
  174    HE2  MET  21           HE2      MET  21  25.815  26.780   6.012
  175    HE3  MET  21           HE3      MET  21  24.215  27.379   6.444
  176    H    ALA  22           HN       ALA  22  24.287  20.707   4.586
  177    HA   ALA  22           HA       ALA  22  21.825  21.072   3.199
  178    HB1  ALA  22           HB1      ALA  22  23.576  18.650   2.897
  179    HB2  ALA  22           HB2      ALA  22  24.079  20.225   2.285
  180    HB3  ALA  22           HB3      ALA  22  22.606  19.470   1.674
  181    H    TRP  23           HN       TRP  23  22.972  18.648   5.505
  182    HA   TRP  23           HA       TRP  23  20.826  16.839   5.230
  183    HB2  TRP  23           HB2      TRP  23  23.100  16.627   6.500
  184    HB3  TRP  23           HB1      TRP  23  22.191  17.271   7.862
  185    HD1  TRP  23           HD1      TRP  23  22.778  14.187   5.849
  186    HE1  TRP  23           HE1      TRP  23  21.311  12.264   6.738
  187    HE3  TRP  23           HE3      TRP  23  19.725  16.795   9.008
  188    HZ2  TRP  23           HZ2      TRP  23  19.129  11.882   8.547
  189    HZ3  TRP  23           HZ3      TRP  23  17.963  15.626  10.301
  190    HH2  TRP  23           HH2      TRP  23  17.661  13.174  10.074
  191    H    THR  24           HN       THR  24  21.266  19.696   7.292
  192    HA   THR  24           HA       THR  24  18.857  19.347   8.777
  193    HB   THR  24           HB       THR  24  19.185  21.830   9.263
  194    HG1  THR  24           HG1      THR  24  20.615  22.834   8.132
  195   HG21  THR  24          HG21      THR  24  20.029  20.377  10.901
  196   HG22  THR  24          HG22      THR  24  21.444  21.328  10.452
  197   HG23  THR  24          HG23      THR  24  21.241  19.698   9.814
  198    H    ILE  25           HN       ILE  25  19.673  21.094   5.794
  199    HA   ILE  25           HA       ILE  25  17.208  22.445   5.502
  200    HB   ILE  25           HB       ILE  25  19.265  21.522   3.495
  201   HG12  ILE  25          HG12      ILE  25  18.592  24.316   4.445
  202   HG13  ILE  25          HG11      ILE  25  19.787  23.308   5.261
  203   HG21  ILE  25          HG21      ILE  25  16.717  23.112   3.137
  204   HG22  ILE  25          HG22      ILE  25  17.269  21.709   2.220
  205   HG23  ILE  25          HG23      ILE  25  18.075  23.264   2.021
  206   HD11  ILE  25          HD11      ILE  25  20.877  23.023   2.945
  207   HD12  ILE  25          HD12      ILE  25  21.045  24.599   3.717
  208   HD13  ILE  25          HD13      ILE  25  19.858  24.369   2.432
  209    H    GLY  26           HN       GLY  26  18.342  19.306   4.266
  210    HA2  GLY  26           HA2      GLY  26  15.999  18.643   2.825
  211    HA3  GLY  26           HA1      GLY  26  17.193  17.492   3.418
  212    H    HIS  27           HN       HIS  27  16.995  18.014   6.170
  213    HA   HIS  27           HA       HIS  27  14.904  16.335   6.944
  214    HB2  HIS  27           HB2      HIS  27  16.781  16.638   8.405
  215    HB3  HIS  27           HB1      HIS  27  16.498  18.376   8.506
  216    HD2  HIS  27           HD2      HIS  27  14.746  19.127  10.520
  217    HE1  HIS  27           HE1      HIS  27  13.302  15.280  11.487
  218    HE2  HIS  27           HE2      HIS  27  13.252  17.732  12.145
  219    H    LEU  28           HN       LEU  28  15.117  19.886   6.955
  220    HA   LEU  28           HA       LEU  28  12.448  20.194   8.007
  221    HB2  LEU  28           HB2      LEU  28  14.486  21.820   8.175
  222    HB3  LEU  28           HB1      LEU  28  13.950  22.369   6.586
  223    HG   LEU  28           HG       LEU  28  11.804  22.087   8.602
  224   HD11  LEU  28          HD11      LEU  28  13.752  24.395   8.800
  225   HD12  LEU  28          HD12      LEU  28  13.797  23.007   9.886
  226   HD13  LEU  28          HD13      LEU  28  12.378  24.055   9.851
  227   HD21  LEU  28          HD21      LEU  28  12.565  24.422   6.831
  228   HD22  LEU  28          HD22      LEU  28  10.981  24.059   7.516
  229   HD23  LEU  28          HD23      LEU  28  11.644  23.040   6.238
  230    H    ASN  29           HN       ASN  29  10.656  19.918   6.850
  231    HA   ASN  29           HA       ASN  29  10.770  20.395   3.931
  232    HB2  ASN  29           HB2      ASN  29   8.957  18.515   5.461
  233    HB3  ASN  29           HB1      ASN  29   8.976  18.743   3.713
  234   HD21  ASN  29          HD21      ASN  29  11.566  18.634   2.952
  235   HD22  ASN  29          HD22      ASN  29  12.322  17.207   3.476
  236    H    GLN  30           HN       GLN  30   9.190  21.621   2.982
  237    HA   GLN  30           HA       GLN  30   7.369  23.032   4.834
  238    HB2  GLN  30           HB2      GLN  30   8.734  23.858   2.284
  239    HB3  GLN  30           HB1      GLN  30   7.286  24.695   2.844
  240    HG2  GLN  30           HG2      GLN  30   9.739  24.263   4.567
  241    HG3  GLN  30           HG1      GLN  30   9.454  25.728   3.628
  242   HE21  GLN  30          HE21      GLN  30   7.494  27.027   4.209
  243   HE22  GLN  30          HE22      GLN  30   6.855  26.911   5.777
  244    H    ILE  31           HN       ILE  31   5.309  22.458   4.716
  245    HA   ILE  31           HA       ILE  31   4.296  21.311   2.187
  246    HB   ILE  31           HB       ILE  31   3.404  20.876   5.045
  247   HG12  ILE  31          HG12      ILE  31   4.372  18.840   3.033
  248   HG13  ILE  31          HG11      ILE  31   5.496  19.705   4.083
  249   HG21  ILE  31          HG21      ILE  31   1.863  19.177   3.913
  250   HG22  ILE  31          HG22      ILE  31   2.214  20.012   2.401
  251   HG23  ILE  31          HG23      ILE  31   1.417  20.871   3.719
  252   HD11  ILE  31          HD11      ILE  31   4.703  17.471   4.984
  253   HD12  ILE  31          HD12      ILE  31   3.095  18.181   5.126
  254   HD13  ILE  31          HD13      ILE  31   4.436  18.842   6.060
  255    H    LYS  32           HN       LYS  32   2.783  22.406   1.120
  256    HA   LYS  32           HA       LYS  32   1.263  24.488   2.575
  257    HB2  LYS  32           HB2      LYS  32   2.480  24.558  -0.189
  258    HB3  LYS  32           HB1      LYS  32   1.234  25.693   0.333
  259    HG2  LYS  32           HG2      LYS  32   2.623  26.558   2.080
  260    HG3  LYS  32           HG1      LYS  32   3.791  25.250   1.891
  261    HD2  LYS  32           HD2      LYS  32   4.728  27.183   0.809
  262    HD3  LYS  32           HD1      LYS  32   4.192  26.089  -0.467
  263    HE2  LYS  32           HE2      LYS  32   3.470  28.360  -1.001
  264    HE3  LYS  32           HE1      LYS  32   2.061  27.369  -0.631
  265    HZ1  LYS  32           HZ1      LYS  32   1.537  28.755   0.995
  266    HZ2  LYS  32           HZ2      LYS  32   2.862  29.739   0.598
  267    HZ3  LYS  32           HZ3      LYS  32   3.033  28.508   1.756
  268    H    ARG  33           HN       ARG  33  -0.802  23.907   2.708
  269    HA   ARG  33           HA       ARG  33  -1.958  22.217   0.592
  270    HB2  ARG  33           HB2      ARG  33  -2.936  22.848   3.388
  271    HB3  ARG  33           HB1      ARG  33  -3.771  21.806   2.237
  272    HG2  ARG  33           HG2      ARG  33  -1.853  20.295   2.163
  273    HG3  ARG  33           HG1      ARG  33  -0.947  21.355   3.243
  274    HD2  ARG  33           HD2      ARG  33  -1.881  19.549   4.555
  275    HD3  ARG  33           HD1      ARG  33  -2.733  21.023   4.974
  276    HE   ARG  33           HE       ARG  33  -3.787  18.762   3.423
  277   HH11  ARG  33          HH11      ARG  33  -4.303  21.965   4.736
  278   HH12  ARG  33          HH12      ARG  33  -6.017  21.869   4.580
  279   HH21  ARG  33          HH21      ARG  33  -6.018  18.693   3.227
  280   HH22  ARG  33          HH22      ARG  33  -6.983  20.040   3.728
  281    H1   MET   1           HT1      MET   1  47.200  17.015  33.292
  282    H2   MET   1           HT2      MET   1  46.567  18.584  33.138
  283    H3   MET   1           HT3      MET   1  47.682  17.999  31.998
  284    HA   MET   1           HA       MET   1  45.893  17.522  30.769
  285    HB2  MET   1           HB2      MET   1  46.782  15.320  31.862
  286    HB3  MET   1           HB1      MET   1  45.270  15.363  32.769
  287    HG2  MET   1           HG2      MET   1  44.276  15.830  30.324
  288    HG3  MET   1           HG1      MET   1  45.719  14.932  29.853
  289    HE1  MET   1           HE1      MET   1  43.152  14.585  33.014
  290    HE2  MET   1           HE2      MET   1  42.019  13.592  32.101
  291    HE3  MET   1           HE3      MET   1  42.473  15.183  31.494
  292    H    PHE   2           HN       PHE   2  44.214  18.887  30.698
  293    HA   PHE   2           HA       PHE   2  42.444  19.125  33.033
  294    HB2  PHE   2           HB2      PHE   2  43.323  21.210  32.046
  295    HB3  PHE   2           HB1      PHE   2  42.572  20.785  30.508
  296    HD1  PHE   2           HD1      PHE   2  41.794  21.383  34.112
  297    HD2  PHE   2           HD2      PHE   2  40.316  21.333  30.080
  298    HE1  PHE   2           HE1      PHE   2  39.658  22.378  34.883
  299    HE2  PHE   2           HE2      PHE   2  38.179  22.328  30.850
  300    HZ   PHE   2           HZ       PHE   2  37.850  22.851  33.252
  301    H    GLU   3           HN       GLU   3  42.262  18.659  29.505
  302    HA   GLU   3           HA       GLU   3  39.505  17.755  29.774
  303    HB2  GLU   3           HB2      GLU   3  41.219  18.207  27.327
  304    HB3  GLU   3           HB1      GLU   3  39.530  17.710  27.287
  305    HG2  GLU   3           HG2      GLU   3  39.170  19.964  27.166
  306    HG3  GLU   3           HG1      GLU   3  39.322  19.853  28.918
  307    HA   PRO   4           HA       PRO   4  40.230  13.413  29.596
  308    HB2  PRO   4           HB2      PRO   4  38.450  13.249  27.211
  309    HB3  PRO   4           HB1      PRO   4  38.324  12.417  28.773
  310    HG2  PRO   4           HG2      PRO   4  36.697  14.413  28.159
  311    HG3  PRO   4           HG1      PRO   4  37.327  14.216  29.804
  312    HD2  PRO   4           HD2      PRO   4  38.177  16.176  27.691
  313    HD3  PRO   4           HD1      PRO   4  38.035  16.397  29.449
  314    H    PHE   5           HN       PHE   5  40.211  15.005  26.415
  315    HA   PHE   5           HA       PHE   5  42.666  13.559  25.706
  316    HB2  PHE   5           HB2      PHE   5  40.033  13.279  24.378
  317    HB3  PHE   5           HB1      PHE   5  41.417  13.497  23.307
  318    HD1  PHE   5           HD1      PHE   5  39.972  11.376  25.979
  319    HD2  PHE   5           HD2      PHE   5  43.109  11.804  23.077
  320    HE1  PHE   5           HE1      PHE   5  40.618   9.008  26.329
  321    HE2  PHE   5           HE2      PHE   5  43.756   9.436  23.427
  322    HZ   PHE   5           HZ       PHE   5  42.511   8.037  25.053
  323    H    GLN   6           HN       GLN   6  40.498  15.452  23.661
  324    HA   GLN   6           HA       GLN   6  42.228  17.794  23.827
  325    HB2  GLN   6           HB2      GLN   6  42.173  15.924  21.538
  326    HB3  GLN   6           HB1      GLN   6  42.022  17.631  21.120
  327    HG2  GLN   6           HG2      GLN   6  44.180  16.519  22.936
  328    HG3  GLN   6           HG1      GLN   6  44.402  16.821  21.212
  329   HE21  GLN   6          HE21      GLN   6  44.329  19.093  20.479
  330   HE22  GLN   6          HE22      GLN   6  44.559  20.360  21.583
  331    H    ILE   7           HN       ILE   7  41.338  19.588  22.441
  332    HA   ILE   7           HA       ILE   7  38.650  20.080  23.091
  333    HB   ILE   7           HB       ILE   7  40.493  21.372  21.073
  334   HG12  ILE   7          HG12      ILE   7  39.457  22.419  23.719
  335   HG13  ILE   7          HG11      ILE   7  40.954  21.497  23.588
  336   HG21  ILE   7          HG21      ILE   7  37.677  22.082  21.921
  337   HG22  ILE   7          HG22      ILE   7  38.291  21.851  20.284
  338   HG23  ILE   7          HG23      ILE   7  38.780  23.265  21.217
  339   HD11  ILE   7          HD11      ILE   7  40.305  24.173  22.334
  340   HD12  ILE   7          HD12      ILE   7  41.673  23.189  21.807
  341   HD13  ILE   7          HD13      ILE   7  41.605  23.790  23.463
  342    H    LEU   8           HN       LEU   8  40.158  18.962  20.102
  343    HA   LEU   8           HA       LEU   8  37.831  19.007  18.482
  344    HB2  LEU   8           HB2      LEU   8  40.199  18.822  17.647
  345    HB3  LEU   8           HB1      LEU   8  40.192  17.143  18.187
  346    HG   LEU   8           HG       LEU   8  37.849  17.888  16.569
  347   HD11  LEU   8          HD11      LEU   8  40.556  17.690  15.221
  348   HD12  LEU   8          HD12      LEU   8  39.723  19.217  15.506
  349   HD13  LEU   8          HD13      LEU   8  38.999  18.003  14.452
  350   HD21  LEU   8          HD21      LEU   8  38.376  15.721  15.522
  351   HD22  LEU   8          HD22      LEU   8  38.404  15.579  17.279
  352   HD23  LEU   8          HD23      LEU   8  39.917  15.672  16.377
  353    H    SER   9           HN       SER   9  39.174  16.655  20.687
  354    HA   SER   9           HA       SER   9  37.440  14.484  19.947
  355    HB2  SER   9           HB2      SER   9  39.094  14.969  22.427
  356    HB3  SER   9           HB1      SER   9  38.205  13.484  22.109
  357    HG   SER   9           HG       SER   9  40.490  13.573  21.426
  358    H    ILE  10           HN       ILE  10  37.382  16.992  22.459
  359    HA   ILE  10           HA       ILE  10  35.086  16.038  23.819
  360    HB   ILE  10           HB       ILE  10  36.416  18.734  23.647
  361   HG12  ILE  10          HG12      ILE  10  37.336  16.686  24.947
  362   HG13  ILE  10          HG11      ILE  10  37.213  18.217  25.814
  363   HG21  ILE  10          HG21      ILE  10  34.148  19.338  23.984
  364   HG22  ILE  10          HG22      ILE  10  34.834  19.287  25.606
  365   HG23  ILE  10          HG23      ILE  10  33.840  17.950  25.027
  366   HD11  ILE  10          HD11      ILE  10  34.902  16.282  25.877
  367   HD12  ILE  10          HD12      ILE  10  35.354  17.514  27.050
  368   HD13  ILE  10          HD13      ILE  10  36.288  16.031  26.929
  369    H    CYS  11           HN       CYS  11  35.498  18.402  21.189
  370    HA   CYS  11           HA       CYS  11  32.811  19.213  21.037
  371    HB2  CYS  11           HB2      CYS  11  34.997  19.076  18.957
  372    HB3  CYS  11           HB1      CYS  11  33.413  19.783  18.643
  373    HG   CYS  11           HG       CYS  11  34.956  20.905  21.085
  374    H    SER  12           HN       SER  12  34.557  16.706  19.165
  375    HA   SER  12           HA       SER  12  32.362  15.823  17.683
  376    HB2  SER  12           HB2      SER  12  34.808  14.334  18.647
  377    HB3  SER  12           HB1      SER  12  33.640  13.660  17.514
  378    HG   SER  12           HG       SER  12  35.662  15.309  17.025
  379    H    PHE  13           HN       PHE  13  33.450  14.924  20.917
  380    HA   PHE  13           HA       PHE  13  31.751  12.727  21.339
  381    HB2  PHE  13           HB2      PHE  13  33.509  14.387  22.903
  382    HB3  PHE  13           HB1      PHE  13  32.017  14.087  23.795
  383    HD1  PHE  13           HD1      PHE  13  35.177  12.731  22.817
  384    HD2  PHE  13           HD2      PHE  13  31.152  11.640  23.844
  385    HE1  PHE  13           HE1      PHE  13  35.932  10.422  23.325
  386    HE2  PHE  13           HE2      PHE  13  31.905   9.334  24.350
  387    HZ   PHE  13           HZ       PHE  13  34.295   8.724  24.091
  388    H    ILE  14           HN       ILE  14  31.276  16.170  22.179
  389    HA   ILE  14           HA       ILE  14  28.671  15.855  23.236
  390    HB   ILE  14           HB       ILE  14  30.045  18.269  22.031
  391   HG12  ILE  14          HG12      ILE  14  29.539  17.600  24.942
  392   HG13  ILE  14          HG11      ILE  14  31.018  17.114  24.113
  393   HG21  ILE  14          HG21      ILE  14  28.301  19.491  23.436
  394   HG22  ILE  14          HG22      ILE  14  27.458  17.949  23.574
  395   HG23  ILE  14          HG23      ILE  14  27.683  18.692  21.991
  396   HD11  ILE  14          HD11      ILE  14  31.220  19.609  23.430
  397   HD12  ILE  14          HD12      ILE  14  31.582  19.185  25.102
  398   HD13  ILE  14          HD13      ILE  14  30.025  19.905  24.696
  399    H    LEU  15           HN       LEU  15  29.879  16.641  20.008
  400    HA   LEU  15           HA       LEU  15  27.390  17.217  18.811
  401    HB2  LEU  15           HB2      LEU  15  30.026  16.256  17.723
  402    HB3  LEU  15           HB1      LEU  15  28.624  16.459  16.670
  403    HG   LEU  15           HG       LEU  15  29.572  18.647  18.526
  404   HD11  LEU  15          HD11      LEU  15  30.582  19.626  16.409
  405   HD12  LEU  15          HD12      LEU  15  30.381  18.035  15.674
  406   HD13  LEU  15          HD13      LEU  15  31.437  18.233  17.073
  407   HD21  LEU  15          HD21      LEU  15  28.344  20.010  16.732
  408   HD22  LEU  15          HD22      LEU  15  27.331  19.008  17.767
  409   HD23  LEU  15          HD23      LEU  15  27.722  18.473  16.132
  410    H    SER  16           HN       SER  16  29.305  14.234  18.446
  411    HA   SER  16           HA       SER  16  27.489  12.623  17.213
  412    HB2  SER  16           HB2      SER  16  29.348  11.813  19.463
  413    HB3  SER  16           HB1      SER  16  28.562  10.700  18.347
  414    HG   SER  16           HG       SER  16  30.783  11.461  17.838
  415    H    ALA  17           HN       ALA  17  27.638  13.362  20.683
  416    HA   ALA  17           HA       ALA  17  25.642  11.608  21.568
  417    HB1  ALA  17           HB1      ALA  17  27.112  12.921  23.065
  418    HB2  ALA  17           HB2      ALA  17  25.409  13.125  23.476
  419    HB3  ALA  17           HB3      ALA  17  26.259  14.389  22.592
  420    H    LEU  18           HN       LEU  18  25.246  15.105  20.878
  421    HA   LEU  18           HA       LEU  18  22.419  15.048  20.937
  422    HB2  LEU  18           HB2      LEU  18  24.518  16.946  20.044
  423    HB3  LEU  18           HB1      LEU  18  22.918  17.163  19.335
  424    HG   LEU  18           HG       LEU  18  23.343  18.429  21.502
  425   HD11  LEU  18          HD11      LEU  18  21.067  16.445  21.688
  426   HD12  LEU  18          HD12      LEU  18  21.076  17.766  20.521
  427   HD13  LEU  18          HD13      LEU  18  21.103  18.117  22.247
  428   HD21  LEU  18          HD21      LEU  18  23.478  17.276  23.552
  429   HD22  LEU  18          HD22      LEU  18  24.517  16.316  22.502
  430   HD23  LEU  18          HD23      LEU  18  22.879  15.769  22.860
  431    H    HIS  19           HN       HIS  19  24.657  14.028  18.560
  432    HA   HIS  19           HA       HIS  19  23.055  14.380  16.251
  433    HB2  HIS  19           HB2      HIS  19  25.579  13.976  16.366
  434    HB3  HIS  19           HB1      HIS  19  25.181  12.274  16.593
  435    HD2  HIS  19           HD2      HIS  19  22.700  12.102  14.386
  436    HE1  HIS  19           HE1      HIS  19  25.607  13.432  11.628
  437    HE2  HIS  19           HE2      HIS  19  23.331  12.328  11.863
  438    H    PHE  20           HN       PHE  20  23.692  11.576  18.346
  439    HA   PHE  20           HA       PHE  20  21.851   9.911  16.913
  440    HB2  PHE  20           HB2      PHE  20  23.805   9.585  18.972
  441    HB3  PHE  20           HB1      PHE  20  22.277   8.908  19.535
  442    HD1  PHE  20           HD1      PHE  20  25.132   8.404  17.422
  443    HD2  PHE  20           HD2      PHE  20  21.002   7.344  17.929
  444    HE1  PHE  20           HE1      PHE  20  25.461   6.427  15.960
  445    HE2  PHE  20           HE2      PHE  20  21.328   5.368  16.467
  446    HZ   PHE  20           HZ       PHE  20  23.557   4.913  15.486
  447    H    MET  21           HN       MET  21  21.601  12.224  19.496
  448    HA   MET  21           HA       MET  21  19.213  11.199  20.675
  449    HB2  MET  21           HB2      MET  21  20.502  13.930  20.660
  450    HB3  MET  21           HB1      MET  21  19.051  13.546  21.591
  451    HG2  MET  21           HG2      MET  21  21.585  11.919  21.814
  452    HG3  MET  21           HG1      MET  21  21.269  13.314  22.842
  453    HE1  MET  21           HE1      MET  21  18.576  13.520  23.723
  454    HE2  MET  21           HE2      MET  21  19.909  13.338  24.859
  455    HE3  MET  21           HE3      MET  21  18.433  12.404  25.088
  456    H    ALA  22           HN       ALA  22  19.771  13.945  18.468
  457    HA   ALA  22           HA       ALA  22  16.999  14.418  18.019
  458    HB1  ALA  22           HB1      ALA  22  19.164  15.210  16.094
  459    HB2  ALA  22           HB2      ALA  22  18.989  16.014  17.654
  460    HB3  ALA  22           HB3      ALA  22  17.668  16.059  16.485
  461    H    TRP  23           HN       TRP  23  19.451  12.558  16.278
  462    HA   TRP  23           HA       TRP  23  17.926  12.016  13.967
  463    HB2  TRP  23           HB2      TRP  23  20.451  11.597  14.499
  464    HB3  TRP  23           HB1      TRP  23  19.885  10.029  15.062
  465    HD1  TRP  23           HD1      TRP  23  20.635  12.011  11.995
  466    HE1  TRP  23           HE1      TRP  23  20.129  10.606   9.894
  467    HE3  TRP  23           HE3      TRP  23  18.151   8.092  14.131
  468    HZ2  TRP  23           HZ2      TRP  23  18.839   8.148   9.209
  469    HZ3  TRP  23           HZ3      TRP  23  17.295   6.234  12.731
  470    HH2  TRP  23           HH2      TRP  23  17.636   6.257  10.274
  471    H    THR  24           HN       THR  24  18.182  10.334  17.085
  472    HA   THR  24           HA       THR  24  16.576   8.102  16.332
  473    HB   THR  24           HB       THR  24  16.333   7.844  18.858
  474    HG1  THR  24           HG1      THR  24  16.989   9.429  20.038
  475   HG21  THR  24          HG21      THR  24  18.026   6.542  17.886
  476   HG22  THR  24          HG22      THR  24  18.900   7.484  19.095
  477   HG23  THR  24          HG23      THR  24  18.967   7.953  17.397
  478    H    ILE  25           HN       ILE  25  15.871  11.244  17.831
  479    HA   ILE  25           HA       ILE  25  13.169  10.719  18.471
  480    HB   ILE  25           HB       ILE  25  14.647  13.276  17.849
  481   HG12  ILE  25          HG12      ILE  25  13.562  12.248  20.481
  482   HG13  ILE  25          HG11      ILE  25  15.186  11.859  19.917
  483   HG21  ILE  25          HG21      ILE  25  11.782  12.792  18.689
  484   HG22  ILE  25          HG22      ILE  25  12.378  13.794  17.366
  485   HG23  ILE  25          HG23      ILE  25  12.609  14.311  19.035
  486   HD11  ILE  25          HD11      ILE  25  15.509  14.398  19.625
  487   HD12  ILE  25          HD12      ILE  25  15.468  13.784  21.276
  488   HD13  ILE  25          HD13      ILE  25  14.046  14.574  20.595
  489    H    GLY  26           HN       GLY  26  14.678  12.159  15.588
  490    HA2  GLY  26           HA2      GLY  26  12.282  12.683  14.179
  491    HA3  GLY  26           HA1      GLY  26  13.875  12.497  13.451
  492    H    HIS  27           HN       HIS  27  14.428   9.864  14.255
  493    HA   HIS  27           HA       HIS  27  13.253   8.361  12.214
  494    HB2  HIS  27           HB2      HIS  27  15.337   7.642  13.163
  495    HB3  HIS  27           HB1      HIS  27  14.627   7.512  14.772
  496    HD2  HIS  27           HD2      HIS  27  13.472   5.048  15.310
  497    HE1  HIS  27           HE1      HIS  27  13.555   3.511  11.377
  498    HE2  HIS  27           HE2      HIS  27  13.031   2.962  13.801
  499    H    LEU  28           HN       LEU  28  12.454   8.552  15.677
  500    HA   LEU  28           HA       LEU  28  10.292   6.657  15.434
  501    HB2  LEU  28           HB2      LEU  28  11.735   7.257  17.530
  502    HB3  LEU  28           HB1      LEU  28  10.586   8.583  17.717
  503    HG   LEU  28           HG       LEU  28   9.371   5.941  17.165
  504   HD11  LEU  28          HD11      LEU  28  10.552   6.510  19.895
  505   HD12  LEU  28          HD12      LEU  28  11.327   5.454  18.715
  506   HD13  LEU  28          HD13      LEU  28   9.739   5.039  19.359
  507   HD21  LEU  28          HD21      LEU  28   8.836   7.951  19.366
  508   HD22  LEU  28          HD22      LEU  28   7.725   6.748  18.711
  509   HD23  LEU  28          HD23      LEU  28   8.197   8.138  17.733
  510    H    ASN  29           HN       ASN  29   8.375   7.120  14.571
  511    HA   ASN  29           HA       ASN  29   7.412   9.917  14.686
  512    HB2  ASN  29           HB2      ASN  29   6.785   7.793  12.621
  513    HB3  ASN  29           HB1      ASN  29   6.179   9.449  12.622
  514   HD21  ASN  29          HD21      ASN  29   8.313  11.046  13.073
  515   HD22  ASN  29          HD22      ASN  29   9.562  10.763  11.959
  516    H    GLN  30           HN       GLN  30   5.335  10.309  15.344
  517    HA   GLN  30           HA       GLN  30   3.885   7.997  16.478
  518    HB2  GLN  30           HB2      GLN  30   4.074  10.887  17.287
  519    HB3  GLN  30           HB1      GLN  30   2.708   9.894  17.798
  520    HG2  GLN  30           HG2      GLN  30   5.600   9.102  18.220
  521    HG3  GLN  30           HG1      GLN  30   4.633   9.937  19.434
  522   HE21  GLN  30          HE21      GLN  30   2.680   8.767  20.259
  523   HE22  GLN  30          HE22      GLN  30   2.634   7.071  20.189
  524    H    ILE  31           HN       ILE  31   2.146   7.379  15.389
  525    HA   ILE  31           HA       ILE  31   0.738   9.367  13.713
  526    HB   ILE  31           HB       ILE  31   0.968   6.363  13.437
  527   HG12  ILE  31          HG12      ILE  31   1.769   8.513  11.469
  528   HG13  ILE  31          HG11      ILE  31   2.880   7.944  12.716
  529   HG21  ILE  31          HG21      ILE  31  -0.314   6.839  11.275
  530   HG22  ILE  31          HG22      ILE  31  -0.714   8.409  11.971
  531   HG23  ILE  31          HG23      ILE  31  -1.253   6.928  12.764
  532   HD11  ILE  31          HD11      ILE  31   3.075   6.748  10.487
  533   HD12  ILE  31          HD12      ILE  31   1.467   6.087  10.784
  534   HD13  ILE  31          HD13      ILE  31   2.798   5.694  11.874
  535    H    LYS  32           HN       LYS  32  -1.276   9.891  14.249
  536    HA   LYS  32           HA       LYS  32  -2.771   8.076  16.048
  537    HB2  LYS  32           HB2      LYS  32  -2.573  11.091  16.070
  538    HB3  LYS  32           HB1      LYS  32  -3.851  10.213  16.912
  539    HG2  LYS  32           HG2      LYS  32  -2.279   9.079  18.313
  540    HG3  LYS  32           HG1      LYS  32  -0.915   9.610  17.328
  541    HD2  LYS  32           HD2      LYS  32  -0.953  11.016  19.280
  542    HD3  LYS  32           HD1      LYS  32  -1.541  11.991  17.933
  543    HE2  LYS  32           HE2      LYS  32  -2.999  12.325  19.864
  544    HE3  LYS  32           HE1      LYS  32  -3.879  11.461  18.606
  545    HZ1  LYS  32           HZ1      LYS  32  -4.222   9.803  20.011
  546    HZ2  LYS  32           HZ2      LYS  32  -3.423  10.662  21.237
  547    HZ3  LYS  32           HZ3      LYS  32  -2.555   9.591  20.246
  548    H    ARG  33           HN       ARG  33  -4.432   7.223  14.985
  549    HA   ARG  33           HA       ARG  33  -5.684   8.756  12.806
  550    HB2  ARG  33           HB2      ARG  33  -5.853   5.818  13.522
  551    HB3  ARG  33           HB1      ARG  33  -6.687   6.576  12.166
  552    HG2  ARG  33           HG2      ARG  33  -4.551   7.247  11.186
  553    HG3  ARG  33           HG1      ARG  33  -3.682   6.582  12.570
  554    HD2  ARG  33           HD2      ARG  33  -3.603   4.966  10.771
  555    HD3  ARG  33           HD1      ARG  33  -4.653   4.334  12.025
  556    HE   ARG  33           HE       ARG  33  -5.470   5.348   9.392
  557   HH11  ARG  33          HH11      ARG  33  -6.415   4.054  12.503
  558   HH12  ARG  33          HH12      ARG  33  -7.990   3.611  11.960
  559   HH21  ARG  33          HH21      ARG  33  -7.533   4.766   8.739
  560   HH22  ARG  33          HH22      ARG  33  -8.624   4.014   9.853
  561    H1   MET   1           HT1      MET   1  51.167  -5.090  23.968
  562    H2   MET   1           HT2      MET   1  50.099  -5.214  25.284
  563    H3   MET   1           HT3      MET   1  50.874  -3.739  24.951
  564    HA   MET   1           HA       MET   1  48.989  -3.198  23.906
  565    HB2  MET   1           HB2      MET   1  50.788  -3.847  22.124
  566    HB3  MET   1           HB1      MET   1  49.733  -5.226  21.811
  567    HG2  MET   1           HG2      MET   1  47.872  -3.297  21.804
  568    HG3  MET   1           HG1      MET   1  49.259  -2.325  21.311
  569    HE1  MET   1           HE1      MET   1  48.145  -6.173  20.494
  570    HE2  MET   1           HE2      MET   1  47.101  -5.681  19.162
  571    HE3  MET   1           HE3      MET   1  46.846  -5.003  20.768
  572    H    PHE   2           HN       PHE   2  47.070  -3.757  24.738
  573    HA   PHE   2           HA       PHE   2  46.217  -6.568  24.648
  574    HB2  PHE   2           HB2      PHE   2  46.070  -5.397  26.816
  575    HB3  PHE   2           HB1      PHE   2  44.993  -4.205  26.088
  576    HD1  PHE   2           HD1      PHE   2  45.360  -7.871  26.710
  577    HD2  PHE   2           HD2      PHE   2  42.670  -4.609  25.950
  578    HE1  PHE   2           HE1      PHE   2  43.426  -9.368  27.126
  579    HE2  PHE   2           HE2      PHE   2  40.737  -6.106  26.366
  580    HZ   PHE   2           HZ       PHE   2  41.115  -8.485  26.954
  581    H    GLU   3           HN       GLU   3  44.976  -3.313  23.896
  582    HA   GLU   3           HA       GLU   3  42.862  -4.500  22.281
  583    HB2  GLU   3           HB2      GLU   3  43.431  -1.623  23.008
  584    HB3  GLU   3           HB1      GLU   3  42.046  -2.160  22.061
  585    HG2  GLU   3           HG2      GLU   3  41.040  -2.238  24.111
  586    HG3  GLU   3           HG1      GLU   3  41.807  -3.823  24.176
  587    HA   PRO   4           HA       PRO   4  44.695  -3.953  18.309
  588    HB2  PRO   4           HB2      PRO   4  42.331  -2.336  17.481
  589    HB3  PRO   4           HB1      PRO   4  42.993  -3.818  16.765
  590    HG2  PRO   4           HG2      PRO   4  40.755  -3.870  18.178
  591    HG3  PRO   4           HG1      PRO   4  41.938  -5.185  18.287
  592    HD2  PRO   4           HD2      PRO   4  41.415  -2.966  20.243
  593    HD3  PRO   4           HD1      PRO   4  41.824  -4.669  20.545
  594    H    PHE   5           HN       PHE   5  43.130  -1.027  19.590
  595    HA   PHE   5           HA       PHE   5  45.499   0.535  18.837
  596    HB2  PHE   5           HB2      PHE   5  42.768   0.870  17.739
  597    HB3  PHE   5           HB1      PHE   5  43.579   2.350  18.254
  598    HD1  PHE   5           HD1      PHE   5  43.804  -0.597  16.018
  599    HD2  PHE   5           HD2      PHE   5  45.499   3.204  17.084
  600    HE1  PHE   5           HE1      PHE   5  45.179  -0.630  13.954
  601    HE2  PHE   5           HE2      PHE   5  46.873   3.170  15.020
  602    HZ   PHE   5           HZ       PHE   5  46.713   1.253  13.453
  603    H    GLN   6           HN       GLN   6  42.313   1.633  19.903
  604    HA   GLN   6           HA       GLN   6  43.253   2.017  22.636
  605    HB2  GLN   6           HB2      GLN   6  42.956   4.196  20.660
  606    HB3  GLN   6           HB1      GLN   6  42.190   4.485  22.222
  607    HG2  GLN   6           HG2      GLN   6  45.060   3.571  21.890
  608    HG3  GLN   6           HG1      GLN   6  44.582   5.254  22.114
  609   HE21  GLN   6          HE21      GLN   6  43.608   5.847  24.215
  610   HE22  GLN   6          HE22      GLN   6  43.834   4.856  25.575
  611    H    ILE   7           HN       ILE   7  41.474   2.947  24.003
  612    HA   ILE   7           HA       ILE   7  39.146   1.393  23.776
  613    HB   ILE   7           HB       ILE   7  39.735   3.887  25.379
  614   HG12  ILE   7          HG12      ILE   7  39.412   1.016  26.287
  615   HG13  ILE   7          HG11      ILE   7  40.972   1.687  25.811
  616   HG21  ILE   7          HG21      ILE   7  37.302   2.089  25.338
  617   HG22  ILE   7          HG22      ILE   7  37.357   3.845  25.165
  618   HG23  ILE   7          HG23      ILE   7  37.709   3.100  26.725
  619   HD11  ILE   7          HD11      ILE   7  39.195   2.557  28.100
  620   HD12  ILE   7          HD12      ILE   7  40.521   3.556  27.501
  621   HD13  ILE   7          HD13      ILE   7  40.854   1.962  28.179
  622    H    LEU   8           HN       LEU   8  39.793   4.749  22.905
  623    HA   LEU   8           HA       LEU   8  37.141   5.455  22.183
  624    HB2  LEU   8           HB2      LEU   8  39.028   7.070  22.600
  625    HB3  LEU   8           HB1      LEU   8  39.687   6.609  21.030
  626    HG   LEU   8           HG       LEU   8  36.823   7.285  20.972
  627   HD11  LEU   8          HD11      LEU   8  38.840   9.499  21.436
  628   HD12  LEU   8          HD12      LEU   8  37.755   8.895  22.688
  629   HD13  LEU   8          HD13      LEU   8  37.095   9.665  21.247
  630   HD21  LEU   8          HD21      LEU   8  37.556   8.513  18.967
  631   HD22  LEU   8          HD22      LEU   8  38.223   6.881  18.968
  632   HD23  LEU   8          HD23      LEU   8  39.242   8.249  19.412
  633    H    SER   9           HN       SER   9  39.773   3.933  20.462
  634    HA   SER   9           HA       SER   9  38.587   4.078  17.848
  635    HB2  SER   9           HB2      SER   9  40.774   2.312  18.955
  636    HB3  SER   9           HB1      SER   9  40.299   2.352  17.261
  637    HG   SER   9           HG       SER   9  42.084   3.780  17.935
  638    H    ILE  10           HN       ILE  10  38.683   1.628  20.416
  639    HA   ILE  10           HA       ILE  10  37.361  -0.416  18.967
  640    HB   ILE  10           HB       ILE  10  37.721   0.131  21.907
  641   HG12  ILE  10          HG12      ILE  10  39.576  -0.706  20.298
  642   HG13  ILE  10          HG11      ILE  10  39.326  -1.604  21.793
  643   HG21  ILE  10          HG21      ILE  10  35.633  -0.994  21.880
  644   HG22  ILE  10          HG22      ILE  10  36.818  -2.272  22.142
  645   HG23  ILE  10          HG23      ILE  10  36.112  -2.038  20.542
  646   HD11  ILE  10          HD11      ILE  10  37.832  -2.415  19.303
  647   HD12  ILE  10          HD12      ILE  10  38.285  -3.392  20.696
  648   HD13  ILE  10          HD13      ILE  10  39.504  -2.911  19.527
  649    H    CYS  11           HN       CYS  11  36.156   2.118  21.152
  650    HA   CYS  11           HA       CYS  11  33.464   1.305  21.172
  651    HB2  CYS  11           HB2      CYS  11  34.750   4.019  21.496
  652    HB3  CYS  11           HB1      CYS  11  33.021   3.741  21.709
  653    HG   CYS  11           HG       CYS  11  34.916   1.957  23.392
  654    H    SER  12           HN       SER  12  35.106   3.736  19.117
  655    HA   SER  12           HA       SER  12  32.885   4.388  17.553
  656    HB2  SER  12           HB2      SER  12  35.831   4.382  16.877
  657    HB3  SER  12           HB1      SER  12  34.590   5.056  15.822
  658    HG   SER  12           HG       SER  12  35.760   6.173  17.927
  659    H    PHE  13           HN       PHE  13  35.227   1.764  17.226
  660    HA   PHE  13           HA       PHE  13  34.474   0.842  14.685
  661    HB2  PHE  13           HB2      PHE  13  36.107  -0.059  16.880
  662    HB3  PHE  13           HB1      PHE  13  35.164  -1.407  16.244
  663    HD1  PHE  13           HD1      PHE  13  38.047   0.649  15.753
  664    HD2  PHE  13           HD2      PHE  13  35.105  -1.680  13.663
  665    HE1  PHE  13           HE1      PHE  13  39.556   0.504  13.789
  666    HE2  PHE  13           HE2      PHE  13  36.612  -1.825  11.700
  667    HZ   PHE  13           HZ       PHE  13  38.838  -0.733  11.762
  668    H    ILE  14           HN       ILE  14  33.358  -0.217  17.910
  669    HA   ILE  14           HA       ILE  14  31.472  -2.101  16.965
  670    HB   ILE  14           HB       ILE  14  31.598  -0.566  19.572
  671   HG12  ILE  14          HG12      ILE  14  32.334  -3.449  19.005
  672   HG13  ILE  14          HG11      ILE  14  33.512  -2.143  18.888
  673   HG21  ILE  14          HG21      ILE  14  30.168  -2.526  20.359
  674   HG22  ILE  14          HG22      ILE  14  29.903  -2.903  18.657
  675   HG23  ILE  14          HG23      ILE  14  29.351  -1.364  19.315
  676   HD11  ILE  14          HD11      ILE  14  32.748  -1.505  21.283
  677   HD12  ILE  14          HD12      ILE  14  33.763  -2.935  21.101
  678   HD13  ILE  14          HD13      ILE  14  32.024  -3.113  21.327
  679    H    LEU  15           HN       LEU  15  31.226   1.318  17.812
  680    HA   LEU  15           HA       LEU  15  28.422   1.556  17.589
  681    HB2  LEU  15           HB2      LEU  15  30.681   3.524  17.324
  682    HB3  LEU  15           HB1      LEU  15  29.008   4.013  17.049
  683    HG   LEU  15           HG       LEU  15  29.865   2.540  19.546
  684   HD11  LEU  15          HD11      LEU  15  29.765   4.846  20.608
  685   HD12  LEU  15          HD12      LEU  15  29.788   5.513  18.976
  686   HD13  LEU  15          HD13      LEU  15  31.155   4.565  19.561
  687   HD21  LEU  15          HD21      LEU  15  27.762   3.751  20.378
  688   HD22  LEU  15          HD22      LEU  15  27.496   2.460  19.210
  689   HD23  LEU  15          HD23      LEU  15  27.441   4.143  18.689
  690    H    SER  16           HN       SER  16  30.867   2.642  15.237
  691    HA   SER  16           HA       SER  16  29.278   3.219  13.100
  692    HB2  SER  16           HB2      SER  16  31.944   1.783  13.007
  693    HB3  SER  16           HB1      SER  16  31.176   2.581  11.638
  694    HG   SER  16           HG       SER  16  32.771   3.817  12.944
  695    H    ALA  17           HN       ALA  17  30.391  -0.004  14.097
  696    HA   ALA  17           HA       ALA  17  29.404  -1.476  11.931
  697    HB1  ALA  17           HB1      ALA  17  30.859  -2.403  13.707
  698    HB2  ALA  17           HB2      ALA  17  29.416  -3.389  13.461
  699    HB3  ALA  17           HB3      ALA  17  29.515  -2.299  14.843
  700    H    LEU  18           HN       LEU  18  27.821  -1.064  15.116
  701    HA   LEU  18           HA       LEU  18  25.321  -2.106  14.289
  702    HB2  LEU  18           HB2      LEU  18  26.354  -0.596  16.623
  703    HB3  LEU  18           HB1      LEU  18  24.618  -0.493  16.336
  704    HG   LEU  18           HG       LEU  18  25.373  -2.413  17.825
  705   HD11  LEU  18          HD11      LEU  18  23.969  -3.323  15.305
  706   HD12  LEU  18          HD12      LEU  18  23.198  -2.264  16.485
  707   HD13  LEU  18          HD13      LEU  18  23.712  -3.882  16.957
  708   HD21  LEU  18          HD21      LEU  18  26.524  -4.253  16.909
  709   HD22  LEU  18          HD22      LEU  18  27.372  -2.879  16.202
  710   HD23  LEU  18          HD23      LEU  18  26.185  -3.769  15.248
  711    H    HIS  19           HN       HIS  19  26.802   0.928  13.753
  712    HA   HIS  19           HA       HIS  19  24.478   2.522  13.479
  713    HB2  HIS  19           HB2      HIS  19  26.891   3.308  13.802
  714    HB3  HIS  19           HB1      HIS  19  27.099   3.005  12.077
  715    HD2  HIS  19           HD2      HIS  19  24.175   4.212  11.057
  716    HE1  HIS  19           HE1      HIS  19  25.446   7.771  12.938
  717    HE2  HIS  19           HE2      HIS  19  23.808   6.789  11.263
  718    H    PHE  20           HN       PHE  20  26.566   0.866  11.124
  719    HA   PHE  20           HA       PHE  20  24.905   1.614   8.911
  720    HB2  PHE  20           HB2      PHE  20  27.452   0.377   9.293
  721    HB3  PHE  20           HB1      PHE  20  26.470  -0.664   8.260
  722    HD1  PHE  20           HD1      PHE  20  28.447   2.328   8.415
  723    HD2  PHE  20           HD2      PHE  20  25.227   0.442   6.289
  724    HE1  PHE  20           HE1      PHE  20  28.804   3.872   6.506
  725    HE2  PHE  20           HE2      PHE  20  25.584   1.985   4.380
  726    HZ   PHE  20           HZ       PHE  20  27.370   3.700   4.486
  727    H    MET  21           HN       MET  21  24.909  -0.966  11.243
  728    HA   MET  21           HA       MET  21  23.462  -2.871   9.688
  729    HB2  MET  21           HB2      MET  21  23.828  -2.487  12.660
  730    HB3  MET  21           HB1      MET  21  22.959  -3.853  11.957
  731    HG2  MET  21           HG2      MET  21  25.768  -3.129  11.119
  732    HG3  MET  21           HG1      MET  21  25.441  -4.242  12.445
  733    HE1  MET  21           HE1      MET  21  23.273  -6.014  11.960
  734    HE2  MET  21           HE2      MET  21  24.908  -6.606  12.241
  735    HE3  MET  21           HE3      MET  21  23.934  -7.310  10.953
  736    H    ALA  22           HN       ALA  22  22.425  -0.690  12.306
  737    HA   ALA  22           HA       ALA  22  19.652  -1.251  11.958
  738    HB1  ALA  22           HB1      ALA  22  20.700   1.281  13.182
  739    HB2  ALA  22           HB2      ALA  22  20.847  -0.267  14.014
  740    HB3  ALA  22           HB3      ALA  22  19.252   0.366  13.604
  741    H    TRP  23           HN       TRP  23  21.783   1.292  10.731
  742    HA   TRP  23           HA       TRP  23  19.781   2.940   9.621
  743    HB2  TRP  23           HB2      TRP  23  22.343   3.336   9.955
  744    HB3  TRP  23           HB1      TRP  23  22.475   2.654   8.338
  745    HD1  TRP  23           HD1      TRP  23  21.530   5.732  10.220
  746    HE1  TRP  23           HE1      TRP  23  20.762   7.565   8.580
  747    HE3  TRP  23           HE3      TRP  23  21.159   2.981   5.932
  748    HZ2  TRP  23           HZ2      TRP  23  20.077   7.830   5.817
  749    HZ3  TRP  23           HZ3      TRP  23  20.447   4.050   3.812
  750    HH2  TRP  23           HH2      TRP  23  19.905   6.468   3.749
  751    H    THR  24           HN       THR  24  21.560   0.162   8.306
  752    HA   THR  24           HA       THR  24  20.501   0.371   5.668
  753    HB   THR  24           HB       THR  24  21.223  -2.074   5.540
  754    HG1  THR  24           HG1      THR  24  21.762  -2.997   7.327
  755   HG21  THR  24          HG21      THR  24  22.777  -0.531   4.695
  756   HG22  THR  24          HG22      THR  24  23.704  -1.390   5.924
  757   HG23  THR  24          HG23      THR  24  23.049   0.209   6.274
  758    H    ILE  25           HN       ILE  25  19.491  -1.376   8.588
  759    HA   ILE  25           HA       ILE  25  17.437  -2.901   7.388
  760    HB   ILE  25           HB       ILE  25  17.817  -1.877  10.201
  761   HG12  ILE  25          HG12      ILE  25  18.038  -4.691   9.109
  762   HG13  ILE  25          HG11      ILE  25  19.411  -3.585   9.148
  763   HG21  ILE  25          HG21      ILE  25  15.676  -3.647   9.006
  764   HG22  ILE  25          HG22      ILE  25  15.473  -2.229  10.034
  765   HG23  ILE  25          HG23      ILE  25  16.102  -3.727  10.716
  766   HD11  ILE  25          HD11      ILE  25  18.874  -3.273  11.646
  767   HD12  ILE  25          HD12      ILE  25  19.574  -4.819  11.170
  768   HD13  ILE  25          HD13      ILE  25  17.842  -4.694  11.480
  769    H    GLY  26           HN       GLY  26  17.393   0.284   8.967
  770    HA2  GLY  26           HA2      GLY  26  14.612   0.754   8.708
  771    HA3  GLY  26           HA1      GLY  26  15.843   1.997   8.918
  772    H    HIS  27           HN       HIS  27  17.367   1.517   6.608
  773    HA   HIS  27           HA       HIS  27  16.046   3.060   4.693
  774    HB2  HIS  27           HB2      HIS  27  18.440   2.918   4.653
  775    HB3  HIS  27           HB1      HIS  27  18.391   1.167   4.449
  776    HD2  HIS  27           HD2      HIS  27  18.248   0.334   1.807
  777    HE1  HIS  27           HE1      HIS  27  17.418   4.090   0.069
  778    HE2  HIS  27           HE2      HIS  27  17.935   1.654  -0.424
  779    H    LEU  28           HN       LEU  28  16.465  -0.467   4.903
  780    HA   LEU  28           HA       LEU  28  14.984  -0.941   2.473
  781    HB2  LEU  28           HB2      LEU  28  16.822  -2.416   3.602
  782    HB3  LEU  28           HB1      LEU  28  15.481  -3.032   4.568
  783    HG   LEU  28           HG       LEU  28  14.956  -2.863   1.661
  784   HD11  LEU  28          HD11      LEU  28  16.783  -5.025   2.732
  785   HD12  LEU  28          HD12      LEU  28  17.377  -3.617   1.851
  786   HD13  LEU  28          HD13      LEU  28  16.294  -4.763   1.059
  787   HD21  LEU  28          HD21      LEU  28  14.658  -5.171   3.599
  788   HD22  LEU  28          HD22      LEU  28  13.781  -4.907   2.093
  789   HD23  LEU  28          HD23      LEU  28  13.475  -3.868   3.484
  790    H    ASN  29           HN       ASN  29  12.842  -0.815   2.321
  791    HA   ASN  29           HA       ASN  29  11.220  -1.341   4.741
  792    HB2  ASN  29           HB2      ASN  29  10.558   0.436   2.381
  793    HB3  ASN  29           HB1      ASN  29   9.544   0.175   3.798
  794   HD21  ASN  29          HD21      ASN  29  11.145   0.454   5.955
  795   HD22  ASN  29          HD22      ASN  29  11.965   1.940   5.950
  796    H    GLN  30           HN       GLN  30   9.474  -2.692   4.588
  797    HA   GLN  30           HA       GLN  30   9.225  -4.192   2.054
  798    HB2  GLN  30           HB2      GLN  30   8.844  -4.970   4.934
  799    HB3  GLN  30           HB1      GLN  30   8.080  -5.896   3.641
  800    HG2  GLN  30           HG2      GLN  30  11.040  -5.259   3.716
  801    HG3  GLN  30           HG1      GLN  30  10.351  -6.758   4.337
  802   HE21  GLN  30          HE21      GLN  30   9.220  -8.177   2.732
  803   HE22  GLN  30          HE22      GLN  30   9.642  -8.077   1.091
  804    H    ILE  31           HN       ILE  31   7.471  -3.766   0.899
  805    HA   ILE  31           HA       ILE  31   5.070  -2.744   2.288
  806    HB   ILE  31           HB       ILE  31   6.040  -2.318  -0.546
  807   HG12  ILE  31          HG12      ILE  31   5.467  -0.259   1.591
  808   HG13  ILE  31          HG11      ILE  31   7.052  -1.020   1.444
  809   HG21  ILE  31          HG21      ILE  31   4.016  -0.753  -0.607
  810   HG22  ILE  31          HG22      ILE  31   3.447  -1.593   0.836
  811   HG23  ILE  31          HG23      ILE  31   3.660  -2.480  -0.673
  812   HD11  ILE  31          HD11      ILE  31   6.803   1.171   0.189
  813   HD12  ILE  31          HD12      ILE  31   5.656   0.347  -0.869
  814   HD13  ILE  31          HD13      ILE  31   7.333  -0.193  -0.793
  815    H    LYS  32           HN       LYS  32   3.298  -3.961   2.265
  816    HA   LYS  32           HA       LYS  32   3.096  -6.117   0.248
  817    HB2  LYS  32           HB2      LYS  32   2.419  -6.155   3.191
  818    HB3  LYS  32           HB1      LYS  32   1.814  -7.364   2.059
  819    HG2  LYS  32           HG2      LYS  32   4.026  -8.095   1.512
  820    HG3  LYS  32           HG1      LYS  32   4.757  -6.713   2.328
  821    HD2  LYS  32           HD2      LYS  32   4.989  -8.594   3.807
  822    HD3  LYS  32           HD1      LYS  32   3.723  -7.567   4.478
  823    HE2  LYS  32           HE2      LYS  32   2.985  -9.895   4.533
  824    HE3  LYS  32           HE1      LYS  32   2.012  -8.998   3.370
  825    HZ1  LYS  32           HZ1      LYS  32   2.661 -10.382   1.788
  826    HZ2  LYS  32           HZ2      LYS  32   3.549 -11.278   2.923
  827    HZ3  LYS  32           HZ3      LYS  32   4.293 -10.015   2.066
  828    H    ARG  33           HN       ARG  33   1.489  -5.679  -1.111
  829    HA   ARG  33           HA       ARG  33  -0.815  -4.117  -0.153
  830    HB2  ARG  33           HB2      ARG  33   0.122  -4.761  -2.959
  831    HB3  ARG  33           HB1      ARG  33  -1.306  -3.804  -2.566
  832    HG2  ARG  33           HG2      ARG  33   0.075  -2.162  -1.400
  833    HG3  ARG  33           HG1      ARG  33   1.518  -3.134  -1.694
  834    HD2  ARG  33           HD2      ARG  33   1.436  -1.374  -3.352
  835    HD3  ARG  33           HD1      ARG  33   1.107  -2.897  -4.156
  836    HE   ARG  33           HE       ARG  33  -0.817  -0.745  -3.607
  837   HH11  ARG  33          HH11      ARG  33  -0.225  -3.951  -4.881
  838   HH12  ARG  33          HH12      ARG  33  -1.694  -3.979  -5.783
  839   HH21  ARG  33          HH21      ARG  33  -2.719  -0.836  -4.787
  840   HH22  ARG  33          HH22      ARG  33  -3.098  -2.239  -5.729
  841    H1   MET   1           HT1      MET   1  57.860   4.871   2.689
  842    H2   MET   1           HT2      MET   1  57.345   3.265   2.479
  843    H3   MET   1           HT3      MET   1  57.538   3.901   4.042
  844    HA   MET   1           HA       MET   1  55.347   4.256   3.968
  845    HB2  MET   1           HB2      MET   1  56.584   6.521   3.553
  846    HB3  MET   1           HB1      MET   1  55.907   6.397   1.928
  847    HG2  MET   1           HG2      MET   1  53.687   5.843   3.326
  848    HG3  MET   1           HG1      MET   1  54.520   6.820   4.534
  849    HE1  MET   1           HE1      MET   1  54.298   7.051   0.458
  850    HE2  MET   1           HE2      MET   1  52.792   7.963   0.505
  851    HE3  MET   1           HE3      MET   1  52.889   6.394   1.303
  852    H    PHE   2           HN       PHE   2  54.025   2.795   3.071
  853    HA   PHE   2           HA       PHE   2  53.990   2.478   0.149
  854    HB2  PHE   2           HB2      PHE   2  54.228   0.439   1.521
  855    HB3  PHE   2           HB1      PHE   2  52.692   0.801   2.308
  856    HD1  PHE   2           HD1      PHE   2  54.227   0.197  -1.045
  857    HD2  PHE   2           HD2      PHE   2  50.654   0.114   1.337
  858    HE1  PHE   2           HE1      PHE   2  53.016  -0.917  -2.900
  859    HE2  PHE   2           HE2      PHE   2  49.442  -1.000  -0.519
  860    HZ   PHE   2           HZ       PHE   2  50.624  -1.516  -2.638
  861    H    GLU   3           HN       GLU   3  51.724   2.863   2.874
  862    HA   GLU   3           HA       GLU   3  49.618   3.622   1.016
  863    HB2  GLU   3           HB2      GLU   3  49.585   3.253   4.012
  864    HB3  GLU   3           HB1      GLU   3  48.172   3.646   3.037
  865    HG2  GLU   3           HG2      GLU   3  47.935   1.373   2.983
  866    HG3  GLU   3           HG1      GLU   3  49.085   1.513   1.654
  867    HA   PRO   4           HA       PRO   4  49.865   8.003   1.463
  868    HB2  PRO   4           HB2      PRO   4  47.015   8.036   2.334
  869    HB3  PRO   4           HB1      PRO   4  47.790   8.874   0.976
  870    HG2  PRO   4           HG2      PRO   4  46.225   6.777   0.569
  871    HG3  PRO   4           HG1      PRO   4  47.691   7.028  -0.395
  872    HD2  PRO   4           HD2      PRO   4  47.238   5.102   1.864
  873    HD3  PRO   4           HD1      PRO   4  48.172   4.892   0.366
  874    H    PHE   5           HN       PHE   5  48.055   6.382   4.061
  875    HA   PHE   5           HA       PHE   5  49.535   7.966   6.042
  876    HB2  PHE   5           HB2      PHE   5  46.616   8.072   5.555
  877    HB3  PHE   5           HB1      PHE   5  47.110   7.928   7.241
  878    HD1  PHE   5           HD1      PHE   5  47.403   9.986   4.175
  879    HD2  PHE   5           HD2      PHE   5  48.243   9.721   8.379
  880    HE1  PHE   5           HE1      PHE   5  47.991  12.395   4.209
  881    HE2  PHE   5           HE2      PHE   5  48.831  12.131   8.414
  882    HZ   PHE   5           HZ       PHE   5  48.702  13.475   6.326
  883    H    GLN   6           HN       GLN   6  46.685   5.915   6.460
  884    HA   GLN   6           HA       GLN   6  48.309   3.691   7.415
  885    HB2  GLN   6           HB2      GLN   6  46.811   5.529   9.178
  886    HB3  GLN   6           HB1      GLN   6  46.534   3.812   9.473
  887    HG2  GLN   6           HG2      GLN   6  49.283   5.071   9.253
  888    HG3  GLN   6           HG1      GLN   6  48.460   4.762  10.781
  889   HE21  GLN   6          HE21      GLN   6  48.088   2.481  11.388
  890   HE22  GLN   6          HE22      GLN   6  48.999   1.242  10.666
  891    H    ILE   7           HN       ILE   7  46.876   1.831   8.056
  892    HA   ILE   7           HA       ILE   7  45.120   1.182   5.960
  893    HB   ILE   7           HB       ILE   7  45.485  -0.017   8.712
  894   HG12  ILE   7          HG12      ILE   7  46.269  -1.096   5.993
  895   HG13  ILE   7          HG11      ILE   7  47.347  -0.087   6.958
  896   HG21  ILE   7          HG21      ILE   7  43.756  -0.885   6.386
  897   HG22  ILE   7          HG22      ILE   7  43.272  -0.636   8.064
  898   HG23  ILE   7          HG23      ILE   7  44.294  -2.007   7.636
  899   HD11  ILE   7          HD11      ILE   7  46.229  -2.809   7.658
  900   HD12  ILE   7          HD12      ILE   7  46.966  -1.753   8.864
  901   HD13  ILE   7          HD13      ILE   7  47.921  -2.339   7.503
  902    H    LEU   8           HN       LEU   8  44.506   2.355   9.236
  903    HA   LEU   8           HA       LEU   8  41.679   2.150   9.168
  904    HB2  LEU   8           HB2      LEU   8  43.082   2.472  11.235
  905    HB3  LEU   8           HB1      LEU   8  43.304   4.153  10.748
  906    HG   LEU   8           HG       LEU   8  40.502   3.250  10.692
  907   HD11  LEU   8          HD11      LEU   8  41.875   3.597  13.372
  908   HD12  LEU   8          HD12      LEU   8  41.456   2.025  12.691
  909   HD13  LEU   8          HD13      LEU   8  40.185   3.182  13.082
  910   HD21  LEU   8          HD21      LEU   8  40.188   5.433  11.789
  911   HD22  LEU   8          HD22      LEU   8  41.242   5.597  10.384
  912   HD23  LEU   8          HD23      LEU   8  41.931   5.584  12.008
  913    H    SER   9           HN       SER   9  43.933   4.613   8.124
  914    HA   SER   9           HA       SER   9  41.977   6.660   7.635
  915    HB2  SER   9           HB2      SER   9  44.800   6.301   6.617
  916    HB3  SER   9           HB1      SER   9  43.816   7.729   6.315
  917    HG   SER   9           HG       SER   9  45.260   7.769   8.212
  918    H    ILE  10           HN       ILE  10  43.556   4.186   5.639
  919    HA   ILE  10           HA       ILE  10  42.455   5.011   3.163
  920    HB   ILE  10           HB       ILE  10  43.573   2.397   4.158
  921   HG12  ILE  10          HG12      ILE  10  44.969   4.511   3.596
  922   HG13  ILE  10          HG11      ILE  10  45.467   2.986   2.868
  923   HG21  ILE  10          HG21      ILE  10  41.980   1.660   2.565
  924   HG22  ILE  10          HG22      ILE  10  43.487   1.771   1.659
  925   HG23  ILE  10          HG23      ILE  10  42.270   3.039   1.504
  926   HD11  ILE  10          HD11      ILE  10  43.536   4.775   1.398
  927   HD12  ILE  10          HD12      ILE  10  44.662   3.585   0.751
  928   HD13  ILE  10          HD13      ILE  10  45.259   5.121   1.360
  929    H    CYS  11           HN       CYS  11  41.365   2.646   5.591
  930    HA   CYS  11           HA       CYS  11  39.156   1.672   4.150
  931    HB2  CYS  11           HB2      CYS  11  39.682   1.920   7.115
  932    HB3  CYS  11           HB1      CYS  11  38.259   1.114   6.453
  933    HG   CYS  11           HG       CYS  11  41.004   0.114   5.420
  934    H    SER  12           HN       SER  12  39.319   4.258   6.626
  935    HA   SER  12           HA       SER  12  36.627   4.992   6.501
  936    HB2  SER  12           HB2      SER  12  39.083   6.639   7.126
  937    HB3  SER  12           HB1      SER  12  37.435   7.227   7.333
  938    HG   SER  12           HG       SER  12  38.867   5.696   8.964
  939    H    PHE  13           HN       PHE  13  39.367   6.001   4.510
  940    HA   PHE  13           HA       PHE  13  38.122   8.088   3.110
  941    HB2  PHE  13           HB2      PHE  13  40.552   6.553   2.927
  942    HB3  PHE  13           HB1      PHE  13  39.861   6.772   1.319
  943    HD1  PHE  13           HD1      PHE  13  41.756   8.305   3.934
  944    HD2  PHE  13           HD2      PHE  13  39.056   9.163   0.706
  945    HE1  PHE  13           HE1      PHE  13  42.536  10.660   3.908
  946    HE2  PHE  13           HE2      PHE  13  39.834  11.516   0.679
  947    HZ   PHE  13           HZ       PHE  13  41.574  12.265   2.279
  948    H    ILE  14           HN       ILE  14  38.431   4.636   2.243
  949    HA   ILE  14           HA       ILE  14  36.935   4.803  -0.152
  950    HB   ILE  14           HB       ILE  14  37.465   2.458   1.692
  951   HG12  ILE  14          HG12      ILE  14  38.740   3.132  -0.973
  952   HG13  ILE  14          HG11      ILE  14  39.414   3.694   0.555
  953   HG21  ILE  14          HG21      ILE  14  36.956   1.154  -0.443
  954   HG22  ILE  14          HG22      ILE  14  36.272   2.647  -1.086
  955   HG23  ILE  14          HG23      ILE  14  35.563   1.896   0.343
  956   HD11  ILE  14          HD11      ILE  14  39.307   1.206   1.288
  957   HD12  ILE  14          HD12      ILE  14  40.566   1.673   0.146
  958   HD13  ILE  14          HD13      ILE  14  39.112   0.858  -0.430
  959    H    LEU  15           HN       LEU  15  36.040   4.059   3.195
  960    HA   LEU  15           HA       LEU  15  33.362   3.310   2.684
  961    HB2  LEU  15           HB2      LEU  15  34.781   4.413   5.100
  962    HB3  LEU  15           HB1      LEU  15  33.044   4.111   5.123
  963    HG   LEU  15           HG       LEU  15  35.029   2.008   4.244
  964   HD11  LEU  15          HD11      LEU  15  34.650   1.071   6.577
  965   HD12  LEU  15          HD12      LEU  15  33.966   2.639   7.009
  966   HD13  LEU  15          HD13      LEU  15  35.652   2.520   6.505
  967   HD21  LEU  15          HD21      LEU  15  33.060   0.551   5.006
  968   HD22  LEU  15          HD22      LEU  15  32.796   1.502   3.547
  969   HD23  LEU  15          HD23      LEU  15  32.118   2.040   5.083
  970    H    SER  16           HN       SER  16  34.547   6.391   4.010
  971    HA   SER  16           HA       SER  16  32.260   7.875   3.914
  972    HB2  SER  16           HB2      SER  16  35.037   8.833   3.178
  973    HB3  SER  16           HB1      SER  16  33.679   9.881   3.574
  974    HG   SER  16           HG       SER  16  35.202   9.256   5.327
  975    H    ALA  17           HN       ALA  17  34.463   7.201   1.218
  976    HA   ALA  17           HA       ALA  17  33.275   8.837  -0.717
  977    HB1  ALA  17           HB1      ALA  17  35.417   7.635  -1.019
  978    HB2  ALA  17           HB2      ALA  17  34.303   7.329  -2.351
  979    HB3  ALA  17           HB3      ALA  17  34.535   6.110  -1.100
  980    H    LEU  18           HN       LEU  18  32.742   5.323  -0.275
  981    HA   LEU  18           HA       LEU  18  30.502   5.198  -2.008
  982    HB2  LEU  18           HB2      LEU  18  31.773   3.422  -0.004
  983    HB3  LEU  18           HB1      LEU  18  30.077   3.098  -0.363
  984    HG   LEU  18           HG       LEU  18  31.764   1.884  -1.832
  985   HD11  LEU  18          HD11      LEU  18  29.932   3.732  -3.378
  986   HD12  LEU  18          HD12      LEU  18  29.320   2.404  -2.391
  987   HD13  LEU  18          HD13      LEU  18  30.379   2.070  -3.761
  988   HD21  LEU  18          HD21      LEU  18  33.017   3.065  -3.439
  989   HD22  LEU  18          HD22      LEU  18  33.183   4.076  -2.004
  990   HD23  LEU  18          HD23      LEU  18  32.044   4.526  -3.273
  991    H    HIS  19           HN       HIS  19  30.840   6.326   1.200
  992    HA   HIS  19           HA       HIS  19  28.207   5.849   2.129
  993    HB2  HIS  19           HB2      HIS  19  30.285   6.408   3.514
  994    HB3  HIS  19           HB1      HIS  19  30.005   8.086   3.048
  995    HD2  HIS  19           HD2      HIS  19  26.696   8.091   3.359
  996    HE1  HIS  19           HE1      HIS  19  27.474   6.902   7.334
  997    HE2  HIS  19           HE2      HIS  19  25.723   7.874   5.772
  998    H    PHE  20           HN       PHE  20  29.802   8.715   0.745
  999    HA   PHE  20           HA       PHE  20  27.382  10.249   0.762
 1000    HB2  PHE  20           HB2      PHE  20  30.154  10.717   0.247
 1001    HB3  PHE  20           HB1      PHE  20  29.218  11.305  -1.128
 1002    HD1  PHE  20           HD1      PHE  20  30.239  11.963   2.250
 1003    HD2  PHE  20           HD2      PHE  20  27.154  12.769  -0.629
 1004    HE1  PHE  20           HE1      PHE  20  29.519  13.934   3.574
 1005    HE2  PHE  20           HE2      PHE  20  26.435  14.739   0.694
 1006    HZ   PHE  20           HZ       PHE  20  27.610  15.317   2.795
 1007    H    MET  21           HN       MET  21  28.838   7.958  -1.410
 1008    HA   MET  21           HA       MET  21  27.551   8.847  -3.797
 1009    HB2  MET  21           HB2      MET  21  28.733   6.199  -2.951
 1010    HB3  MET  21           HB1      MET  21  28.090   6.504  -4.567
 1011    HG2  MET  21           HG2      MET  21  30.170   8.288  -3.301
 1012    HG3  MET  21           HG1      MET  21  30.604   6.886  -4.276
 1013    HE1  MET  21           HE1      MET  21  28.967   6.522  -6.571
 1014    HE2  MET  21           HE2      MET  21  30.702   6.797  -6.702
 1015    HE3  MET  21           HE3      MET  21  29.600   7.641  -7.787
 1016    H    ALA  22           HN       ALA  22  26.851   6.119  -1.614
 1017    HA   ALA  22           HA       ALA  22  24.379   5.473  -2.876
 1018    HB1  ALA  22           HB1      ALA  22  25.031   4.786  -0.028
 1019    HB2  ALA  22           HB2      ALA  22  25.850   3.991  -1.371
 1020    HB3  ALA  22           HB3      ALA  22  24.100   3.857  -1.202
 1021    H    TRP  23           HN       TRP  23  25.221   7.457  -0.070
 1022    HA   TRP  23           HA       TRP  23  22.598   7.875   0.879
 1023    HB2  TRP  23           HB2      TRP  23  24.922   8.458   1.928
 1024    HB3  TRP  23           HB1      TRP  23  24.709   9.994   1.095
 1025    HD1  TRP  23           HD1      TRP  23  23.612   8.026   4.067
 1026    HE1  TRP  23           HE1      TRP  23  21.888   9.373   5.427
 1027    HE3  TRP  23           HE3      TRP  23  22.659  11.812   0.775
 1028    HZ2  TRP  23           HZ2      TRP  23  20.310  11.741   5.154
 1029    HZ3  TRP  23           HZ3      TRP  23  21.041  13.599   1.351
 1030    HH2  TRP  23           HH2      TRP  23  19.865  13.569   3.535
 1031    H    THR  24           HN       THR  24  24.553   9.614  -1.522
 1032    HA   THR  24           HA       THR  24  22.691  11.732  -1.929
 1033    HB   THR  24           HB       THR  24  23.973  12.000  -4.118
 1034    HG1  THR  24           HG1      THR  24  25.286  10.470  -4.641
 1035   HG21  THR  24          HG21      THR  24  24.689  13.389  -2.368
 1036   HG22  THR  24          HG22      THR  24  26.159  12.520  -2.807
 1037   HG23  THR  24          HG23      THR  24  25.239  12.032  -1.384
 1038    H    ILE  25           HN       ILE  25  23.187   8.575  -3.472
 1039    HA   ILE  25           HA       ILE  25  21.357   8.934  -5.597
 1040    HB   ILE  25           HB       ILE  25  22.323   6.466  -4.152
 1041   HG12  ILE  25          HG12      ILE  25  22.943   7.454  -6.945
 1042   HG13  ILE  25          HG11      ILE  25  23.899   7.934  -5.543
 1043   HG21  ILE  25          HG21      ILE  25  20.483   6.781  -6.533
 1044   HG22  ILE  25          HG22      ILE  25  20.238   5.804  -5.084
 1045   HG23  ILE  25          HG23      ILE  25  21.438   5.320  -6.281
 1046   HD11  ILE  25          HD11      ILE  25  24.127   5.418  -5.048
 1047   HD12  ILE  25          HD12      ILE  25  25.031   6.043  -6.426
 1048   HD13  ILE  25          HD13      ILE  25  23.526   5.161  -6.686
 1049    H    GLY  26           HN       GLY  26  20.952   7.562  -2.339
 1050    HA2  GLY  26           HA2      GLY  26  18.219   6.872  -2.602
 1051    HA3  GLY  26           HA1      GLY  26  19.061   7.148  -1.079
 1052    H    HIS  27           HN       HIS  27  19.834   9.821  -1.465
 1053    HA   HIS  27           HA       HIS  27  17.599  11.223  -0.559
 1054    HB2  HIS  27           HB2      HIS  27  19.797  12.077  -0.116
 1055    HB3  HIS  27           HB1      HIS  27  20.167  12.182  -1.838
 1056    HD2  HIS  27           HD2      HIS  27  19.420  14.578  -3.017
 1057    HE1  HIS  27           HE1      HIS  27  17.081  16.075   0.165
 1058    HE2  HIS  27           HE2      HIS  27  18.059  16.616  -2.116
 1059    H    LEU  28           HN       LEU  28  19.016  11.034  -3.816
 1060    HA   LEU  28           HA       LEU  28  17.022  12.781  -4.952
 1061    HB2  LEU  28           HB2      LEU  28  19.455  12.293  -5.775
 1062    HB3  LEU  28           HB1      LEU  28  18.715  10.901  -6.568
 1063    HG   LEU  28           HG       LEU  28  17.262  13.455  -6.912
 1064   HD11  LEU  28          HD11      LEU  28  19.854  12.995  -8.404
 1065   HD12  LEU  28          HD12      LEU  28  19.726  14.078  -7.019
 1066   HD13  LEU  28          HD13      LEU  28  18.803  14.408  -8.485
 1067   HD21  LEU  28          HD21      LEU  28  18.247  11.445  -8.951
 1068   HD22  LEU  28          HD22      LEU  28  16.896  12.567  -9.107
 1069   HD23  LEU  28          HD23      LEU  28  16.780  11.196  -8.003
 1070    H    ASN  29           HN       ASN  29  14.996  12.194  -5.373
 1071    HA   ASN  29           HA       ASN  29  14.444   9.345  -5.958
 1072    HB2  ASN  29           HB2      ASN  29  12.602  11.404  -4.717
 1073    HB3  ASN  29           HB1      ASN  29  12.206   9.715  -5.031
 1074   HD21  ASN  29          HD21      ASN  29  14.275   8.251  -4.095
 1075   HD22  ASN  29          HD22      ASN  29  14.610   8.596  -2.467
 1076    H    GLN  30           HN       GLN  30  13.183   8.835  -7.704
 1077    HA   GLN  30           HA       GLN  30  12.555  11.070  -9.533
 1078    HB2  GLN  30           HB2      GLN  30  13.343   8.206 -10.000
 1079    HB3  GLN  30           HB1      GLN  30  12.489   9.121 -11.244
 1080    HG2  GLN  30           HG2      GLN  30  15.024  10.091  -9.901
 1081    HG3  GLN  30           HG1      GLN  30  15.008   9.212 -11.429
 1082   HE21  GLN  30          HE21      GLN  30  13.856  10.272 -13.278
 1083   HE22  GLN  30          HE22      GLN  30  13.685  11.960 -13.293
 1084    H    ILE  31           HN       ILE  31  10.477  11.564  -9.714
 1085    HA   ILE  31           HA       ILE  31   8.465   9.479  -9.129
 1086    HB   ILE  31           HB       ILE  31   8.320  12.488  -8.852
 1087   HG12  ILE  31          HG12      ILE  31   7.922  10.369  -6.733
 1088   HG13  ILE  31          HG11      ILE  31   9.521  11.020  -7.099
 1089   HG21  ILE  31          HG21      ILE  31   6.037  11.912  -7.849
 1090   HG22  ILE  31          HG22      ILE  31   6.213  10.330  -8.608
 1091   HG23  ILE  31          HG23      ILE  31   6.165  11.785  -9.603
 1092   HD11  ILE  31          HD11      ILE  31   8.294  12.200  -5.217
 1093   HD12  ILE  31          HD12      ILE  31   7.139  12.765  -6.424
 1094   HD13  ILE  31          HD13      ILE  31   8.832  13.251  -6.528
 1095    H    LYS  32           HN       LYS  32   7.183   8.843 -10.735
 1096    HA   LYS  32           HA       LYS  32   6.944  10.582 -13.118
 1097    HB2  LYS  32           HB2      LYS  32   7.281   7.586 -12.936
 1098    HB3  LYS  32           HB1      LYS  32   6.702   8.395 -14.394
 1099    HG2  LYS  32           HG2      LYS  32   8.733   9.635 -14.627
 1100    HG3  LYS  32           HG1      LYS  32   9.279   9.176 -13.013
 1101    HD2  LYS  32           HD2      LYS  32  10.477   7.792 -14.573
 1102    HD3  LYS  32           HD1      LYS  32   9.262   6.769 -13.807
 1103    HE2  LYS  32           HE2      LYS  32   9.248   6.371 -16.217
 1104    HE3  LYS  32           HE1      LYS  32   7.748   7.164 -15.744
 1105    HZ1  LYS  32           HZ1      LYS  32   8.207   8.817 -17.121
 1106    HZ2  LYS  32           HZ2      LYS  32   9.622   8.022 -17.619
 1107    HZ3  LYS  32           HZ3      LYS  32   9.678   9.130 -16.335
 1108    H    ARG  33           HN       ARG  33   4.931  11.321 -13.267
 1109    HA   ARG  33           HA       ARG  33   2.721   9.693 -12.203
 1110    HB2  ARG  33           HB2      ARG  33   2.849  12.625 -12.957
 1111    HB3  ARG  33           HB1      ARG  33   1.417  11.803 -12.335
 1112    HG2  ARG  33           HG2      ARG  33   2.593  11.247 -10.268
 1113    HG3  ARG  33           HG1      ARG  33   4.074  11.978 -10.887
 1114    HD2  ARG  33           HD2      ARG  33   2.988  13.576  -9.432
 1115    HD3  ARG  33           HD1      ARG  33   2.848  14.158 -11.080
 1116    HE   ARG  33           HE       ARG  33   0.690  13.069  -9.410
 1117   HH11  ARG  33          HH11      ARG  33   1.697  14.339 -12.512
 1118   HH12  ARG  33          HH12      ARG  33   0.085  14.680 -13.015
 1119   HH21  ARG  33          HH21      ARG  33  -1.387  13.520 -10.116
 1120   HH22  ARG  33          HH22      ARG  33  -1.649  14.218 -11.679