*HEADER    TRANSCRIPTION                           05-APR-06   2GLW              
*TITLE     THE SOLUTION STRUCTURE OF PHS018 FROM PYROCOCCUS HORIKOSHII           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 92AA LONG HYPOTHETICAL PROTEIN;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: PHS018;                                                     
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII;                          
*SOURCE   3 ORGANISM_COMMON: ARCHAEA;                                            
*SOURCE   4 STRAIN: OT3;                                                         
*SOURCE   5 GENE: PHS018;                                                        
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET30B                                    
*KEYWDS    NMR, RIFT BARREL, BIOINFORMATICS                                      
*EXPDTA    NMR, 22 STRUCTURES                                                    
*AUTHOR    M.COLES, M.HULKO, V.TRUFFAULT, J.MARTIN, A.N.LUPAS                    
*REVDAT   1   05-DEC-06 2GLW    0                                                

!!!	NOE RESTRAINTS

!!!	Note: the first residue of each pair was identified in the HSQC plane of 3D experiments


!!    Intra-residue

 assign(resid    2 and name hn   )(resid    2 and name ha   ) 2.7  0.0  5.0    

 assign(resid    2 and name hn   )(resid    2 and name hb+  ) 0.0  0.0  3.5    
 assign(resid    3 and name hg2+ )(resid    3 and name ha   ) 0.0  0.0  3.5    

 assign(resid    3 and name hn   )(resid    3 and name ha   ) 2.7  0.0  5.0    

 assign(resid    3 and name hn   )(resid    3 and name hb   ) 0.0  0.0  2.7    

 assign(resid    3 and name hn   )(resid    3 and name hg1+ ) 0.0  0.0  4.0    

 assign(resid    3 and name hn   )(resid    3 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid    4 and name hd2+ )(resid    4 and name ha   ) 0.0  0.0  3.5    

 assign(resid    4 and name hn   )(resid    4 and name ha   ) 2.7  0.0  5.0    

 assign(resid    4 and name hn   )(resid    4 and name hb1  ) 0.0  0.0  4.0    

 assign(resid    4 and name hn   )(resid    4 and name hb2  ) 0.0  0.0  2.7    

 assign(resid    4 and name hn   )(resid    4 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid    4 and name hn   )(resid    4 and name hg   ) 0.0  0.0  4.0    
 assign(resid    5 and name hn   )(resid    5 and name ha   ) 2.7  0.0  5.0    

 assign(resid    5 and name hn   )(resid    5 and name hb+  ) 0.0  0.0  3.5    
 assign(resid    6 and name hn   )(resid    6 and name ha   ) 2.7  0.0  5.0    

 assign(resid    6 and name hn   )(resid    6 and name hb+  ) 0.0  0.0  4.0    
 assign(resid    7 and name hn   )(resid    7 and name ha   ) 2.7  0.0  5.0    

 assign(resid    7 and name hn   )(resid    7 and name hb1  ) 0.0  0.0  3.2    

 assign(resid    7 and name hn   )(resid    7 and name hb2  ) 0.0  0.0  4.0    
 assign(resid    8 and name hn   )(resid    8 and name ha   ) 2.7  0.0  5.0    

 assign(resid    8 and name hn   )(resid    8 and name hb+  ) 0.0  0.0  4.0    
 assign(resid    9 and name hn   )(resid    9 and name ha   ) 2.7  0.0  5.0    

 assign(resid    9 and name hn   )(resid    9 and name hb   ) 3.2  0.0  5.0    

 assign(resid    9 and name hn   )(resid    9 and name hg2+ ) 0.0  0.0  3.5    
 assign(resid   10 and name hn   )(resid   10 and name ha   ) 2.7  0.0  5.0    

 assign(resid   10 and name hn   )(resid   10 and name hb   ) 0.0  0.0  3.2    

 assign(resid   10 and name hn   )(resid   10 and name hg2+ ) 0.0  0.0  4.0    
 assign(resid   11 and name hn   )(resid   11 and name ha   ) 2.7  0.0  5.0    

 assign(resid   11 and name hn   )(resid   11 and name hb   ) 0.0  0.0  2.7    

 assign(resid   11 and name hn   )(resid   11 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   11 and name hn   )(resid   11 and name hg1+ ) 0.0  0.0  4.8    
 assign(resid   12 and name hn   )(resid   12 and name ha   ) 2.7  0.0  5.0    

 assign(resid   12 and name hn   )(resid   12 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   12 and name hn   )(resid   12 and name hb2  ) 0.0  0.0  3.2    
 assign(resid   13 and name hn   )(resid   13 and name ha   ) 2.7  0.0  5.0    

 assign(resid   13 and name hn   )(resid   13 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   13 and name hn   )(resid   13 and name hd+  ) 0.0  0.0  4.8    

 assign(resid   13 and name hn   )(resid   13 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   14 and name hn   )(resid   14 and name ha   ) 0.0  0.0  2.7    

 assign(resid   14 and name hn   )(resid   14 and name hb   ) 3.2  0.0  5.0    

 assign(resid   14 and name hn   )(resid   14 and name hg1+ ) 0.0  0.0  4.0  

 assign(resid   14 and name hn   )(resid   14 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   15 and name hn   )(resid   15 and name ha+  ) 0.0  0.0  3.5    
 assign(resid   16 and name hn   )(resid   16 and name ha   ) 2.7  0.0  5.0    

 assign(resid   16 and name hn   )(resid   16 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   17 and name hn   )(resid   17 and name ha   ) 2.7  0.0  5.0    

 assign(resid   17 and name hn   )(resid   17 and name hb   ) 0.0  0.0  4.0    

 assign(resid   17 and name hn   )(resid   17 and name hg1+ ) 0.0  0.0  4.0    

 assign(resid   17 and name hn   )(resid   17 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   18 and name hn   )(resid   18 and name ha   ) 2.7  0.0  5.0    

 assign(resid   18 and name hn   )(resid   18 and name hb   ) 0.0  0.0  3.2    

 assign(resid   18 and name hn   )(resid   18 and name hg11 ) 0.0  0.0  4.0    

 assign(resid   18 and name hn   )(resid   18 and name hg12 ) 0.0  0.0  4.0    

 assign(resid   18 and name hn   )(resid   18 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   19 and name hn   )(resid   19 and name ha   ) 2.7  0.0  5.0    

 assign(resid   19 and name hn   )(resid   19 and name hb   ) 0.0  0.0  3.2    

 assign(resid   19 and name hn   )(resid   19 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   19 and name hn   )(resid   19 and name hg1+ ) 0.0  0.0  4.0   
 assign(resid   21 and name hn   )(resid   21 and name ha   ) 2.7  0.0  5.0    

 assign(resid   21 and name hn   )(resid   21 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   22 and name hn   )(resid   22 and name ha+  ) 0.0  0.0  3.5    
 assign(resid   23 and name hn   )(resid   23 and name ha   ) 2.7  0.0  5.0    

 assign(resid   23 and name hn   )(resid   23 and name hb   ) 0.0  0.0  3.2    

 assign(resid   23 and name hn   )(resid   23 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   24 and name he   )(resid   24 and name hg1  ) 0.0  0.0  3.2    

 assign(resid   24 and name he   )(resid   24 and name hg2  ) 0.0  0.0  3.2    

 assign(resid   24 and name hn   )(resid   24 and name ha   ) 2.7  0.0  5.0    

 assign(resid   24 and name hn   )(resid   24 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   25 and name hn   )(resid   25 and name ha   ) 2.7  0.0  5.0    

 assign(resid   25 and name hn   )(resid   25 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   25 and name hn   )(resid   25 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   26 and name hn   )(resid   26 and name ha   ) 2.7  0.0  5.0    

 assign(resid   26 and name hn   )(resid   26 and name hb1  ) 0.0  0.0  2.7    

 assign(resid   26 and name hn   )(resid   26 and name hb2  ) 0.0  0.0  2.7    

 assign(resid   26 and name hn   )(resid   26 and name hd+  ) 0.0  0.0  4.8    
 assign(resid   27 and name hn   )(resid   27 and name ha   ) 2.7  0.0  5.0    

 assign(resid   27 and name ha   )(resid   27 and name hd1  ) 2.7  0.0  1.3    

 assign(resid   27 and name hn   )(resid   27 and name hb1  ) 0.0  0.0  3.2    

 assign(resid   27 and name hn   )(resid   27 and name hb2  ) 0.0  0.0  2.7    
 assign(resid   28 and name hn   )(resid   28 and name ha+  ) 0.0  0.0  3.5    
 assign(resid   29 and name ha   )(resid   29 and name hb   ) 2.7  0.0  5.0    

 assign(resid   29 and name ha   )(resid   29 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   29 and name hn   )(resid   29 and name ha   ) 2.7  0.0  5.0    

 assign(resid   29 and name hn   )(resid   29 and name hb   ) 0.0  0.0  2.7    

 assign(resid   29 and name hn   )(resid   29 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   29 and name hn   )(resid   29 and name hg1+ ) 0.0  0.0  5.8    
 assign(resid   30 and name hn   )(resid   30 and name ha   ) 2.7  0.0  5.0    

 assign(resid   30 and name hn   )(resid   30 and name hb+  ) 0.0  0.0  4.0    
 assign(resid   31 and name hn   )(resid   31 and name ha   ) 2.7  0.0  5.0    

 assign(resid   31 and name hn   )(resid   31 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   31 and name hn   )(resid   31 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   32 and name hn   )(resid   32 and name ha1  ) 0.0  0.0  3.2    

 assign(resid   32 and name hn   )(resid   32 and name ha2  ) 0.0  0.0  3.2    
 assign(resid   33 and name hn   )(resid   33 and name ha   ) 2.7  0.0  5.0    

 assign(resid   33 and name hn   )(resid   33 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   34 and name hn   )(resid   34 and name ha   ) 2.7  0.0  5.0    

 assign(resid   34 and name hn   )(resid   34 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   34 and name hn   )(resid   34 and name hb2  ) 0.0  0.0  3.2    
 assign(resid   35 and name hn   )(resid   35 and name ha   ) 2.7  0.0  5.0    

 assign(resid   35 and name hn   )(resid   35 and name hb   ) 0.0  0.0  4.0    

 assign(resid   35 and name hn   )(resid   35 and name hg1+ ) 0.0  0.0  4.0    

 assign(resid   35 and name hn   )(resid   35 and name hg2+ ) 0.0  0.0  3.5    
 assign(resid   36 and name hn   )(resid   36 and name ha   ) 2.7  0.0  5.0    

 assign(resid   36 and name hn   )(resid   36 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   36 and name hn   )(resid   36 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   37 and name hn   )(resid   37 and name ha   ) 2.7  0.0  5.0    

 assign(resid   37 and name hn   )(resid   37 and name hb   ) 0.0  0.0  3.2    

 assign(resid   37 and name hn   )(resid   37 and name hg1+ ) 0.0  0.0  4.8  

 assign(resid   37 and name hn   )(resid   37 and name hg2+ ) 0.0  0.0  4.0    
 assign(resid   38 and name hn   )(resid   38 and name ha   ) 2.7  0.0  5.0    

 assign(resid   38 and name hn   )(resid   38 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   39 and name ha   )(resid   39 and name hb   ) 0.0  0.0  2.7    

 assign(resid   39 and name hg2+ )(resid   39 and name ha   ) 0.0  0.0  3.5    

 assign(resid   39 and name hn   )(resid   39 and name ha   ) 2.7  0.0  5.0    

 assign(resid   39 and name hn   )(resid   39 and name hb   ) 0.0  0.0  4.0    

 assign(resid   39 and name hn   )(resid   39 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   39 and name hn   )(resid   39 and name hg1+ ) 0.0  0.0  3.5  
 assign(resid   40 and name hn   )(resid   40 and name ha   ) 2.7  0.0  5.0    

 assign(resid   40 and name hn   )(resid   40 and name hb   ) 0.0  0.0  2.7    

 assign(resid   40 and name hn   )(resid   40 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   40 and name hn   )(resid   40 and name hg2+ ) 0.0  0.0  4.0    
 assign(resid   42 and name hn   )(resid   42 and name ha   ) 2.7  0.0  5.0    

 assign(resid   42 and name hn   )(resid   42 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   43 and name hn   )(resid   43 and name ha   ) 2.7  0.0  5.0    

 assign(resid   43 and name hn   )(resid   43 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   43 and name hn   )(resid   43 and name hg+  ) 0.0  0.0  3.8    
 assign(resid   44 and name hn   )(resid   44 and name ha1  ) 2.7  0.0  5.0    

 assign(resid   44 and name hn   )(resid   44 and name ha2  ) 0.0  0.0  2.7    
 assign(resid   45 and name hn   )(resid   45 and name ha   ) 2.7  0.0  5.0    

 assign(resid   45 and name hn   )(resid   45 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   45 and name hn   )(resid   45 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   46 and name hn   )(resid   46 and name ha   ) 2.7  0.0  5.0    

 assign(resid   46 and name hn   )(resid   46 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   48 and name hn   )(resid   48 and name ha   ) 2.7  0.0  5.0    

 assign(resid   48 and name hn   )(resid   48 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   48 and name hn   )(resid   48 and name hd+  ) 0.0  0.0  5.8    

 assign(resid   48 and name hn   )(resid   48 and name hg+  ) 0.0  0.0  4.0    
 assign(resid   49 and name hn   )(resid   49 and name ha   ) 2.7  0.0  5.0    

 assign(resid   49 and name hn   )(resid   49 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   49 and name hn   )(resid   49 and name hg+  ) 0.0  0.0  4.0    
 assign(resid   50 and name hn   )(resid   50 and name ha1  ) 0.0  0.0  2.7    

 assign(resid   50 and name hn   )(resid   50 and name ha2  ) 2.7  0.0  5.0    
 assign(resid   51 and name ha   )(resid   51 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   51 and name hn   )(resid   51 and name ha   ) 2.7  0.0  5.0    

 assign(resid   51 and name hn   )(resid   51 and name hb   ) 0.0  0.0  3.2    
 assign(resid   52 and name hn   )(resid   52 and name ha   ) 2.7  0.0  5.0    

 assign(resid   52 and name hn   )(resid   52 and name hb+  ) 0.0  0.0  4.0    
 assign(resid   53 and name ha   )(resid   53 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   53 and name hn   )(resid   53 and name ha   ) 2.7  0.0  5.0    

 assign(resid   53 and name hn   )(resid   53 and name hb   ) 0.0  0.0  3.2    
 assign(resid   54 and name hn   )(resid   54 and name ha   ) 2.7  0.0  5.0    

 assign(resid   54 and name hn   )(resid   54 and name hb+  ) 0.0  0.0  4.0    
 assign(resid   55 and name hn   )(resid   55 and name ha   ) 2.7  0.0  5.0    

 assign(resid   55 and name hn   )(resid   55 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   55 and name hn   )(resid   55 and name hd+  ) 0.0  0.0  5.8    

 assign(resid   55 and name hn   )(resid   55 and name hg+  ) 0.0  0.0  5.8    
 assign(resid   56 and name ha   )(resid   56 and name hb   ) 0.0  0.0  3.2    

 assign(resid   56 and name hn   )(resid   56 and name ha   ) 2.7  0.0  5.0    

 assign(resid   56 and name hn   )(resid   56 and name hb   ) 0.0  0.0  3.2    

 assign(resid   56 and name hn   )(resid   56 and name hg2+ ) 0.0  0.0  3.5    

 assign(resid   56 and name hn   )(resid   56 and name hg1+ ) 0.0  0.0  4.8    
 assign(resid   57 and name hn   )(resid   57 and name ha1  ) 0.0  0.0  3.2    

 assign(resid   57 and name hn   )(resid   57 and name ha2  ) 0.0  0.0  3.2    
 assign(resid   58 and name hn   )(resid   58 and name ha   ) 2.7  0.0  5.0    

 assign(resid   58 and name hn   )(resid   58 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   59 and name hn   )(resid   59 and name ha   ) 0.0  0.0  2.7    

 assign(resid   59 and name hn   )(resid   59 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   59 and name hn   )(resid   59 and name hg+  ) 0.0  0.0  4.0    
 assign(resid   60 and name hn   )(resid   60 and name ha+  ) 0.0  0.0  3.5    
 assign(resid   61 and name hn   )(resid   61 and name ha   ) 2.7  0.0  5.0    

 assign(resid   61 and name hn   )(resid   61 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   62 and name hn   )(resid   62 and name ha   ) 2.7  0.0  5.0    

 assign(resid   62 and name hn   )(resid   62 and name hb   ) 0.0  0.0  3.2    

 assign(resid   62 and name hn   )(resid   62 and name hg1+ ) 0.0  0.0  4.8    
 assign(resid   63 and name ha   )(resid   63 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   63 and name hn   )(resid   63 and name ha   ) 2.7  0.0  5.0    

 assign(resid   63 and name hn   )(resid   63 and name hb   ) 0.0  0.0  3.2    

 assign(resid   63 and name hn   )(resid   63 and name hg11 ) 0.0  0.0  4.0    

 assign(resid   63 and name hn   )(resid   63 and name hg12 ) 0.0  0.0  4.0    

 assign(resid   63 and name hn   )(resid   63 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   64 and name ha   )(resid   64 and name hg1+ ) 0.0  0.0  4.0    

 assign(resid   64 and name hn   )(resid   64 and name ha   ) 2.7  0.0  5.0    

 assign(resid   64 and name hn   )(resid   64 and name hb   ) 0.0  0.0  3.2    

 assign(resid   64 and name hn   )(resid   64 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   64 and name hn   )(resid   64 and name hg1+ ) 0.0  0.0  3.5   
 assign(resid   66 and name hn   )(resid   66 and name ha   ) 2.7  0.0  5.0    

 assign(resid   66 and name hn   )(resid   66 and name hd+  ) 0.0  0.0  5.8    

 assign(resid   66 and name hn   )(resid   66 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   67 and name hn   )(resid   67 and name ha   ) 2.7  0.0  5.0    

 assign(resid   67 and name hn   )(resid   67 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   68 and name hn   )(resid   68 and name ha   ) 2.7  0.0  5.0    

 assign(resid   68 and name hn   )(resid   68 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   68 and name hn   )(resid   68 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   68 and name hn   )(resid   68 and name hd2+ ) 0.0  0.0  5.8    

 assign(resid   68 and name hn   )(resid   68 and name hg   ) 0.0  0.0  5.0    
 assign(resid   69 and name he   )(resid   69 and name hg1  ) 0.0  0.0  3.2    

 assign(resid   69 and name he   )(resid   69 and name hg2  ) 0.0  0.0  3.2    

 assign(resid   69 and name hn   )(resid   69 and name ha   ) 2.7  0.0  5.0    

 assign(resid   69 and name hn   )(resid   69 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   69 and name hn   )(resid   69 and name hd+  ) 0.0  0.0  4.8    

 assign(resid   69 and name hn   )(resid   69 and name hg+  ) 0.0  0.0  4.0    
 assign(resid   70 and name hn   )(resid   70 and name ha   ) 2.7  0.0  5.0    

 assign(resid   70 and name hn   )(resid   70 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   71 and name ha   )(resid   71 and name hb   ) 0.0  0.0  3.2    

 assign(resid   71 and name hn   )(resid   71 and name ha   ) 2.7  0.0  5.0    

 assign(resid   71 and name hn   )(resid   71 and name hb   ) 0.0  0.0  2.7    

 assign(resid   71 and name hn   )(resid   71 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   71 and name hn   )(resid   71 and name hg1+ ) 0.0  0.0  4.8    
 assign(resid   72 and name ha   )(resid   72 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   72 and name hn   )(resid   72 and name ha   ) 2.7  0.0  5.0    

 assign(resid   72 and name hn   )(resid   72 and name hb   ) 0.0  0.0  3.2    

 assign(resid   72 and name hn   )(resid   72 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   72 and name hn   )(resid   72 and name hg1+ ) 0.0  0.0  3.5  

 assign(resid   72 and name hn   )(resid   72 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   73 and name hn   )(resid   73 and name ha+  ) 0.0  0.0  3.5    
 assign(resid   74 and name ha   )(resid   74 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   74 and name hn   )(resid   74 and name ha   ) 0.0  0.0  3.5    

 assign(resid   74 and name hn   )(resid   74 and name hb   ) 0.0  0.0  3.2    

 assign(resid   74 and name hn   )(resid   74 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   74 and name hn   )(resid   74 and name hg1+ ) 0.0  0.0  5.8  
 assign(resid   75 and name hn   )(resid   75 and name ha   ) 2.7  0.0  5.0    

 assign(resid   75 and name hn   )(resid   75 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   75 and name hn   )(resid   75 and name hd+  ) 0.0  0.0  4.0    

 assign(resid   75 and name hn   )(resid   75 and name hg+  ) 0.0  0.0  4.0    
 assign(resid   77 and name hn   )(resid   77 and name ha1  ) 0.0  0.0  3.2    

 assign(resid   77 and name hn   )(resid   77 and name ha2  ) 0.0  0.0  3.2    
 assign(resid   78 and name hn   )(resid   78 and name ha   ) 2.7  0.0  5.0    

 assign(resid   78 and name hn   )(resid   78 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   78 and name hn   )(resid   78 and name hg+  ) 0.0  0.0  4.0    
 assign(resid   79 and name ha   )(resid   79 and name hb   ) 0.0  0.0  3.2    

 assign(resid   79 and name hn   )(resid   79 and name ha   ) 2.7  0.0  5.0    

 assign(resid   79 and name hn   )(resid   79 and name hb   ) 0.0  0.0  3.2    

 assign(resid   79 and name hn   )(resid   79 and name hg1+ ) 0.0  0.0  4.0    

 assign(resid   79 and name hn   )(resid   79 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   80 and name ha   )(resid   80 and name hb   ) 0.0  0.0  3.2    

 assign(resid   80 and name hn   )(resid   80 and name ha   ) 2.7  0.0  5.0    

 assign(resid   80 and name hn   )(resid   80 and name hb   ) 3.2  0.0  5.0    

 assign(resid   80 and name hn   )(resid   80 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   80 and name hn   )(resid   80 and name hg1+ ) 0.0  0.0  3.5    

 assign(resid   80 and name hn   )(resid   80 and name hg2+ ) 0.0  0.0  4.0    
 assign(resid   81 and name hn   )(resid   81 and name ha   ) 2.7  0.0  5.0    

 assign(resid   81 and name hn   )(resid   81 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   81 and name hn   )(resid   81 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   82 and name hn   )(resid   82 and name ha   ) 2.7  0.0  5.0    

 assign(resid   82 and name hn   )(resid   82 and name hb   ) 0.0  0.0  3.2    

 assign(resid   82 and name hn   )(resid   82 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   82 and name hn   )(resid   82 and name hg2+ ) 0.0  0.0  4.0    
 assign(resid   83 and name hb+  )(resid   83 and name hg   ) 0.0  0.0  3.5    

 assign(resid   83 and name hn   )(resid   83 and name ha   ) 2.7  0.0  5.0    

 assign(resid   83 and name hn   )(resid   83 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   83 and name hn   )(resid   83 and name hb2  ) 0.0  0.0  3.2    

 assign(resid   83 and name hn   )(resid   83 and name hd2+ ) 0.0  0.0  4.0    

 assign(resid   83 and name hn   )(resid   83 and name hg   ) 0.0  0.0  5.0    
 assign(resid   84 and name hn   )(resid   84 and name ha   ) 2.7  0.0  5.0    

 assign(resid   84 and name hn   )(resid   84 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   84 and name hn   )(resid   84 and name hb2  ) 0.0  0.0  3.2    

 assign(resid   84 and name hn   )(resid   84 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   84 and name hn   )(resid   84 and name hg   ) 0.0  0.0  5.0    
 assign(resid   85 and name hn   )(resid   85 and name ha   ) 0.0  0.0  3.2    

 assign(resid   85 and name hn   )(resid   85 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   85 and name hn   )(resid   85 and name hd++ ) 0.0  0.0  5.5    
 assign(resid   86 and name hn   )(resid   86 and name ha1  ) 0.0  0.0  3.2    

 assign(resid   86 and name hn   )(resid   86 and name ha2  ) 0.0  0.0  3.2    
 assign(resid   87 and name hn   )(resid   87 and name ha   ) 2.7  0.0  5.0    

 assign(resid   87 and name hn   )(resid   87 and name hb+  ) 0.0  0.0  3.5    
 assign(resid   88 and name hn   )(resid   88 and name ha   ) 2.7  0.0  5.0    

 assign(resid   88 and name hn   )(resid   88 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   88 and name hn   )(resid   88 and name hb2  ) 0.0  0.0  3.2    
 assign(resid   89 and name hn   )(resid   89 and name ha   ) 2.7  0.0  5.0    

 assign(resid   89 and name hn   )(resid   89 and name hb+  ) 0.0  0.0  3.5    



!!    Sequential [ Hx(i) to Hx(i-1)]

 assign(resid  2   and name HN   )(resid  1   and name HA   ) 0.0 0.0 2.7 

 assign(resid  2   and name HN   )(resid  1   and name HB+  ) 0.0 0.0 4.8 

 assign(resid  2   and name HN   )(resid  1   and name HG+  ) 0.0 0.0 4.0 

 assign(resid  2   and name HN   )(resid  3   and name HN   ) 3.2 0.0 5.0
 assign(resid  3   and name HN   )(resid  2   and name HA   ) 0.0 0.0 2.7 

 assign(resid  3   and name HN   )(resid  2   and name HB+  ) 0.0 0.0 4.8 

 assign(resid  3   and name HN   )(resid  4   and name HD++ ) 0.0 0.0 5.5 

 assign(resid  3   and name HN   )(resid  4   and name HN   ) 3.2 0.0 5.0

 assign(resid  3   and name HA   )(resid  4   and name HG   ) 0.0 0.0 4.0 
 assign(resid  4   and name HN   )(resid  3   and name HA   ) 0.0 0.0 2.7 

 assign(resid  4   and name HN   )(resid  3   and name HB   ) 3.2 0.0 1.8 

 assign(resid  4   and name HN   )(resid  3   and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  4   and name HN   )(resid  3   and name HG1+ ) 0.0 0.0 5.8 

 assign(resid  4   and name HN   )(resid  5   and name HN   ) 0.0 0.0 2.7 
 assign(resid  5   and name HN   )(resid  4   and name HA   ) 3.2 0.0 5.0 

 assign(resid  5   and name HN   )(resid  6   and name HN   ) 3.2 0.0 5.0

 assign(resid  5   and name HB+  )(resid  4   and name HB+  ) 0.0 0.0 6.6 
 assign(resid  6   and name HN   )(resid  5   and name HA   ) 0.0 0.0 2.7 

 assign(resid  6   and name HN   )(resid  5   and name HB+  ) 0.0 0.0 5.8 

 assign(resid  6   and name HN   )(resid  7   and name HN   ) 3.2 0.0 5.0
 assign(resid  7   and name HN   )(resid  6   and name HA   ) 0.0 0.0 2.7 

 assign(resid  7   and name HN   )(resid  6   and name HB+  ) 0.0 0.0 4.8 8

 assign(resid  7   and name HN   )(resid  6   and name HG+  ) 0.0 0.0 4.8 

 assign(resid  7   and name HN   )(resid  6   and name HD+  ) 0.0 0.0 5.8 

 assign(resid  7   and name HN   )(resid  8   and name HN   ) 3.2 0.0 5.0
 assign(resid  8   and name HN   )(resid  7   and name HA   ) 0.0 0.0 2.7 

 assign(resid  8   and name HN   )(resid  7   and name HB1  ) 0.0 0.0 4.0 

 assign(resid  8   and name HN   )(resid  7   and name HB2  ) 0.0 0.0 3.2 

 assign(resid  8   and name HN   )(resid  7   and name HD+  ) 0.0 0.0 5.5 

 assign(resid  8   and name HN   )(resid  9   and name HN   ) 3.2 0.0 5.0
 assign(resid  9   and name HN   )(resid  8   and name HA   ) 0.0 0.0 2.7 

 assign(resid  9   and name HN   )(resid  8   and name HB+  ) 0.0 0.0 4.0 

 assign(resid  9   and name HN   )(resid  10  and name HN   ) 3.2 0.0 5.0 
 assign(resid  10  and name HN   )(resid  9   and name HA   ) 0.0 0.0 2.7 

 assign(resid  10  and name HN   )(resid  9   and name HB   ) 3.2 0.0 1.8 

 assign(resid  10  and name HN   )(resid  9   and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  10  and name HN   )(resid  11  and name HN   ) 3.2 0.0 5.0
 assign(resid  11  and name HN   )(resid  10  and name HA   ) 0.0 0.0 2.7 

 assign(resid  11  and name HN   )(resid  10  and name HB   ) 3.2 0.0 1.8 

 assign(resid  11  and name HN   )(resid  10  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  11  and name HN   )(resid  12  and name HN   ) 3.2 0.0 5.0
 assign(resid  12  and name HN   )(resid  11  and name HA   ) 0.0 0.0 2.7 

 assign(resid  12  and name HN   )(resid  11  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  12  and name HN   )(resid  11  and name HG1+ ) 0.0 0.0 4.0 

 assign(resid  12  and name HN   )(resid  13  and name HN   ) 3.2 0.0 5.0
 assign(resid  13  and name HN   )(resid  12  and name HA   ) 0.0 0.0 2.7 

 assign(resid  13  and name HN   )(resid  12  and name HB2  ) 3.2 0.0 1.8 

 assign(resid  13  and name HN   )(resid  12  and name HB1  ) 0.0 0.0 3.2 

 assign(resid  13  and name HN   )(resid  12  and name HD2  ) 0.0 0.0 4.0

 assign(resid  13  and name HN   )(resid  14  and name HN   ) 3.2 0.0 5.0

 assign(resid  13  and name HB+  )(resid  12  and name HB1  ) 0.0 0.0 4.0 
 assign(resid  14  and name HN   )(resid  13  and name HA   ) 0.0 0.0 2.7 

 assign(resid  14  and name HN   )(resid  13  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  14  and name HN   )(resid  15  and name HN   ) 0.0 0.0 3.2 
 assign(resid  15  and name HN   )(resid  14  and name HA   ) 2.7 0.0 5.0 

 assign(resid  15  and name HN   )(resid  14  and name HB   ) 3.2 0.0 1.8 

 assign(resid  15  and name HN   )(resid  16  and name HN   ) 0.0 0.0 2.7 
 assign(resid  16  and name HN   )(resid  15  and name HA1  ) 3.2 0.0 5.0 

 assign(resid  16  and name HN   )(resid  15  and name HA2  ) 3.2 0.0 5.0 

 assign(resid  16  and name HN   )(resid  17  and name HN   ) 3.2 0.0 5.0 
 assign(resid  17  and name HN   )(resid  16  and name HA   ) 0.0 0.0 2.7 

 assign(resid  17  and name HN   )(resid  16  and name HB+  ) 0.0 0.0 4.8 2

 assign(resid  17  and name HN   )(resid  18  and name HN   ) 3.2 0.0 5.0
 assign(resid  18  and name HN   )(resid  17  and name HA   ) 0.0 0.0 2.7 

 assign(resid  18  and name HN   )(resid  17  and name HB   ) 0.0 0.0 3.2 

 assign(resid  18  and name HN   )(resid  17  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  18  and name HN   )(resid  19  and name HN   ) 3.2 0.0 5.0

 assign(resid  18  and name HD1+ )(resid  17  and name HA   ) 0.0 0.0 4.8 
 assign(resid  19  and name HN   )(resid  18  and name HA   ) 0.0 0.0 2.7 

 assign(resid  19  and name HN   )(resid  18  and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  19  and name HN   )(resid  20  and name HD+  ) 3.5 0.0 2.3 

 assign(resid  19  and name HG2+ )(resid  20  and name HD+  ) 0.0 0.0 4.8 
 assign(resid  20  and name HD1  )(resid  19  and name HA   ) 0.0 0.0 2.7

 assign(resid  20  and name HD2  )(resid  19  and name HA   ) 0.0 0.0 2.7
 assign(resid  21  and name HN   )(resid  20  and name HA   ) 0.0 0.0 2.7 

 assign(resid  21  and name HN   )(resid  20  and name HB2  ) 0.0 0.0 3.2 

 assign(resid  21  and name HN   )(resid  20  and name HG+  ) 0.0 0.0 5.8 

 assign(resid  21  and name HN   )(resid  22  and name HN   ) 0.0 0.0 2.7 
 assign(resid  22  and name HN   )(resid  21  and name HA   ) 3.2 0.0 5.0 

 assign(resid  22  and name HN   )(resid  21  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  22  and name HN   )(resid  23  and name HN   ) 0.0 0.0 2.7 
 assign(resid  23  and name HN   )(resid  22  and name HA1  ) 2.7 0.0 5.0 13

 assign(resid  23  and name HN   )(resid  22  and name HA2  ) 3.2 0.0 5.0 13

 assign(resid  23  and name HN   )(resid  24  and name HN   ) 0.0 0.0 2.7 
 assign(resid  24  and name HN   )(resid  23  and name HA   ) 2.7 0.0 5.0 

 assign(resid  24  and name HN   )(resid  23  and name HB   ) 0.0 0.0 2.7 

 assign(resid  24  and name HN   )(resid  23  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  24  and name HN   )(resid  25  and name HN   ) 0.0 0.0 2.7
 assign(resid  25  and name HN   )(resid  24  and name HA   ) 2.7 0.0 5.0 

 assign(resid  25  and name HN   )(resid  24  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  25  and name HN   )(resid  24  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  25  and name HN   )(resid  26  and name HN   ) 0.0 0.0 2.7 
 assign(resid  26  and name HN   )(resid  25  and name HA   ) 2.7 0.0 5.0 

 assign(resid  26  and name HN   )(resid  25  and name HB+  ) 0.0 0.0 3.5 

 assign(resid  26  and name HN   )(resid  25  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  26  and name HN   )(resid  25  and name HD+  ) 0.0 0.0 4.8 

 assign(resid  26  and name HN   )(resid  27  and name HN   ) 0.0 0.0 2.7 

 assign(resid  26  and name HD1  )(resid  27  and name HA   ) 0.0 0.0 4.0 
 assign(resid  27  and name HN   )(resid  26  and name HA   ) 2.7 0.0 5.0 

 assign(resid  27  and name HN   )(resid  26  and name HB1  ) 0.0 0.0 2.7 

 assign(resid  27  and name HN   )(resid  28  and name HN   ) 0.0 0.0 2.7 
 assign(resid  28  and name HN   )(resid  27  and name HA   ) 2.7 0.0 5.0 

 assign(resid  28  and name HN   )(resid  27  and name HB1  ) 3.2 0.0 1.8 

 assign(resid  28  and name HN   )(resid  27  and name HB2  ) 3.2 0.0 1.8 

 assign(resid  28  and name HN   )(resid  29  and name HN   ) 0.0 0.0 2.7 
 assign(resid  29  and name HN   )(resid  28  and name HA+  ) 0.0 0.0 3.5 

 assign(resid  29  and name HN   )(resid  30  and name HN   ) 3.2 0.0 5.0
 assign(resid  30  and name HN   )(resid  29  and name HA   ) 0.0 0.0 2.7 

 assign(resid  30  and name HN   )(resid  29  and name HB   ) 3.2 0.0 1.8 

 assign(resid  30  and name HN   )(resid  29  and name HG1+ ) 0.0 0.0 4.8 

 assign(resid  30  and name HN   )(resid  29  and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  30  and name HN   )(resid  31  and name HN   ) 3.2 0.0 5.0
 assign(resid  31  and name HN   )(resid  30  and name HA   ) 0.0 0.0 3.5 

 assign(resid  31  and name HN   )(resid  30  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  31  and name HN   )(resid  30  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  31  and name HN   )(resid  32  and name HN   ) 3.2 0.0 5.0
 assign(resid  32  and name HN   )(resid  31  and name HA   ) 0.0 0.0 2.7 

 assign(resid  32  and name HN   )(resid  31  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  32  and name HN   )(resid  31  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  32  and name HN   )(resid  33  and name HN   ) 0.0 0.0 2.7 
 assign(resid  33  and name HN   )(resid  32  and name HA1  ) 3.2 0.0 5.0 

 assign(resid  33  and name HN   )(resid  32  and name HA2  ) 2.7 0.0 5.0 

 assign(resid  33  and name HN   )(resid  34  and name HN   ) 3.2 0.0 5.0
 assign(resid  34  and name HN   )(resid  33  and name HA   ) 0.0 0.0 2.7 

 assign(resid  34  and name HN   )(resid  33  and name HB+  ) 0.0 0.0 3.5 

 assign(resid  34  and name HN   )(resid  35  and name HN   ) 3.2 0.0 5.0
 assign(resid  35  and name HN   )(resid  34  and name HA   ) 0.0 0.0 2.7 

 assign(resid  35  and name HN   )(resid  34  and name HB1  ) 0.0 0.0 3.2 

 assign(resid  35  and name HN   )(resid  36  and name HN   ) 3.2 0.0 5.0
 assign(resid  36  and name HN   )(resid  35  and name HA   ) 0.0 0.0 2.7 

 assign(resid  36  and name HN   )(resid  35  and name HB   ) 0.0 0.0 3.2 

 assign(resid  36  and name HN   )(resid  35  and name HG1+ ) 0.0 0.0 4.8 

 assign(resid  36  and name HN   )(resid  35  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  36  and name HN   )(resid  37  and name HG2+ ) 0.0 0.0 5.8 

 assign(resid  36  and name HN   )(resid  37  and name HN   ) 3.2 0.0 5.0
 assign(resid  37  and name HN   )(resid  36  and name HA   ) 0.0 0.0 2.7 

 assign(resid  37  and name HN   )(resid  36  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  37  and name HN   )(resid  36  and name HG1  ) 0.0 0.0 4.0 

 assign(resid  37  and name HN   )(resid  36  and name HG2  ) 0.0 0.0 4.0 

 assign(resid  37  and name HN   )(resid  38  and name HN   ) 3.2 0.0 5.0

 assign(resid  37  and name HG2+ )(resid  36  and name HA   ) 0.0 0.0 4.0 
 assign(resid  38  and name HN   )(resid  37  and name HA   ) 0.0 0.0 2.7 

 assign(resid  38  and name HN   )(resid  37  and name HG11 ) 0.0 0.0 4.0 

 assign(resid  38  and name HN   )(resid  37  and name HG12 ) 0.0 0.0 4.0 

 assign(resid  38  and name HN   )(resid  37  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  38  and name HN   )(resid  39  and name HN   ) 3.2 0.0 5.0
 assign(resid  39  and name HN   )(resid  38  and name HA   ) 0.0 0.0 2.7 

 assign(resid  39  and name HN   )(resid  38  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  39  and name HN   )(resid  38  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  39  and name HN   )(resid  40  and name HG2+ ) 0.0 0.0 5.8 

 assign(resid  39  and name HN   )(resid  40  and name HN   ) 3.2 0.0 5.0
 assign(resid  40  and name HN   )(resid  39  and name HA   ) 0.0 0.0 2.7 

 assign(resid  40  and name HN   )(resid  39  and name HB   ) 0.0 0.0 3.2 

 assign(resid  40  and name HN   )(resid  39  and name HG1+ ) 0.0 0.0 4.8 10

 assign(resid  40  and name HN   )(resid  39  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  40  and name HN   )(resid  41  and name HN   ) 3.2 0.0 5.0
 assign(resid  42  and name HN   )(resid  41  and name HA   ) 0.0 0.0 2.7 

 assign(resid  42  and name HN   )(resid  41  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  42  and name HN   )(resid  41  and name HG+  ) 0.0 0.0 4.0 

 assign(resid  42  and name HN   )(resid  41  and name HD+  ) 0.0 0.0 5.8 

 assign(resid  42  and name HN   )(resid  43  and name HN   ) 3.2 0.0 5.0
 assign(resid  43  and name HN   )(resid  42  and name HA   ) 0.0 0.0 2.7 

 assign(resid  43  and name HN   )(resid  42  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  43  and name HN   )(resid  44  and name HN   ) 3.2 0.0 5.0
 assign(resid  44  and name HN   )(resid  43  and name HA   ) 0.0 0.0 2.7 

 assign(resid  44  and name HN   )(resid  43  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  44  and name HN   )(resid  43  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  44  and name HN   )(resid  45  and name HN   ) 3.2 0.0 5.0
 assign(resid  45  and name HN   )(resid  44  and name HA2  ) 2.7 0.0 5.0 2

 assign(resid  45  and name HN   )(resid  44  and name HA1  ) 0.0 0.0 2.7 2

 assign(resid  45  and name HN   )(resid  46  and name HN   ) 0.0 0.0 2.7
 assign(resid  46  and name HN   )(resid  45  and name HA   ) 2.7 0.0 5.0 

 assign(resid  46  and name HN   )(resid  47  and name HD+  ) 3.2 0.0 5.0 

 assign(resid  46  and name HG+  )(resid  47  and name HD+  ) 0.0 0.0 5.6 
 assign(resid  47  and name HD1  )(resid  46  and name HA   ) 0.0 0.0 2.7

 assign(resid  47  and name HD2  )(resid  46  and name HA   ) 0.0 0.0 2.7

 assign(resid  47  and name HD1  )(resid  46  and name HB+  ) 0.0 0.0 4.8

 assign(resid  47  and name HD2  )(resid  46  and name HB+  ) 0.0 0.0 4.8
 assign(resid  48  and name HN   )(resid  47  and name HA   ) 0.0 0.0 2.7 

 assign(resid  48  and name HN   )(resid  47  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  48  and name HN   )(resid  47  and name HG+  ) 0.0 0.0 5.8 

 assign(resid  48  and name HN   )(resid  49  and name HN   ) 3.2 0.0 5.0
 assign(resid  49  and name HN   )(resid  48  and name HA   ) 0.0 0.0 2.7 

 assign(resid  49  and name HN   )(resid  48  and name HB+  ) 0.0 0.0 3.5 

 assign(resid  49  and name HN   )(resid  48  and name HD+  ) 0.0 0.0 4.8 

 assign(resid  49  and name HN   )(resid  50  and name HN   ) 3.2 0.0 5.0
 assign(resid  50  and name HN   )(resid  49  and name HA   ) 0.0 0.0 2.7 

 assign(resid  50  and name HN   )(resid  49  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  50  and name HN   )(resid  49  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  50  and name HN   )(resid  51  and name HN   ) 3.2 0.0 5.0
 assign(resid  51  and name HN   )(resid  50  and name HA1  ) 2.7 0.0 5.0 

 assign(resid  51  and name HN   )(resid  50  and name HA2  ) 0.0 0.0 2.7 

 assign(resid  51  and name HN   )(resid  52  and name HN   ) 3.2 0.0 5.0
 assign(resid  52  and name HN   )(resid  51  and name HA   ) 0.0 0.0 2.7 

 assign(resid  52  and name HN   )(resid  51  and name HB   ) 3.2 0.0 1.8 

 assign(resid  52  and name HN   )(resid  51  and name HG2+ ) 0.0 0.0 3.5 

 assign(resid  52  and name HN   )(resid  53  and name HN   ) 3.2 0.0 5.0

 assign(resid  52  and name HA   )(resid  51  and name HG2+ ) 0.0 0.0 5.8 
 assign(resid  53  and name HN   )(resid  52  and name HA   ) 0.0 0.0 2.7 

 assign(resid  53  and name HN   )(resid  52  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  53  and name HN   )(resid  54  and name HN   ) 3.2 0.0 5.0
 assign(resid  54  and name HN   )(resid  53  and name HA   ) 0.0 0.0 2.7 

 assign(resid  54  and name HN   )(resid  53  and name HB   ) 3.2 0.0 1.8 

 assign(resid  54  and name HN   )(resid  53  and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  54  and name HN   )(resid  55  and name HN   ) 3.2 0.0 5.0
 assign(resid  55  and name HN   )(resid  54  and name HA   ) 0.0 0.0 2.7 

 assign(resid  55  and name HN   )(resid  54  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  55  and name HN   )(resid  56  and name HN   ) 3.2 0.0 5.0
 assign(resid  56  and name HN   )(resid  55  and name HA   ) 0.0 0.0 2.7 

 assign(resid  56  and name HN   )(resid  55  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  56  and name HN   )(resid  55  and name HG+  ) 0.0 0.0 4.0 

 assign(resid  56  and name HN   )(resid  57  and name HN   ) 3.2 0.0 5.0
 assign(resid  57  and name HN   )(resid  56  and name HA   ) 0.0 0.0 2.7 

 assign(resid  57  and name HN   )(resid  56  and name HB   ) 3.2 0.0 1.8 

 assign(resid  57  and name HN   )(resid  56  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  57  and name HN   )(resid  56  and name HG1+ ) 0.0 0.0 4.0 

 assign(resid  57  and name HN   )(resid  58  and name HN   ) 3.2 0.0 5.0
 assign(resid  58  and name HN   )(resid  57  and name HA1  ) 0.0 0.0 2.7 

 assign(resid  58  and name HN   )(resid  57  and name HA2  ) 0.0 0.0 2.7 

 assign(resid  58  and name HN   )(resid  59  and name HN   ) 3.2 0.0 5.0 
 assign(resid  59  and name HN   )(resid  58  and name HA   ) 0.0 0.0 2.7 

 assign(resid  59  and name HN   )(resid  58  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  59  and name HN   )(resid  58  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  59  and name HE22 )(resid  58  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  59  and name HN   )(resid  60  and name HN   ) 0.0 0.0 3.2
 assign(resid  60  and name HN   )(resid  59  and name HA   ) 3.2 0.0 5.0 

 assign(resid  60  and name HN   )(resid  59  and name HB1  ) 3.2 0.0 1.8 

 assign(resid  60  and name HN   )(resid  61  and name HN   ) 0.0 0.0 2.7
 assign(resid  61  and name HN   )(resid  60  and name HA1  ) 2.7 0.0 5.0 

 assign(resid  61  and name HN   )(resid  60  and name HA2  ) 2.7 0.0 5.0 

 assign(resid  61  and name HN   )(resid  62  and name HN   ) 3.2 0.0 5.0
 assign(resid  62  and name HN   )(resid  61  and name HA   ) 0.0 0.0 2.7 

 assign(resid  62  and name HN   )(resid  61  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  62  and name HN   )(resid  63  and name HN   ) 3.2 0.0 5.0
 assign(resid  63  and name HN   )(resid  62  and name HA   ) 0.0 0.0 2.7 

 assign(resid  63  and name HN   )(resid  62  and name HB   ) 3.2 0.0 1.8 

 assign(resid  63  and name HN   )(resid  62  and name HG1+ ) 0.0 0.0 5.8 

 assign(resid  63  and name HN   )(resid  62  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  63  and name HN   )(resid  64  and name HN   ) 3.2 0.0 5.0
 assign(resid  64  and name HN   )(resid  63  and name HA   ) 0.0 0.0 2.7 

 assign(resid  64  and name HN   )(resid  63  and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  64  and name HN   )(resid  65  and name HD+  ) 3.2 0.0 5.0 
 assign(resid  65  and name HD1  )(resid  64  and name HA   ) 0.0 0.0 2.7

 assign(resid  65  and name HD2  )(resid  64  and name HA   ) 0.0 0.0 2.7
 assign(resid  66  and name HN   )(resid  65  and name HA   ) 0.0 0.0 2.7 

 assign(resid  66  and name HN   )(resid  65  and name HD+  ) 3.2 0.0 5.0

 assign(resid  66  and name HN   )(resid  65  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  66  and name HN   )(resid  67  and name HN   ) 0.0 0.0 2.7 
 assign(resid  67  and name HN   )(resid  66  and name HA   ) 3.2 0.0 5.0 

 assign(resid  67  and name HN   )(resid  66  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  67  and name HN   )(resid  66  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  67  and name HN   )(resid  66  and name HD+  ) 0.0 0.0 5.8 

 assign(resid  67  and name HN   )(resid  68  and name HB+  ) 0.0 0.0 5.8 

 assign(resid  67  and name HN   )(resid  68  and name HN   ) 0.0 0.0 2.7
 assign(resid  68  and name HN   )(resid  67  and name HA   ) 3.2 0.0 5.0 

 assign(resid  68  and name HN   )(resid  67  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  68  and name HN   )(resid  69  and name HN   ) 0.0 0.0 2.7 
 assign(resid  69  and name HN   )(resid  68  and name HA   ) 3.2 0.0 5.0 

 assign(resid  69  and name HN   )(resid  68  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  69  and name HN   )(resid  68  and name HG   ) 0.0 0.0 4.8 

 assign(resid  69  and name HN   )(resid  70  and name HN   ) 0.0 0.0 2.7 
 assign(resid  70  and name HN   )(resid  69  and name HA   ) 3.2 0.0 5.0 

 assign(resid  70  and name HN   )(resid  69  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  70  and name HN   )(resid  69  and name HG+  ) 0.0 0.0 5.8 

 assign(resid  70  and name HN   )(resid  69  and name HD+  ) 0.0 0.0 5.8 

 assign(resid  70  and name HN   )(resid  71  and name HN   ) 0.0 0.0 2.7 
 assign(resid  71  and name HN   )(resid  70  and name HA   ) 3.2 0.0 5.0 

 assign(resid  71  and name HN   )(resid  70  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  71  and name HN   )(resid  72  and name HN   ) 0.0 0.0 2.7 
 assign(resid  72  and name HN   )(resid  71  and name HA   ) 3.2 0.0 5.0 

 assign(resid  72  and name HN   )(resid  71  and name HB   ) 0.0 0.0 3.2 

 assign(resid  72  and name HN   )(resid  71  and name HG1+ ) 0.0 0.0 4.0 
 assign(resid  72  and name HN   )(resid  73  and name HN   ) 0.0 0.0 2.7 
 assign(resid  73  and name HN   )(resid  72  and name HA   ) 3.2 0.0 5.0 

 assign(resid  73  and name HN   )(resid  72  and name HB   ) 0.0 0.0 3.2 

 assign(resid  73  and name HN   )(resid  72  and name HG1+ ) 0.0 0.0 4.8 

 assign(resid  73  and name HN   )(resid  72  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  73  and name HN   )(resid  74  and name HG1+ ) 0.0 0.0 4.8 

 assign(resid  73  and name HN   )(resid  74  and name HD1+ ) 0.0 0.0 5.8 

 assign(resid  73  and name HN   )(resid  74  and name HN   ) 0.0 0.0 2.7 
 assign(resid  74  and name HN   )(resid  73  and name HA1  ) 3.2 0.0 5.0 3

 assign(resid  74  and name HN   )(resid  73  and name HA2  ) 2.7 0.0 5.0 3

 assign(resid  74  and name HN   )(resid  75  and name HN   ) 3.2 0.0 5.0 
 assign(resid  75  and name HN   )(resid  74  and name HA   ) 0.0 0.0 2.7 

 assign(resid  75  and name HN   )(resid  74  and name HB   ) 3.2 0.0 1.8 

 assign(resid  75  and name HN   )(resid  74  and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  75  and name HN   )(resid  76  and name HD+  ) 3.5 0.0 5.0 
 assign(resid  76  and name HD1  )(resid  75  and name HA   ) 0.0 0.0 2.7

 assign(resid  76  and name HD2  )(resid  75  and name HA   ) 0.0 0.0 2.7
 assign(resid  77  and name HN   )(resid  76  and name HA   ) 0.0 0.0 2.7 

 assign(resid  77  and name HN   )(resid  76  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  77  and name HN   )(resid  78  and name HN   ) 0.0 0.0 2.7 
 assign(resid  78  and name HN   )(resid  77  and name HA1  ) 3.2 0.0 5.0 

 assign(resid  78  and name HN   )(resid  77  and name HA2  ) 3.2 0.0 5.0 

 assign(resid  78  and name HN   )(resid  79  and name HN   ) 3.2 0.0 5.0 
 assign(resid  79  and name HN   )(resid  78  and name HA   ) 0.0 0.0 2.7 

 assign(resid  79  and name HN   )(resid  78  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  79  and name HN   )(resid  78  and name HG+  ) 0.0 0.0 4.0 

 assign(resid  79  and name HN   )(resid  80  and name HN   ) 3.2 0.0 5.0
 assign(resid  80  and name HN   )(resid  79  and name HA   ) 0.0 0.0 2.7 

 assign(resid  80  and name HN   )(resid  79  and name HB   ) 3.2 0.0 1.8 

 assign(resid  80  and name HN   )(resid  79  and name HG2+ ) 0.0 0.0 4.0 

 assign(resid  80  and name HN   )(resid  81  and name HN   ) 3.2 0.0 5.0
 assign(resid  81  and name HN   )(resid  80  and name HA   ) 0.0 0.0 2.7 

 assign(resid  81  and name HN   )(resid  80  and name HB   ) 0.0 0.0 3.2 

 assign(resid  81  and name HN   )(resid  80  and name HG1+ ) 0.0 0.0 4.0 

 assign(resid  81  and name HN   )(resid  80  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  81  and name HN   )(resid  80  and name HD1+ ) 0.0 0.0 5.8 

 assign(resid  81  and name HN   )(resid  82  and name HN   ) 3.2 0.0 5.0
 assign(resid  82  and name HN   )(resid  81  and name HA   ) 0.0 0.0 2.7 

 assign(resid  82  and name HN   )(resid  81  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  82  and name HN   )(resid  81  and name HG+  ) 0.0 0.0 4.8 

 assign(resid  82  and name HN   )(resid  83  and name HD2+ ) 0.0 0.0 5.8 

 assign(resid  82  and name HN   )(resid  83  and name HN   ) 3.2 0.0 5.0
 assign(resid  83  and name HN   )(resid  82  and name HA   ) 0.0 0.0 2.7 

 assign(resid  83  and name HN   )(resid  82  and name HG1+ ) 0.0 0.0 4.0 

 assign(resid  83  and name HN   )(resid  82  and name HG2+ ) 0.0 0.0 4.8 

 assign(resid  83  and name HN   )(resid  84  and name HN   ) 3.2 0.0 5.0
 assign(resid  84  and name HN   )(resid  83  and name HA   ) 0.0 0.0 2.7 

 assign(resid  84  and name HN   )(resid  83  and name HB+  ) 0.0 0.0 4.8 

 assign(resid  84  and name HN   )(resid  83  and name HD2+ ) 0.0 0.0 4.8 

 assign(resid  84  and name HN   )(resid  85  and name HN   ) 3.2 0.0 5.0
 assign(resid  85  and name HN   )(resid  84  and name HA   ) 0.0 0.0 3.2 

 assign(resid  85  and name HN   )(resid  84  and name HB2  ) 3.2 0.0 1.8 

 assign(resid  85  and name HN   )(resid  84  and name HB1  ) 3.2 0.0 1.8 

 assign(resid  85  and name HN   )(resid  84  and name HG   ) 0.0 0.0 5.0 

 assign(resid  85  and name HN   )(resid  84  and name HD2+ ) 0.0 0.0 4.8 

 assign(resid  85  and name HN   )(resid  86  and name HN   ) 0.0 0.0 2.7 
 assign(resid  86  and name HN   )(resid  85  and name HA   ) 2.7 0.0 5.0

 assign(resid  86  and name HN   )(resid  85  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  86  and name HN   )(resid  87  and name HN   ) 3.2 0.0 5.0
 assign(resid  87  and name HN   )(resid  86  and name HA1  ) 0.0 0.0 3.2 

 assign(resid  87  and name HN   )(resid  86  and name HA2  ) 0.0 0.0 2.7 

 assign(resid  87  and name HN   )(resid  88  and name HN   ) 3.2 0.0 5.0 
 assign(resid  88  and name HN   )(resid  87  and name HA   ) 0.0 0.0 2.7 

 assign(resid  88  and name HN   )(resid  87  and name HB+  ) 0.0 0.0 4.0 

 assign(resid  88  and name HN   )(resid  89  and name HN   ) 3.2 0.0 5.0 
 assign(resid  89  and name HN   )(resid  88  and name HA   ) 0.0 0.0 2.7 

 assign(resid  89  and name HN   )(resid  88  and name HB1  ) 0.0 0.0 3.2 

 assign(resid  89  and name HN   )(resid  88  and name HB2  ) 3.2 0.0 1.8 

 assign(resid  89  and name HN   )(resid  90  and name HD1  ) 3.2 0.0 5.0 

 assign(resid  89  and name HN   )(resid  90  and name HD2  ) 3.2 0.0 5.0 



!!    Medium-range [ Hx(i) to Hx(i?2-5)]


 assign(resid    3 and name hg2+ )(resid    6 and name ha   ) 0.0  0.0  4.8    

 assign(resid    3 and name hg2+ )(resid    6 and name he+  ) 0.0  0.0  5.6    
 assign(resid    4 and name hd2+ )(resid    2 and name hb+  ) 0.0  0.0  4.8    
 assign(resid    5 and name hn   )(resid    3 and name ha   ) 0.0  0.0  4.0    

 assign(resid    5 and name hn   )(resid    3 and name hg1+ ) 0.0  0.0  3.5    

 assign(resid    5 and name hn   )(resid    3 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid    6 and name hn   )(resid    3 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid    9 and name hb   )(resid    7 and name he1  ) 0.0  0.0  3.2    

 assign(resid    9 and name hg2+ )(resid    7 and name he1  ) 0.0  0.0  3.5    
 assign(resid   12 and name hb1  )(resid   16 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   12 and name hb2  )(resid   16 and name hb1  ) 0.0  0.0  5.0    
 assign(resid   14 and name hd1+ )(resid   16 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   14 and name hd1+ )(resid   16 and name hd+  ) 0.0  0.0  5.6    
 assign(resid   15 and name ha2  )(resid   11 and name hg1+ ) 0.0  0.0  4.0    

 assign(resid   15 and name hn   )(resid   11 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   15 and name hn   )(resid   13 and name ha   ) 0.0  0.0  4.0    
 assign(resid   16 and name hn   )(resid   12 and name hb2  ) 0.0  0.0  5.0    

 assign(resid   16 and name hn   )(resid   14 and name hn   ) 3.2  0.0  1.8    
 assign(resid   18 and name hd1+ )(resid   16 and name hd+  ) 0.0  0.0  4.8    
 assign(resid   20 and name ha   )(resid   18 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   21 and name ha   )(resid   24 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   21 and name ha   )(resid   24 and name hd+  ) 0.0  0.0  4.0    

 assign(resid   21 and name ha   )(resid   24 and name he   ) 0.0  0.0  2.7    

 assign(resid   21 and name ha   )(resid   24 and name hg+  ) 0.0  0.0  4.8    

 assign(resid   21 and name hb+  )(resid   24 and name he   ) 0.0  0.0  4.8    
 assign(resid   22 and name ha+  )(resid   25 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   22 and name ha+  )(resid   25 and name hg+  ) 0.0  0.0  5.8    

 assign(resid   22 and name hn   )(resid   20 and name ha   ) 0.0  0.0  5.0    

 assign(resid   22 and name hn   )(resid   20 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   22 and name hn   )(resid   20 and name hb2  ) 0.0  0.0  4.0    
 assign(resid   23 and name ha   )(resid   26 and name hb1  ) 0.0  0.0  3.2    

 assign(resid   23 and name ha   )(resid   26 and name hb2  ) 0.0  0.0  4.0    

 assign(resid   23 and name hg2+ )(resid   19 and name hd1+ ) 0.0  0.0  5.6    

 assign(resid   23 and name hg2+ )(resid   19 and name hg2+ ) 0.0  0.0  4.3    

 assign(resid   23 and name hn   )(resid   19 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   23 and name hn   )(resid   20 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   23 and name hn   )(resid   20 and name hb2  ) 0.0  0.0  3.2    

 assign(resid   23 and name hn   )(resid   20 and name hd+  ) 0.0  0.0  4.8    

 assign(resid   23 and name hn   )(resid   20 and name hg+  ) 0.0  0.0  4.8    

 assign(resid   23 and name hn   )(resid   21 and name ha   ) 0.0  0.0  5.0    

 assign(resid   23 and name hn   )(resid   21 and name hb+  ) 0.0  0.0  5.8    

 assign(resid   23 and name hn   )(resid   25 and name hn   ) 3.2  0.0  1.8    
 assign(resid   24 and name hn   )(resid   20 and name hd+  ) 0.0  0.0  5.8 

 assign(resid   24 and name hn   )(resid   21 and name ha   ) 0.0  0.0  3.5    

 assign(resid   24 and name hn   )(resid   22 and name ha+  ) 0.0  0.0  5.8 
 assign(resid   25 and name hn   )(resid   21 and name ha   ) 0.0  0.0  4.5    

 assign(resid   25 and name hn   )(resid   22 and name ha+  ) 0.0  0.0  4.0    

 assign(resid   25 and name hn   )(resid   23 and name ha   ) 0.0  0.0  5.0    

 assign(resid   25 and name hn   )(resid   27 and name hn   ) 3.2  0.0  1.8    
 assign(resid   26 and name hd1  )(resid   23 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   26 and name hn   )(resid   22 and name ha+  ) 0.0  0.0  4.8 

 assign(resid   26 and name hn   )(resid   23 and name ha   ) 0.0  0.0  3.5    

 assign(resid   26 and name hn   )(resid   23 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   27 and name hb1  )(resid   29 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid   27 and name hb1  )(resid   29 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   27 and name hb2  )(resid   29 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid   27 and name hb2  )(resid   29 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   27 and name hn   )(resid   23 and name ha   ) 0.0  0.0  4.5    

 assign(resid   27 and name hn   )(resid   23 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   27 and name hn   )(resid   24 and name ha   ) 0.0  0.0  4.0    

 assign(resid   27 and name hn   )(resid   29 and name hd1+ ) 0.0  0.0  4.8    
 assign(resid   28 and name hn   )(resid   25 and name ha   ) 0.0  0.0  3.5    

 assign(resid   28 and name hn   )(resid   25 and name hb+  ) 0.0  0.0  5.8    

 assign(resid   28 and name hn   )(resid   24 and name ha   ) 0.0  0.0  4.5    

 assign(resid   28 and name hn   )(resid   25 and name hg+  ) 0.0  0.0  5.8    
 assign(resid   29 and name hn   )(resid   25 and name ha   ) 0.0  0.0  4.5    

 assign(resid   29 and name hn   )(resid   27 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   29 and name hn   )(resid   27 and name hb2  ) 0.0  0.0  5.0    
 assign(resid   30 and name hn   )(resid   33 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   30 and name hn   )(resid   33 and name hn   ) 0.0  0.0  4.0    
 assign(resid   33 and name hn   )(resid   31 and name ha   ) 0.0  0.0  3.5    
 assign(resid   38 and name hd+  )(resid   40 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   40 and name hg2+ )(resid   38 and name he+  ) 0.0  0.0  4.8    
 assign(resid   42 and name he2  )(resid   45 and name ha   ) 0.0  0.0  4.0    

 assign(resid   42 and name he1  )(resid   46 and name ha   ) 0.0  0.0  4.0    

 assign(resid   42 and name hn   )(resid   40 and name hg1+ ) 0.0  0.0  5.8    
 assign(resid   43 and name hn   )(resid   47 and name ha   ) 0.0  0.0  4.0    
 assign(resid   46 and name hg+  )(resid   48 and name he+  ) 0.0  0.0  5.6    

 assign(resid   46 and name hn   )(resid   43 and name hn   ) 0.0  0.0  4.0    
 assign(resid   54 and name hb+  )(resid   52 and name hz   ) 0.0  0.0  3.5    
 assign(resid   59 and name hn   )(resid   61 and name hn   ) 3.2  0.0  1.8    
 assign(resid   60 and name hn   )(resid   58 and name ha   ) 0.0  0.0  5.0    
 assign(resid   61 and name hn   )(resid   59 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   61 and name hn   )(resid   59 and name hb2  ) 0.0  0.0  5.0    
 assign(resid   67 and name ha   )(resid   70 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   67 and name hn   )(resid   65 and name ha   ) 0.0  0.0  5.0    

 assign(resid   67 and name hn   )(resid   65 and name hg+  ) 0.0  0.0  4.8    

 assign(resid   67 and name hn   )(resid   69 and name hn   ) 3.2  0.0  1.8    
 assign(resid   68 and name ha   )(resid   71 and name hb   ) 0.0  0.0  3.2    

 assign(resid   68 and name hn   )(resid   65 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   68 and name hn   )(resid   65 and name hb2  ) 0.0  0.0  3.2    

 assign(resid   68 and name hn   )(resid   70 and name hn   ) 3.2  0.0  1.8    
 assign(resid   69 and name ha   )(resid   72 and name hb   ) 0.0  0.0  3.2    

 assign(resid   69 and name ha   )(resid   72 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid   69 and name he   )(resid   66 and name ha   ) 0.0  0.0  3.2    

 assign(resid   69 and name hn   )(resid   65 and name hd+  ) 0.0  0.0  5.8    

 assign(resid   69 and name hn   )(resid   71 and name hn   ) 3.2  0.0  1.8    
 assign(resid   70 and name hn   )(resid   66 and name hg+  ) 0.0  0.0  5.8    

 assign(resid   70 and name hn   )(resid   67 and name ha   ) 0.0  0.0  4.0    
 assign(resid   71 and name hn   )(resid   68 and name ha   ) 0.0  0.0  3.5    
 assign(resid   72 and name hn   )(resid   68 and name ha   ) 0.0  0.0  4.5    

 assign(resid   72 and name hn   )(resid   69 and name ha   ) 0.0  0.0  4.0    

 assign(resid   72 and name hn   )(resid   74 and name hg1+ ) 0.0  0.0  5.8    
 assign(resid   73 and name hn   )(resid   69 and name ha   ) 0.0  0.0  4.5    

 assign(resid   73 and name hn   )(resid   70 and name ha   ) 0.0  0.0  3.5    
 assign(resid   78 and name hn   )(resid   74 and name hg2+ ) 0.0  0.0  5.8    

 assign(resid   78 and name hn   )(resid   76 and name ha   ) 0.0  0.0  4.0    
 assign(resid   86 and name hn   )(resid   84 and name ha   ) 0.0  0.0  5.0    

 assign(resid   86 and name hn   )(resid   84 and name hd2+ ) 0.0  0.0  4.8    
 assign(resid   88 and name he1  )(resid   86 and name ha1  ) 0.0  0.0  4.0    
 assign(resid   89 and name hn   )(resid   89 and name hb+  ) 0.0  0.0  3.5    



!!    Long-range [ Hx(i) to Hx(i>?5)]


 assign(resid    2 and name hn   )(resid   85 and name hd++ ) 0.0  0.0  5.5    
 assign(resid    3 and name ha   )(resid   85 and name ha   ) 0.0  0.0  3.2    

 assign(resid    3 and name hg2+ )(resid   83 and name ha   ) 0.0  0.0  4.0    

 assign(resid    3 and name hg2+ )(resid   83 and name hb1  ) 0.0  0.0  3.2    
 assign(resid    4 and name hb2  )(resid   84 and name hb1  ) 0.0  0.0  5.0    

 assign(resid    4 and name hb2  )(resid   84 and name hb2  ) 0.0  0.0  4.0    

 assign(resid    4 and name hd1+ )(resid   84 and name hd2+ ) 0.0  0.0  4.8    

 assign(resid    4 and name hd1+ )(resid   86 and name ha1  ) 0.0  0.0  4.0    

 assign(resid    4 and name hd1+ )(resid   86 and name ha2  ) 0.0  0.0  4.0    

 assign(resid    4 and name hd1+ )(resid   87 and name hb+  ) 0.0  0.0  4.0    

 assign(resid    4 and name hd1+ )(resid   87 and name hd2  ) 0.0  0.0  4.0    

 assign(resid    4 and name hd2+ )(resid   86 and name ha1  ) 4.0  0.0  9.0    

 assign(resid    4 and name hd2+ )(resid   86 and name ha2  ) 4.0  0.0  9.0    

 assign(resid    4 and name hd2+ )(resid   87 and name hd2  ) 0.0  0.0  4.8    

 assign(resid    4 and name hn   )(resid   84 and name hb1  ) 0.0  0.0  4.0    

 assign(resid    4 and name hn   )(resid   84 and name hb2  ) 0.0  0.0  4.0    

 assign(resid    4 and name hn   )(resid   85 and name ha   ) 0.0  0.0  4.0    
 assign(resid    5 and name hb+  )(resid   23 and name ha   ) 0.0  0.0  4.8    

 assign(resid    5 and name hb+  )(resid   26 and name hd1  ) 0.0  0.0  3.5    

 assign(resid    5 and name hb+  )(resid   84 and name hb+  ) 0.0  0.0  4.8    

 assign(resid    5 and name hn   )(resid   83 and name ha   ) 0.0  0.0  5.0    

 assign(resid    5 and name hn   )(resid   84 and name hb1  ) 0.0  0.0  4.0    

 assign(resid    5 and name hn   )(resid   84 and name hb2  ) 0.0  0.0  2.7    

 assign(resid    5 and name hn   )(resid   84 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid    5 and name hn   )(resid   84 and name hd2+ ) 0.0  0.0  5.8    

 assign(resid    5 and name hn   )(resid   84 and name hn   ) 0.0  0.0  3.5    
 assign(resid    6 and name ha   )(resid   82 and name hb   ) 0.0  0.0  5.0    
 assign(resid    7 and name he1  )(resid   17 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid    7 and name he1  )(resid   19 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid    7 and name hn   )(resid   81 and name ha   ) 0.0  0.0  5.0    

 assign(resid    7 and name hn   )(resid   81 and name hg+  ) 0.0  0.0  4.8    

 assign(resid    7 and name hn   )(resid   82 and name hb   ) 0.0  0.0  4.0    

 assign(resid    7 and name hn   )(resid   82 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid    7 and name hn   )(resid   82 and name hn   ) 0.0  0.0  3.5    

 assign(resid    7 and name hn   )(resid   83 and name ha   ) 0.0  0.0  4.0    
 assign(resid    8 and name ha   )(resid   81 and name ha   ) 0.0  0.0  2.7    

 assign(resid    8 and name ha   )(resid   81 and name hb+  ) 0.0  0.0  5.8    

 assign(resid    8 and name ha   )(resid   81 and name hg+  ) 0.0  0.0  5.8    

 assign(resid    8 and name ha   )(resid   82 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid    8 and name hb+  )(resid   79 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid    9 and name hg2+ )(resid   82 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid    9 and name hn   )(resid   79 and name ha   ) 0.0  0.0  5.0    

 assign(resid    9 and name hn   )(resid   79 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid    9 and name hn   )(resid   80 and name hg1+ ) 0.0  0.0  4.8 

 assign(resid    9 and name hn   )(resid   80 and name hn   ) 0.0  0.0  3.5    

 assign(resid    9 and name hn   )(resid   81 and name ha   ) 0.0  0.0  4.0    
 assign(resid   10 and name ha   )(resid   79 and name ha   ) 0.0  0.0  3.2    

 assign(resid   10 and name hg2+ )(resid   77 and name ha2  ) 0.0  0.0  4.0    

 assign(resid   10 and name hn   )(resid   80 and name hg1+ ) 0.0  0.0  5.8 
 assign(resid   11 and name hn   )(resid   79 and name ha   ) 0.0  0.0  4.0    

 assign(resid   11 and name hn   )(resid   80 and name hg1+ ) 0.0  0.0  5.8    

 assign(resid   11 and name hn   )(resid   80 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   12 and name hn   )(resid   17 and name ha   ) 0.0  0.0  5.0    

 assign(resid   12 and name hn   )(resid   17 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   16 and name ha   )(resid   63 and name ha   ) 0.0  0.0  2.7    

 assign(resid   16 and name hn   )(resid   11 and name hg1+ ) 0.0  0.0  5.8    
 assign(resid   17 and name hd1+ )(resid    7 and name hz   ) 0.0  0.0  4.0    

 assign(resid   17 and name hg1+ )(resid   63 and name ha   ) 0.0  0.0  4.8    

 assign(resid   17 and name hg2+ )(resid   11 and name ha   ) 0.0  0.0  3.5    

 assign(resid   17 and name hn   )(resid   62 and name hg1+ ) 0.0  0.0  4.0

 assign(resid   17 and name hn   )(resid   63 and name ha   ) 0.0  0.0  3.5    
 assign(resid   18 and name hd1+ )(resid   61 and name ha   ) 0.0  0.0  4.0    

 assign(resid   18 and name hd1+ )(resid   61 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   18 and name hg2+ )(resid   60 and name ha+  ) 0.0  0.0  4.8    
 assign(resid   19 and name ha   )(resid    7 and name he1  ) 0.0  0.0  3.2    

 assign(resid   19 and name hb   )(resid   24 and name hd+  ) 0.0  0.0  3.5    

 assign(resid   19 and name hn   )(resid   60 and name ha1  ) 0.0  0.0  4.0    

 assign(resid   19 and name hn   )(resid   61 and name ha   ) 0.0  0.0  3.5    
 assign(resid   23 and name hg2+ )(resid    5 and name hb+  ) 0.0  0.0  4.8    
 assign(resid   24 and name ha   )(resid   29 and name hb   ) 0.0  0.0  2.7    

 assign(resid   24 and name ha   )(resid   29 and name hd1+ ) 0.0  0.0  3.5    

 assign(resid   24 and name ha   )(resid   29 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   24 and name he   )(resid   19 and name hb   ) 0.0  0.0  4.0    

 assign(resid   24 and name he   )(resid   19 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   24 and name he   )(resid   60 and name ha+  ) 0.0  0.0  4.0    

 assign(resid   24 and name hg+  )(resid   29 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   24 and name hn   )(resid   19 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   24 and name hn   )(resid   19 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   29 and name hb   )(resid   24 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   29 and name hd1+ )(resid   35 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   29 and name hn   )(resid   24 and name ha   ) 0.0  0.0  4.0    
 assign(resid   30 and name hn   )(resid   35 and name hg1+ ) 0.0  0.0  5.8    
 assign(resid   31 and name ha   )(resid   56 and name hb   ) 0.0  0.0  4.0    

 assign(resid   31 and name ha   )(resid   56 and name hg1+ ) 0.0  0.0  3.5    

 assign(resid   31 and name ha   )(resid   57 and name ha2  ) 0.0  0.0  4.0    

 assign(resid   31 and name hg+  )(resid   57 and name ha2  ) 0.0  0.0  4.0    

 assign(resid   31 and name hn   )(resid   56 and name hg1+ ) 0.0  0.0  4.8    
 assign(resid   32 and name hn   )(resid   55 and name hd+  ) 0.0  0.0  4.8    

 assign(resid   32 and name hn   )(resid   56 and name hg2+ ) 0.0  0.0  5.8    

 assign(resid   32 and name hn   )(resid   56 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   32 and name hn   )(resid   56 and name hn   ) 0.0  0.0  4.0    
 assign(resid   33 and name hn   )(resid   55 and name hg+  ) 0.0  0.0  4.8    

 assign(resid   33 and name hn   )(resid   56 and name hb   ) 0.0  0.0  3.2    

 assign(resid   33 and name hn   )(resid   56 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   33 and name hn   )(resid   56 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   34 and name ha   )(resid   55 and name ha   ) 0.0  0.0  2.7    

 assign(resid   34 and name hn   )(resid   88 and name hn   ) 0.0  0.0  3.5    

 assign(resid   34 and name hn   )(resid   89 and name ha   ) 0.0  0.0  4.0    

 assign(resid   34 and name hn   )(resid   90 and name hd+  ) 0.0  0.0  4.8    
 assign(resid   35 and name ha   )(resid   87 and name ha   ) 0.0  0.0  2.7    

 assign(resid   35 and name hb   )(resid   87 and name ha   ) 0.0  0.0  4.0    

 assign(resid   35 and name hg1+ )(resid   29 and name hd1+ ) 0.0  0.0  4.3    

 assign(resid   35 and name hg1+ )(resid   87 and name ha   ) 0.0  0.0  4.8    

 assign(resid   35 and name hg1+ )(resid   87 and name hb+  ) 0.0  0.0  4.3    

 assign(resid   35 and name hn   )(resid   53 and name ha   ) 0.0  0.0  5.0    

 assign(resid   35 and name hn   )(resid   53 and name hg2+ ) 0.0  0.0  5.8    

 assign(resid   35 and name hn   )(resid   54 and name ha   ) 0.0  0.0  5.0    

 assign(resid   35 and name hn   )(resid   54 and name hb+  ) 0.0  0.0  5.8    

 assign(resid   35 and name hn   )(resid   54 and name hn   ) 0.0  0.0  3.5    

 assign(resid   35 and name hn   )(resid   55 and name ha   ) 0.0  0.0  4.0    

 assign(resid   35 and name hn   )(resid   55 and name hg+  ) 0.0  0.0  5.8    

 assign(resid   35 and name hn   )(resid   87 and name ha   ) 0.0  0.0  5.0    
 assign(resid   36 and name ha   )(resid   53 and name ha   ) 0.0  0.0  2.7    

 assign(resid   36 and name hn   )(resid   85 and name hb2  ) 0.0  0.0  5.0    

 assign(resid   36 and name hn   )(resid   53 and name hg2+ ) 0.0  0.0  5.8    

 assign(resid   36 and name hn   )(resid   84 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   36 and name hn   )(resid   84 and name hd2+ ) 0.0  0.0  4.0    

 assign(resid   36 and name hn   )(resid   85 and name hn   ) 0.0  0.0  4.0    

 assign(resid   36 and name hn   )(resid   86 and name ha+  ) 0.0  0.0  5.8    

 assign(resid   36 and name hn   )(resid   86 and name hn   ) 0.0  0.0  3.5    

 assign(resid   36 and name hn   )(resid   87 and name ha   ) 0.0  0.0  3.5    
 assign(resid   37 and name hd1+ )(resid   84 and name ha   ) 0.0  0.0  4.0

 assign(resid   37 and name hg2+ )(resid   52 and name hd2  ) 0.0  0.0  4.0    

 assign(resid   37 and name hg2+ )(resid   53 and name ha   ) 0.0  0.0  4.8    

 assign(resid   37 and name hn   )(resid   51 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   37 and name hn   )(resid   52 and name hn   ) 0.0  0.0  3.5    

 assign(resid   37 and name hn   )(resid   53 and name ha   ) 0.0  0.0  3.5    
 assign(resid   38 and name ha   )(resid   51 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   38 and name hb+  )(resid   51 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   38 and name hg+  )(resid   51 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   38 and name hn   )(resid   82 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   38 and name hn   )(resid   83 and name hn   ) 0.0  0.0  3.5    

 assign(resid   38 and name hn   )(resid   84 and name ha   ) 0.0  0.0  3.5    

 assign(resid   38 and name hn   )(resid   85 and name hb+  ) 0.0  0.0  4.8 
 assign(resid   39 and name ha   )(resid   82 and name ha   ) 0.0  0.0  3.2    

 assign(resid   39 and name hb   )(resid   80 and name hd1+ ) 0.0  0.0  4.0    

 assign(resid   39 and name hg2+ )(resid   52 and name he2  ) 0.0  0.0  4.0    

 assign(resid   39 and name hg2+ )(resid   80 and name hb   ) 0.0  0.0  4.8    

 assign(resid   39 and name hg2+ )(resid   80 and name hd1+ ) 0.0  0.0  4.3    

 assign(resid   39 and name hg2+ )(resid   82 and name ha   ) 0.0  0.0  4.0    

 assign(resid   39 and name hn   )(resid   50 and name ha1  ) 0.0  0.0  4.0    

 assign(resid   39 and name hn   )(resid   50 and name hn   ) 0.0  0.0  3.5    

 assign(resid   39 and name hn   )(resid   51 and name ha   ) 0.0  0.0  3.5    

 assign(resid   39 and name hn   )(resid   51 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   40 and name hb   )(resid   81 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   40 and name hg1+ )(resid   47 and name hb+  ) 0.0  0.0  4.3    

 assign(resid   40 and name hg2+ )(resid   49 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   40 and name hg2+ )(resid   49 and name hg+  ) 0.0  0.0  5.6    

 assign(resid   40 and name hn   )(resid   81 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   40 and name hn   )(resid   81 and name hn   ) 0.0  0.0  4.0    

 assign(resid   40 and name hn   )(resid   82 and name ha   ) 0.0  0.0  4.0    
 assign(resid   41 and name hb+  )(resid   80 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   41 and name hg+  )(resid   80 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   42 and name he1  )(resid   47 and name ha   ) 0.0  0.0  4.0    

 assign(resid   42 and name he1  )(resid   47 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   42 and name he1  )(resid   47 and name hd1  ) 0.0  0.0  3.2    

 assign(resid   42 and name he1  )(resid   47 and name hd2  ) 0.0  0.0  4.0    

 assign(resid   42 and name he1  )(resid   47 and name hg1  ) 0.0  0.0  4.0    

 assign(resid   42 and name he1  )(resid   47 and name hg2  ) 0.0  0.0  4.0    

 assign(resid   42 and name hn   )(resid   80 and name ha   ) 0.0  0.0  5.0    

 assign(resid   42 and name hn   )(resid   80 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   47 and name ha   )(resid   42 and name ha   ) 0.0  0.0  2.7    
 assign(resid   48 and name hb2  )(resid   41 and name hn   ) 0.0  0.0  5.0    

 assign(resid   48 and name hb2  )(resid   42 and name ha   ) 0.0  0.0  5.0    

 assign(resid   48 and name hb2  )(resid   72 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   48 and name hd+  )(resid   72 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   48 and name hg+  )(resid   72 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   48 and name hn   )(resid   40 and name ha   ) 0.0  0.0  5.0    

 assign(resid   48 and name hn   )(resid   40 and name hg1+ ) 0.0  0.0  5.8    

 assign(resid   48 and name hn   )(resid   41 and name hb+  ) 0.0  0.0  5.8    

 assign(resid   48 and name hn   )(resid   41 and name hn   ) 0.0  0.0  3.5    

 assign(resid   48 and name hn   )(resid   42 and name ha   ) 0.0  0.0  3.5    

 assign(resid   48 and name hn   )(resid   43 and name hg+  ) 0.0  0.0  5.8    
 assign(resid   49 and name ha   )(resid   40 and name ha   ) 0.0  0.0  2.7    

 assign(resid   49 and name ha   )(resid   40 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   49 and name hn   )(resid   72 and name hd1+ ) 0.0  0.0  4.8    
 assign(resid   50 and name ha1  )(resid   68 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   50 and name hn   )(resid   38 and name hg+  ) 0.0  0.0  4.8    

 assign(resid   50 and name hn   )(resid   39 and name hb   ) 0.0  0.0  5.0    

 assign(resid   50 and name hn   )(resid   39 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   50 and name hn   )(resid   39 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   50 and name hn   )(resid   40 and name ha   ) 0.0  0.0  4.0    

 assign(resid   50 and name hn   )(resid   72 and name hd1+ ) 0.0  0.0  4.8    
 assign(resid   51 and name ha   )(resid   38 and name ha   ) 0.0  0.0  2.7    

 assign(resid   51 and name ha   )(resid   38 and name hb+  ) 0.0  0.0  4.0    

 assign(resid   51 and name ha   )(resid   38 and name hd+  ) 0.0  0.0  5.8    

 assign(resid   51 and name ha   )(resid   38 and name hg+  ) 0.0  0.0  4.0    

 assign(resid   51 and name hb   )(resid   68 and name hd1+ ) 0.0  0.0  5.8    

 assign(resid   51 and name hg2+ )(resid   36 and name hg+  ) 0.0  0.0  5.6    

 assign(resid   51 and name hg2+ )(resid   38 and name he+  ) 0.0  0.0  4.8    

 assign(resid   51 and name hn   )(resid   38 and name ha   ) 0.0  0.0  5.0    

 assign(resid   51 and name hn   )(resid   68 and name hd2+ ) 0.0  0.0  4.8    
 assign(resid   52 and name he1  )(resid   62 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   52 and name he2  )(resid   64 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   52 and name hn   )(resid   36 and name hg+  ) 0.0  0.0  5.8    

 assign(resid   52 and name hn   )(resid   37 and name hg1+ ) 0.0  0.0  5.8    

 assign(resid   52 and name hn   )(resid   37 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   52 and name hn   )(resid   38 and name ha   ) 0.0  0.0  3.5    

 assign(resid   52 and name hn   )(resid   38 and name hg+  ) 0.0  0.0  4.8    
 assign(resid   53 and name ha   )(resid   36 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   53 and name ha   )(resid   36 and name hg+  ) 0.0  0.0  5.8    

 assign(resid   53 and name hg2+ )(resid   34 and name hb1  ) 0.0  0.0  4.8    

 assign(resid   53 and name hg2+ )(resid   34 and name hb2  ) 0.0  0.0  5.8    

 assign(resid   53 and name hg2+ )(resid   34 and name hd2  ) 0.0  0.0  3.5    

 assign(resid   53 and name hg2+ )(resid   36 and name ha   ) 0.0  0.0  4.0    
 assign(resid   54 and name hb+  )(resid   35 and name hg2+ ) 0.0  0.0  4.3    

 assign(resid   54 and name hb+  )(resid   62 and name hg2+ ) 0.0  0.0  4.3    

 assign(resid   54 and name hn   )(resid   34 and name ha   ) 0.0  0.0  5.0    

 assign(resid   54 and name hn   )(resid   34 and name hb1  ) 0.0  0.0  5.0    

 assign(resid   54 and name hn   )(resid   35 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   54 and name hn   )(resid   36 and name ha   ) 0.0  0.0  3.5    
 assign(resid   55 and name he   )(resid   32 and name ha2  ) 0.0  0.0  3.2    
 assign(resid   56 and name hn   )(resid   29 and name hg2+ ) 0.0  0.0  5.8 

 assign(resid   56 and name hn   )(resid   34 and name ha   ) 0.0  0.0  3.5    
 assign(resid   60 and name hn   )(resid   56 and name hg1+ ) 0.0  0.0  4.8 
 assign(resid   61 and name ha   )(resid   18 and name ha   ) 0.0  0.0  2.7    

 assign(resid   61 and name hn   )(resid   56 and name hg1+ ) 0.0  0.0  4.8    
 assign(resid   62 and name hn   )(resid   17 and name hg1+ ) 0.0  0.0  4.8    

 assign(resid   62 and name hn   )(resid   18 and name ha   ) 0.0  0.0  3.5    
 assign(resid   64 and name hn   )(resid   15 and name ha1  ) 0.0  0.0  4.0    

 assign(resid   64 and name hn   )(resid   16 and name ha   ) 0.0  0.0  3.5    

 assign(resid   64 and name hn   )(resid   16 and name hb+  ) 0.0  0.0  5.8    

 assign(resid   64 and name hn   )(resid   17 and name hg1+ ) 0.0  0.0  5.8    
 assign(resid   69 and name he   )(resid   15 and name ha1  ) 0.0  0.0  4.0    

 assign(resid   69 and name he   )(resid   64 and name hb   ) 0.0  0.0  4.0    

 assign(resid   69 and name he   )(resid   64 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   69 and name hn   )(resid   64 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   72 and name hd1+ )(resid   49 and name ha   ) 0.0  0.0  4.0    

 assign(resid   72 and name hd1+ )(resid   50 and name ha+  ) 0.0  0.0  4.0    
 assign(resid   74 and name hn   )(resid   69 and name ha   ) 0.0  0.0  4.0    
 assign(resid   75 and name hn   )(resid   11 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   77 and name hn   )(resid   10 and name hg2+ ) 0.0  0.0  4.0    

 assign(resid   77 and name hn   )(resid   12 and name ha   ) 0.0  0.0  4.0    

 assign(resid   77 and name hn   )(resid   12 and name he1  ) 0.0  0.0  5.0    
 assign(resid   78 and name hn   )(resid   10 and name hb   ) 0.0  0.0  5.0    

 assign(resid   78 and name hn   )(resid   10 and name hg2+ ) 0.0  0.0  4.8    

 assign(resid   78 and name hn   )(resid   11 and name hb   ) 0.0  0.0  4.0    

 assign(resid   78 and name hn   )(resid   11 and name hg2+ ) 0.0  0.0  4.8    
 assign(resid   80 and name hn   )(resid    8 and name ha   ) 0.0  0.0  5.0    

 assign(resid   80 and name hn   )(resid    9 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   81 and name hn   )(resid    8 and name ha   ) 0.0  0.0  5.0    

 assign(resid   81 and name hn   )(resid   40 and name hb   ) 0.0  0.0  4.0    

 assign(resid   81 and name hn   )(resid   40 and name hg1+ ) 0.0  0.0  5.8    

 assign(resid   81 and name hn   )(resid   41 and name ha   ) 0.0  0.0  4.0    
 assign(resid   82 and name hn   )(resid    8 and name ha   ) 0.0  0.0  3.5    

 assign(resid   82 and name hn   )(resid    8 and name hb+  ) 0.0  0.0  5.8    
 assign(resid   83 and name ha   )(resid    6 and name ha   ) 0.0  0.0  2.7    

 assign(resid   83 and name hd1+ )(resid   38 and name hb+  ) 0.0  0.0  4.8   

 assign(resid   83 and name hd1+ )(resid   40 and name hg2+ ) 0.0  0.0  4.3 

 assign(resid   83 and name hd2+ )(resid    6 and name ha   ) 0.0  0.0  4.0   

 assign(resid   83 and name hn   )(resid   38 and name ha   ) 0.0  0.0  5.0    

 assign(resid   83 and name hn   )(resid   38 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   83 and name hn   )(resid   39 and name ha   ) 0.0  0.0  4.0    

 assign(resid   83 and name hn   )(resid   39 and name hg2+ ) 0.0  0.0  5.8    
 assign(resid   84 and name hn   )(resid    5 and name ha   ) 0.0  0.0  5.0    

 assign(resid   84 and name hn   )(resid    5 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   84 and name hn   )(resid    6 and name ha   ) 0.0  0.0  4.0    

 assign(resid   84 and name hn   )(resid    6 and name hb+  ) 0.0  0.0  5.8    
 assign(resid   85 and name hn   )(resid   36 and name hb+  ) 0.0  0.0  4.8    

 assign(resid   85 and name hn   )(resid   37 and name ha   ) 0.0  0.0  3.5    

 assign(resid   85 and name hn   )(resid   37 and name hb   ) 0.0  0.0  5.0    
 assign(resid   86 and name hn   )(resid   36 and name ha   ) 0.0  0.0  5.0    

 assign(resid   86 and name hn   )(resid   36 and name hb+  ) 0.0  0.0  3.5    

 assign(resid   86 and name hn   )(resid   37 and name ha   ) 0.0  0.0  4.0    
 assign(resid   87 and name hn   )(resid    4 and name hd1+ ) 0.0  0.0  4.8    

 assign(resid   87 and name hn   )(resid   35 and name ha   ) 0.0  0.0  5.0    
 assign(resid   88 and name hn   )(resid   34 and name hb1  ) 0.0  0.0  4.0    

 assign(resid   88 and name hn   )(resid   34 and name hb2  ) 0.0  0.0  4.0    

 assign(resid   88 and name hn   )(resid   35 and name ha   ) 0.0  0.0  3.5    

 assign(resid   88 and name hn   )(resid   35 and name hg1+ ) 0.0  0.0  4.8    


!!    Hbond

!!    Note: Hbonds were also restrained by treatment as pseudo-covalent bonds
!!    The distance restraints therefore represent the acceptor-donor distance only.

! Backbone

assign(resid  57 and name HN )(resid  61 and name O  ) 2.1 0.4 0.4

assign(resid  12 and name HN )(resid  16 and name O  ) 2.1 0.4 0.4

assign(resid  84 and name HN )(resid   5 and name O  ) 2.1 0.4 0.4

assign(resid   7 and name HN )(resid  82 and name O  ) 2.1 0.4 0.4

assign(resid  82 and name HN )(resid   7 and name O  ) 2.1 0.4 0.4

assign(resid   9 and name HN )(resid  80 and name O  ) 2.1 0.4 0.4

assign(resid  80 and name HN )(resid   9 and name O  ) 2.1 0.4 0.4

assign(resid  34 and name HN )(resid  88 and name O  ) 2.1 0.4 0.4

assign(resid  88 and name HN )(resid  34 and name O  ) 2.1 0.4 0.4

assign(resid  36 and name HN )(resid  86 and name O  ) 2.1 0.4 0.4

assign(resid  85 and name HN )(resid  36 and name O  ) 2.1 0.4 0.4

assign(resid  86 and name HN )(resid  36 and name O  ) 2.1 0.4 0.4

assign(resid  38 and name HN )(resid  83 and name O  ) 2.1 0.4 0.4

assign(resid  83 and name HN )(resid  38 and name O  ) 2.1 0.4 0.4

assign(resid  40 and name HN )(resid  81 and name O  ) 2.1 0.4 0.4

assign(resid  35 and name HN )(resid  54 and name O  ) 2.1 0.4 0.4

assign(resid  54 and name HN )(resid  35 and name O  ) 2.1 0.4 0.4

assign(resid  37 and name HN )(resid  52 and name O  ) 2.1 0.4 0.4

assign(resid  52 and name HN )(resid  37 and name O  ) 2.1 0.4 0.4

assign(resid  39 and name HN )(resid  50 and name O  ) 2.1 0.4 0.4

assign(resid  50 and name HN )(resid  39 and name O  ) 2.1 0.4 0.4

assign(resid  41 and name HN )(resid  48 and name O  ) 2.1 0.4 0.4

assign(resid  48 and name HN )(resid  41 and name O  ) 2.1 0.4 0.4

assign(resid  43 and name HN )(resid  46 and name O  ) 2.1 0.4 0.4

assign(resid  46 and name HN )(resid  43 and name O  ) 2.1 0.4 0.4

assign(resid  17 and name HN )(resid  62 and name O  ) 2.1 0.4 0.4

assign(resid  62 and name HN )(resid  17 and name O  ) 2.1 0.4 0.4

assign(resid  64 and name HN )(resid  15 and name O  ) 2.1 0.4 0.4

assign(resid  19 and name HN )(resid  60 and name O  ) 2.1 0.4 0.4

assign(resid  24 and name HN )(resid  20 and name O  ) 2.1 0.4 0.4

assign(resid  25 and name HN )(resid  21 and name O  ) 2.1 0.4 0.4

assign(resid  26 and name HN )(resid  22 and name O  ) 2.1 0.4 0.4

assign(resid  27 and name HN )(resid  23 and name O  ) 2.1 0.4 0.4

assign(resid  28 and name HN )(resid  25 and name O  ) 2.1 0.4 0.4

assign(resid  29 and name HN )(resid  24 and name O  ) 2.1 0.4 0.4

assign(resid  70 and name HN )(resid  66 and name O  ) 2.1 0.4 0.4

assign(resid  69 and name HN )(resid  65 and name O  ) 2.1 0.4 0.4

assign(resid  71 and name HN )(resid  67 and name O  ) 2.1 0.4 0.4

assign(resid  72 and name HN )(resid  68 and name O  ) 2.1 0.4 0.4

assign(resid  73 and name HN )(resid  70 and name O  ) 2.1 0.4 0.4

assign(resid  74 and name HN )(resid  69 and name O  ) 2.1 0.4 0.4

assign(resid  33 and name HN )(resid  30 and name O  ) 2.1 0.4 0.4

assign(resid  78 and name HN )(resid  75 and name O  ) 2.1 0.4 0.4

assign(resid  15 and name HN )(resid  12 and name O  ) 2.1 0.4 0.4

assign(resid  16 and name HN )(resid  13 and name O  ) 2.1 0.4 0.4

assign(resid  60 and name HN )(resid  57 and name O  ) 2.1 0.4 0.4

assign(resid  61 and name HN )(resid  58 and name O  ) 2.1 0.4 0.4

assign(resid  56 and name HN )(resid  33 and name O  ) 2.1 0.4 0.4

assign(resid  32 and name HN )(resid  56 and name O  ) 2.1 0.4 0.4

assign(resid  11 and name HN )(resid  78 and name O  ) 2.1 0.4 0.4

assign(resid  77 and name HN )(resid  11 and name O  ) 2.1 0.4 0.4

! Sidechain

assign(resid  30 and name HN   )(resid  33 and name OD1 ) 2.1 0.4 0.4

assign(resid  75 and name HN   )(resid  78 and name OE1 ) 2.1 0.4 0.4

assign(resid  24 and name HE   )(resid  19 and name O  ) 2.1 0.4 0.4
assign(resid  24 and name HH21 )(resid  19 and name O  ) 2.1 0.4 0.4

assign(resid  69 and name HE   )(resid  64 and name O  ) 2.1 0.4 0.4
assign(resid  69 and name HH21 )(resid  64 and name O  ) 2.1 0.4 0.4



!!!	DIHEDRAL RESTRAINTS

!!    Backbone phi and psi restraints from TALOS


assign(resid    3 and name c )(resid    4 and name n  )
      (resid    4 and name ca)(resid    4 and name c  ) 5  -83.0   10.0  2

assign(resid    4 and name n )(resid    4 and name ca )
      (resid    4 and name c )(resid    5 and name n  ) 5  -37.0   19.0  2


assign(resid    4 and name c )(resid    5 and name n  )
      (resid    5 and name ca)(resid    5 and name c  ) 5 -148.0   28.0  2

assign(resid    5 and name n )(resid    5 and name ca )
      (resid    5 and name c )(resid    6 and name n  ) 5  158.0   17.0  2


assign(resid    5 and name c )(resid    6 and name n  )
      (resid    6 and name ca)(resid    6 and name c  ) 5 -119.0   21.0  2

assign(resid    6 and name n )(resid    6 and name ca )
      (resid    6 and name c )(resid    7 and name n  ) 5  138.0   18.0  2


assign(resid    6 and name c )(resid    7 and name n  )
      (resid    7 and name ca)(resid    7 and name c  ) 5 -130.0   27.0  2

assign(resid    7 and name n )(resid    7 and name ca )
      (resid    7 and name c )(resid    8 and name n  ) 5  142.0   27.0  2


assign(resid    7 and name c )(resid    8 and name n  )
      (resid    8 and name ca)(resid    8 and name c  ) 5 -114.0   15.0  2

assign(resid    8 and name n )(resid    8 and name ca )
      (resid    8 and name c )(resid    9 and name n  ) 5  130.0   22.0  2


assign(resid    8 and name c )(resid    9 and name n  )
      (resid    9 and name ca)(resid    9 and name c  ) 5 -122.0   31.0  2

assign(resid    9 and name n )(resid    9 and name ca )
      (resid    9 and name c )(resid   10 and name n  ) 5  133.0   29.0  2


assign(resid    9 and name c )(resid   10 and name n  )
      (resid   10 and name ca)(resid   10 and name c  ) 5 -113.0   21.0  2

assign(resid   10 and name n )(resid   10 and name ca )
      (resid   10 and name c )(resid   11 and name n  ) 5  142.0   24.0  2


assign(resid   10 and name c )(resid   11 and name n  )
      (resid   11 and name ca)(resid   11 and name c  ) 5  -95.0   37.0  2

assign(resid   11 and name n )(resid   11 and name ca )
      (resid   11 and name c )(resid   12 and name n  ) 5  126.0   14.0  2


assign(resid   11 and name c )(resid   12 and name n  )
      (resid   12 and name ca)(resid   12 and name c  ) 5  -95.0   25.0  2

assign(resid   12 and name n )(resid   12 and name ca )
      (resid   12 and name c )(resid   13 and name n  ) 5  133.0   38.0  2


assign(resid   12 and name c )(resid   13 and name n  )
      (resid   13 and name ca)(resid   13 and name c  ) 5  -64.0   22.0  2

assign(resid   13 and name n )(resid   13 and name ca )
      (resid   13 and name c )(resid   14 and name n  ) 5  139.0   14.0  2


assign(resid   14 and name c )(resid   15 and name n  )
      (resid   15 and name ca)(resid   15 and name c  ) 5   86.0   15.0  2

assign(resid   15 and name n )(resid   15 and name ca )
      (resid   15 and name c )(resid   16 and name n  ) 5   -2.0   18.0  2


assign(resid   15 and name c )(resid   16 and name n  )
      (resid   16 and name ca)(resid   16 and name c  ) 5 -104.0   31.0  2

assign(resid   16 and name n )(resid   16 and name ca )
      (resid   16 and name c )(resid   17 and name n  ) 5  147.0   20.0  2


assign(resid   16 and name c )(resid   17 and name n  )
      (resid   17 and name ca)(resid   17 and name c  ) 5 -135.0   23.0  2

assign(resid   17 and name n )(resid   17 and name ca )
      (resid   17 and name c )(resid   18 and name n  ) 5  144.0   15.0  2


assign(resid   17 and name c )(resid   18 and name n  )
      (resid   18 and name ca)(resid   18 and name c  ) 5 -116.0   22.0  2

assign(resid   18 and name n )(resid   18 and name ca )
      (resid   18 and name c )(resid   19 and name n  ) 5  138.0   26.0  2


assign(resid   18 and name c )(resid   19 and name n  )
      (resid   19 and name ca)(resid   19 and name c  ) 5  -90.0   30.0  2

assign(resid   19 and name n )(resid   19 and name ca )
      (resid   19 and name c )(resid   20 and name n  ) 5  125.0   22.0  2


assign(resid   19 and name c )(resid   20 and name n  )
      (resid   20 and name ca)(resid   20 and name c  ) 5  -58.0    9.0  2

assign(resid   20 and name n )(resid   20 and name ca )
      (resid   20 and name c )(resid   21 and name n  ) 5  145.0   17.0  2


assign(resid   20 and name c )(resid   21 and name n  )
      (resid   21 and name ca)(resid   21 and name c  ) 5  -58.0   10.0  2

assign(resid   21 and name n )(resid   21 and name ca )
      (resid   21 and name c )(resid   22 and name n  ) 5  -35.0   15.0  2


assign(resid   21 and name c )(resid   22 and name n  )
      (resid   22 and name ca)(resid   22 and name c  ) 5  -61.0   10.0  2

assign(resid   22 and name n )(resid   22 and name ca )
      (resid   22 and name c )(resid   23 and name n  ) 5  -39.0   12.0  2


assign(resid   22 and name c )(resid   23 and name n  )
      (resid   23 and name ca)(resid   23 and name c  ) 5  -66.0    9.0  2

assign(resid   23 and name n )(resid   23 and name ca )
      (resid   23 and name c )(resid   24 and name n  ) 5  -41.0   15.0  2


assign(resid   23 and name c )(resid   24 and name n  )
      (resid   24 and name ca)(resid   24 and name c  ) 5  -63.0   12.0  2

assign(resid   24 and name n )(resid   24 and name ca )
      (resid   24 and name c )(resid   25 and name n  ) 5  -41.0   12.0  2


assign(resid   24 and name c )(resid   25 and name n  )
      (resid   25 and name ca)(resid   25 and name c  ) 5  -65.0   13.0  2

assign(resid   25 and name n )(resid   25 and name ca )
      (resid   25 and name c )(resid   26 and name n  ) 5  -39.0   11.0  2


assign(resid   25 and name c )(resid   26 and name n  )
      (resid   26 and name ca)(resid   26 and name c  ) 5  -70.0   16.0  2

assign(resid   26 and name n )(resid   26 and name ca )
      (resid   26 and name c )(resid   27 and name n  ) 5  -36.0   11.0  2


assign(resid   26 and name c )(resid   27 and name n  )
      (resid   27 and name ca)(resid   27 and name c  ) 5  -92.0   17.0  2

assign(resid   27 and name n )(resid   27 and name ca )
      (resid   27 and name c )(resid   28 and name n  ) 5    5.0   19.0  2


assign(resid   27 and name c )(resid   28 and name n  )
      (resid   28 and name ca)(resid   28 and name c  ) 5   74.0   22.0  2

assign(resid   28 and name n )(resid   28 and name ca )
      (resid   28 and name c )(resid   29 and name n  ) 5   25.0   21.0  2


assign(resid   28 and name c )(resid   29 and name n  )
      (resid   29 and name ca)(resid   29 and name c  ) 5  -89.0   26.0  2

assign(resid   29 and name n )(resid   29 and name ca )
      (resid   29 and name c )(resid   30 and name n  ) 5  134.0   16.0  2


assign(resid   29 and name c )(resid   30 and name n  )
      (resid   30 and name ca)(resid   30 and name c  ) 5 -113.0   23.0  2

assign(resid   30 and name n )(resid   30 and name ca )
      (resid   30 and name c )(resid   31 and name n  ) 5  155.0   39.0  2


assign(resid   31 and name c )(resid   32 and name n  )
      (resid   32 and name ca)(resid   32 and name c  ) 5   88.0   14.0  2

assign(resid   32 and name n )(resid   32 and name ca )
      (resid   32 and name c )(resid   33 and name n  ) 5    2.0   18.0  2


assign(resid   32 and name c )(resid   33 and name n  )
      (resid   33 and name ca)(resid   33 and name c  ) 5  -96.0   39.0  2

assign(resid   33 and name n )(resid   33 and name ca )
      (resid   33 and name c )(resid   34 and name n  ) 5  139.0   33.0  2


assign(resid   33 and name c )(resid   34 and name n  )
      (resid   34 and name ca)(resid   34 and name c  ) 5 -114.0   22.0  2

assign(resid   34 and name n )(resid   34 and name ca )
      (resid   34 and name c )(resid   35 and name n  ) 5  136.0   23.0  2


assign(resid   34 and name c )(resid   35 and name n  )
      (resid   35 and name ca)(resid   35 and name c  ) 5 -130.0   16.0  2

assign(resid   35 and name n )(resid   35 and name ca )
      (resid   35 and name c )(resid   36 and name n  ) 5  142.0   24.0  2


assign(resid   35 and name c )(resid   36 and name n  )
      (resid   36 and name ca)(resid   36 and name c  ) 5 -118.0   13.0  2

assign(resid   36 and name n )(resid   36 and name ca )
      (resid   36 and name c )(resid   37 and name n  ) 5  127.0   18.0  2


assign(resid   36 and name c )(resid   37 and name n  )
      (resid   37 and name ca)(resid   37 and name c  ) 5 -127.0   16.0  2

assign(resid   37 and name n )(resid   37 and name ca )
      (resid   37 and name c )(resid   38 and name n  ) 5  144.0   22.0  2


assign(resid   37 and name c )(resid   38 and name n  )
      (resid   38 and name ca)(resid   38 and name c  ) 5 -125.0   20.0  2

assign(resid   38 and name n )(resid   38 and name ca )
      (resid   38 and name c )(resid   39 and name n  ) 5  132.0   14.0  2


assign(resid   38 and name c )(resid   39 and name n  )
      (resid   39 and name ca)(resid   39 and name c  ) 5 -127.0   12.0  2

assign(resid   39 and name n )(resid   39 and name ca )
      (resid   39 and name c )(resid   40 and name n  ) 5  135.0   16.0  2


assign(resid   39 and name c )(resid   40 and name n  )
      (resid   40 and name ca)(resid   40 and name c  ) 5 -129.0   17.0  2

assign(resid   40 and name n )(resid   40 and name ca )
      (resid   40 and name c )(resid   41 and name n  ) 5  136.0   15.0  2


assign(resid   40 and name c )(resid   41 and name n  )
      (resid   41 and name ca)(resid   41 and name c  ) 5 -122.0   24.0  2

assign(resid   41 and name n )(resid   41 and name ca )
      (resid   41 and name c )(resid   42 and name n  ) 5  134.0   23.0  2


assign(resid   41 and name c )(resid   42 and name n  )
      (resid   42 and name ca)(resid   42 and name c  ) 5 -102.0   21.0  2

assign(resid   42 and name n )(resid   42 and name ca )
      (resid   42 and name c )(resid   43 and name n  ) 5  123.0   15.0  2


assign(resid   42 and name c )(resid   43 and name n  )
      (resid   43 and name ca)(resid   43 and name c  ) 5 -107.0   42.0  2

assign(resid   43 and name n )(resid   43 and name ca )
      (resid   43 and name c )(resid   44 and name n  ) 5  145.0   33.0  2


assign(resid   43 and name c )(resid   44 and name n  )
      (resid   44 and name ca)(resid   44 and name c  ) 5   68.0   8.0  2

assign(resid   44 and name n )(resid   44 and name ca )
      (resid   44 and name c )(resid   45 and name n  ) 5 -114.0   14.0  2


assign(resid   44 and name c )(resid   45 and name n  )
      (resid   45 and name ca)(resid   45 and name c  ) 5  -90.0   15.0  2

assign(resid   45 and name n )(resid   45 and name ca )
      (resid   45 and name c )(resid   46 and name n  ) 5    0.0   15.0  2


assign(resid   45 and name c )(resid   46 and name n  )
      (resid   46 and name ca)(resid   46 and name c  ) 5 -102.0   29.0  2

assign(resid   46 and name n )(resid   46 and name ca )
      (resid   46 and name c )(resid   47 and name n  ) 5  137.0   32.0  2


assign(resid   46 and name c )(resid   47 and name n  )
      (resid   47 and name ca)(resid   47 and name c  ) 5  -62.0   13.0  2

assign(resid   47 and name n )(resid   47 and name ca )
      (resid   47 and name c )(resid   48 and name n  ) 5  144.0   13.0  2


assign(resid   47 and name c )(resid   48 and name n  )
      (resid   48 and name ca)(resid   48 and name c  ) 5 -118.0   25.0  2

assign(resid   48 and name n )(resid   48 and name ca )
      (resid   48 and name c )(resid   49 and name n  ) 5  140.0   24.0  2


assign(resid   48 and name c )(resid   49 and name n  )
      (resid   49 and name ca)(resid   49 and name c  ) 5 -129.0   15.0  2

assign(resid   49 and name n )(resid   49 and name ca )
      (resid   49 and name c )(resid   50 and name n  ) 5  149.0   20.0  2


assign(resid   49 and name c )(resid   50 and name n  )
      (resid   50 and name ca)(resid   50 and name c  ) 5 -148.0   25.0  2

assign(resid   50 and name n )(resid   50 and name ca )
      (resid   50 and name c )(resid   51 and name n  ) 5  155.0   19.0  2


assign(resid   50 and name c )(resid   51 and name n  )
      (resid   51 and name ca)(resid   51 and name c  ) 5 -114.0   22.0  2

assign(resid   51 and name n )(resid   51 and name ca )
      (resid   51 and name c )(resid   52 and name n  ) 5  138.0   19.0  2


assign(resid   51 and name c )(resid   52 and name n  )
      (resid   52 and name ca)(resid   52 and name c  ) 5 -141.0   25.0  2

assign(resid   52 and name n )(resid   52 and name ca )
      (resid   52 and name c )(resid   53 and name n  ) 5  153.0   21.0  2


assign(resid   52 and name c )(resid   53 and name n  )
      (resid   53 and name ca)(resid   53 and name c  ) 5 -112.0   13.0  2

assign(resid   53 and name n )(resid   53 and name ca )
      (resid   53 and name c )(resid   54 and name n  ) 5  133.0   15.0  2


assign(resid   53 and name c )(resid   54 and name n  )
      (resid   54 and name ca)(resid   54 and name c  ) 5 -132.0   27.0  2

assign(resid   54 and name n )(resid   54 and name ca )
      (resid   54 and name c )(resid   55 and name n  ) 5  142.0   22.0  2


assign(resid   54 and name c )(resid   55 and name n  )
      (resid   55 and name ca)(resid   55 and name c  ) 5 -117.0   31.0  2

assign(resid   55 and name n )(resid   55 and name ca )
      (resid   55 and name c )(resid   56 and name n  ) 5  139.0   30.0  2


assign(resid   55 and name c )(resid   56 and name n  )
      (resid   56 and name ca)(resid   56 and name c  ) 5  -96.0   35.0  2

assign(resid   56 and name n )(resid   56 and name ca )
      (resid   56 and name c )(resid   57 and name n  ) 5  133.0   14.0  2


assign(resid   57 and name c )(resid   58 and name n  )
      (resid   58 and name ca)(resid   58 and name c  ) 5  -72.0   10.0  2

assign(resid   58 and name n )(resid   58 and name ca )
      (resid   58 and name c )(resid   59 and name n  ) 5  136.0   36.0  2


assign(resid   59 and name c )(resid   60 and name n  )
      (resid   60 and name ca)(resid   60 and name c  ) 5   81.0   14.0  2

assign(resid   60 and name n )(resid   60 and name ca )
      (resid   60 and name c )(resid   61 and name n  ) 5    3.0   17.0  2


assign(resid   60 and name c )(resid   61 and name n  )
      (resid   61 and name ca)(resid   61 and name c  ) 5  -93.0   15.0  2

assign(resid   61 and name n )(resid   61 and name ca )
      (resid   61 and name c )(resid   62 and name n  ) 5  161.0   25.0  2


assign(resid   61 and name c )(resid   62 and name n  )
      (resid   62 and name ca)(resid   62 and name c  ) 5 -129.0   26.0  2

assign(resid   62 and name n )(resid   62 and name ca )
      (resid   62 and name c )(resid   63 and name n  ) 5  138.0   19.0  2


assign(resid   62 and name c )(resid   63 and name n  )
      (resid   63 and name ca)(resid   63 and name c  ) 5 -100.0   18.0  2

assign(resid   63 and name n )(resid   63 and name ca )
      (resid   63 and name c )(resid   64 and name n  ) 5  127.0   14.0  2


assign(resid   63 and name c )(resid   64 and name n  )
      (resid   64 and name ca)(resid   64 and name c  ) 5  -84.0   23.0  2

assign(resid   64 and name n )(resid   64 and name ca )
      (resid   64 and name c )(resid   65 and name n  ) 5  128.0   21.0  2


assign(resid   64 and name c )(resid   65 and name n  )
      (resid   65 and name ca)(resid   65 and name c  ) 5  -58.0    9.0  2

assign(resid   65 and name n )(resid   65 and name ca )
      (resid   65 and name c )(resid   66 and name n  ) 5  147.0   17.0  2


assign(resid   65 and name c )(resid   66 and name n  )
      (resid   66 and name ca)(resid   66 and name c  ) 5  -59.0   10.0  2

assign(resid   66 and name n )(resid   66 and name ca )
      (resid   66 and name c )(resid   67 and name n  ) 5  -42.0   14.0  2


assign(resid   66 and name c )(resid   67 and name n  )
      (resid   67 and name ca)(resid   67 and name c  ) 5  -62.0   12.0  2

assign(resid   67 and name n )(resid   67 and name ca )
      (resid   67 and name c )(resid   68 and name n  ) 5  -39.0   13.0  2


assign(resid   67 and name c )(resid   68 and name n  )
      (resid   68 and name ca)(resid   68 and name c  ) 5  -66.0   11.0  2

assign(resid   68 and name n )(resid   68 and name ca )
      (resid   68 and name c )(resid   69 and name n  ) 5  -42.0    9.0  2


assign(resid   68 and name c )(resid   69 and name n  )
      (resid   69 and name ca)(resid   69 and name c  ) 5  -62.0    8.0  2

assign(resid   69 and name n )(resid   69 and name ca )
      (resid   69 and name c )(resid   70 and name n  ) 5  -41.0   11.0  2


assign(resid   69 and name c )(resid   70 and name n  )
      (resid   70 and name ca)(resid   70 and name c  ) 5  -63.2   11.6  2

assign(resid   70 and name n )(resid   70 and name ca )
      (resid   70 and name c )(resid   71 and name n  ) 5  -38.2   14.7  2


assign(resid   70 and name c )(resid   71 and name n  )
      (resid   71 and name ca)(resid   71 and name c  ) 5  -75.0   21.0  2

assign(resid   71 and name n )(resid   71 and name ca )
      (resid   71 and name c )(resid   72 and name n  ) 5  -37.0   17.0  2


assign(resid   71 and name c )(resid   72 and name n  )
      (resid   72 and name ca)(resid   72 and name c  ) 5  -84.0   15.0  2

assign(resid   72 and name n )(resid   72 and name ca )
      (resid   72 and name c )(resid   73 and name n  ) 5   -1.0   19.0  2


assign(resid   72 and name c )(resid   73 and name n  )
      (resid   73 and name ca)(resid   73 and name c  ) 5   85.0   16.0  2

assign(resid   73 and name n )(resid   73 and name ca )
      (resid   73 and name c )(resid   74 and name n  ) 5   12.0   23.0  2


assign(resid   73 and name c )(resid   74 and name n  )
      (resid   74 and name ca)(resid   74 and name c  ) 5 -106.0   30.0  2

assign(resid   74 and name n )(resid   74 and name ca )
      (resid   74 and name c )(resid   75 and name n  ) 5  142.0   12.0  2


assign(resid   74 and name c )(resid   75 and name n  )
      (resid   75 and name ca)(resid   75 and name c  ) 5 -113.0   23.0  2

assign(resid   75 and name n )(resid   75 and name ca )
      (resid   75 and name c )(resid   76 and name n  ) 5  155.0   39.0  2


assign(resid   75 and name c )(resid   76 and name n  )
      (resid   76 and name ca)(resid   76 and name c  ) 5  -56.0   10.0  2

assign(resid   76 and name n )(resid   76 and name ca )
      (resid   76 and name c )(resid   77 and name n  ) 5  144.0   18.0  2


assign(resid   76 and name c )(resid   77 and name n  )
      (resid   77 and name ca)(resid   77 and name c  ) 5   90.0   14.0  2

assign(resid   77 and name n )(resid   77 and name ca )
      (resid   77 and name c )(resid   78 and name n  ) 5    3.0   18.0  2


assign(resid   77 and name c )(resid   78 and name n  )
      (resid   78 and name ca)(resid   78 and name c  ) 5  -99.0   40.0  2

assign(resid   78 and name n )(resid   78 and name ca )
      (resid   78 and name c )(resid   79 and name n  ) 5  141.0   21.0  2


assign(resid   78 and name c )(resid   79 and name n  )
      (resid   79 and name ca)(resid   79 and name c  ) 5 -105.0   16.0  2

assign(resid   79 and name n )(resid   79 and name ca )
      (resid   79 and name c )(resid   80 and name n  ) 5  129.0   12.0  2


assign(resid   79 and name c )(resid   80 and name n  )
      (resid   80 and name ca)(resid   80 and name c  ) 5 -115.0   31.0  2

assign(resid   80 and name n )(resid   80 and name ca )
      (resid   80 and name c )(resid   81 and name n  ) 5  141.0   18.0  2


assign(resid   80 and name c )(resid   81 and name n  )
      (resid   81 and name ca)(resid   81 and name c  ) 5 -116.0   23.0  2

assign(resid   81 and name n )(resid   81 and name ca )
      (resid   81 and name c )(resid   82 and name n  ) 5  128.0   15.0  2


assign(resid   81 and name c )(resid   82 and name n  )
      (resid   82 and name ca)(resid   82 and name c  ) 5 -110.0   19.0  2

assign(resid   82 and name n )(resid   82 and name ca )
      (resid   82 and name c )(resid   83 and name n  ) 5  123.0   23.0  2


assign(resid   82 and name c )(resid   83 and name n  )
      (resid   83 and name ca)(resid   83 and name c  ) 5 -111.0   20.0  2

assign(resid   83 and name n )(resid   83 and name ca )
      (resid   83 and name c )(resid   84 and name n  ) 5  130.0   24.0  2


assign(resid   86 and name c )(resid   87 and name n  )
      (resid   87 and name ca)(resid   87 and name c  ) 5 -125.0   31.0  2

assign(resid   87 and name n )(resid   87 and name ca )
      (resid   87 and name c )(resid   88 and name n  ) 5  141.0   30.0  2


assign(resid   87 and name c )(resid   88 and name n  )
      (resid   88 and name ca)(resid   88 and name c  ) 5 -119.0   33.0  2

assign(resid   88 and name n )(resid   88 and name ca )
      (resid   88 and name c )(resid   89 and name n  ) 5  132.0   19.0  2


assign(resid   88 and name c )(resid   89 and name n  )
      (resid   89 and name ca)(resid   89 and name c  ) 5  -93.0   31.0  2

assign(resid   89 and name n )(resid   89 and name ca )
      (resid   89 and name c )(resid   90 and name n  ) 5  124.0   36.0  2


assign(resid   89 and name c )(resid   90 and name n  )
      (resid   90 and name ca)(resid   90 and name c  ) 5  -65.0   11.0  2

assign(resid   90 and name n )(resid   90 and name ca )
      (resid   90 and name c )(resid   91 and name n  ) 5  147.0   13.0  2


assign(resid   90 and name c )(resid   91 and name n  )
      (resid   91 and name ca)(resid   91 and name c  ) 5  -98.0   38.0  2

assign(resid   91 and name n )(resid   91 and name ca )
      (resid   91 and name c )(resid   92 and name n  ) 5  136.0   34.0  2



!!   Sidechain phi and psi restraints from TALOS

! Chi1 all residues

assign (resid   3 and name N  ) (resid   3 and name CA  )
       (resid   3 and name CB ) (resid   3 and name CG1 )  10  60 30 2

assign (resid   4 and name N  ) (resid   4 and name CA  )
       (resid   4 and name CB ) (resid   4 and name CG  )  10 -60 30 2

assign (resid   6 and name N  ) (resid   6 and name CA  )
       (resid   6 and name CB ) (resid   6 and name CG  )  10 180 30 2

assign (resid   7 and name N  ) (resid   7 and name CA  )
       (resid   7 and name CB ) (resid   7 and name CG  )  10  60 30 2

assign (resid   8 and name N  ) (resid   8 and name CA  )
       (resid   8 and name CB ) (resid   8 and name CG  )  10 -60 30 2

assign (resid   9 and name N  ) (resid   9 and name CA  )
       (resid   9 and name CB ) (resid   9 and name OG1 )  10 180 30 2

assign (resid  10 and name N  ) (resid  10 and name CA  )
       (resid  10 and name CB ) (resid  10 and name OG1 )  10 180 30 2

assign (resid  11 and name N  ) (resid  11 and name CA  )
       (resid  11 and name CB ) (resid  11 and name CG1 )  10 180 30 2

assign (resid  12 and name N  ) (resid  12 and name CA  )
       (resid  12 and name CB ) (resid  12 and name CG  )  10 -60 30 2

assign (resid  14 and name N  ) (resid  14 and name CA  )
       (resid  14 and name CB ) (resid  14 and name CG1 )  10 -60 30 2

assign (resid  16 and name N  ) (resid  16 and name CA  )
       (resid  16 and name CB ) (resid  16 and name CG  )  10 180 30 2

assign (resid  17 and name N  ) (resid  17 and name CA  )
       (resid  17 and name CB ) (resid  17 and name CG1 )  10  60 30 2

assign (resid  18 and name N  ) (resid  18 and name CA  )
       (resid  18 and name CB ) (resid  18 and name CG1 )  10 -60 30 2

assign (resid  19 and name N  ) (resid  19 and name CA  )
       (resid  19 and name CB ) (resid  19 and name CG1 )  10 -60 30 2

assign (resid  20 and name N  ) (resid  20 and name CA  )
       (resid  20 and name CB ) (resid  20 and name CG  )  10  30 30 2

assign (resid  23 and name N  ) (resid  23 and name CA  )
       (resid  23 and name CB ) (resid  23 and name OG1 )  10 -60 30 2

assign (resid  24 and name N  ) (resid  24 and name CA  )
       (resid  24 and name CB ) (resid  24 and name CG  )  10 -60 30 2

assign (resid  24 and name CA ) (resid  24 and name CB  )
       (resid  24 and name CG ) (resid  24 and name CD  )  10 180 30 2

assign (resid  24 and name CB ) (resid  24 and name CG  )
       (resid  24 and name CD ) (resid  24 and name NE  )  10 180 30 2

assign (resid  24 and name CG ) (resid  24 and name CD  )
       (resid  24 and name NE ) (resid  24 and name CZ  )  10 180 30 2

assign (resid  26 and name N  ) (resid  26 and name CA  )
       (resid  26 and name CB ) (resid  26 and name CG  )  10 180 30 2

assign (resid  27 and name N  ) (resid  27 and name CA  )
       (resid  27 and name CB ) (resid  27 and name CG  )  10 180 30 2

assign (resid  29 and name N  ) (resid  29 and name CA  )
       (resid  29 and name CB ) (resid  29 and name CG1 )  10 -60 30 2

assign (resid  34 and name N  ) (resid  34 and name CA  )
       (resid  34 and name CB ) (resid  34 and name CG  )  10 -60 30 2

assign (resid  33 and name N  ) (resid  33 and name CA  )
       (resid  33 and name CB ) (resid  33 and name CG  )  10 -60 30 2

assign (resid  35 and name N  ) (resid  35 and name CA  )
       (resid  35 and name CB ) (resid  35 and name CG1 )  10 -60 30 2

assign (resid  37 and name N  ) (resid  37 and name CA  )
       (resid  37 and name CB ) (resid  37 and name CG1 )  10 180 30 2

assign (resid  39 and name N  ) (resid  39 and name CA  )
       (resid  39 and name CB ) (resid  39 and name CG1 )  10  60 30 2

assign (resid  40 and name N  ) (resid  40 and name CA  )
       (resid  40 and name CB ) (resid  40 and name CG1 )  10 180 30 2

assign (resid  41 and name N  ) (resid  41 and name CA  )
       (resid  41 and name CB ) (resid  41 and name CG  )  10 180 30 2

assign (resid  45 and name N  ) (resid  45 and name CA  )
       (resid  45 and name CB ) (resid  45 and name CG  )  10  60 30 2

assign (resid  46 and name N  ) (resid  46 and name CA  )
       (resid  46 and name CB ) (resid  46 and name CG  )  10  60 30 2

assign (resid  51 and name N  ) (resid  51 and name CA  )
       (resid  51 and name CB ) (resid  51 and name OG1 )  10 -60 30 2

assign (resid  53 and name N  ) (resid  53 and name CA  )
       (resid  53 and name CB ) (resid  53 and name OG1 )  10 -60 30 2

assign (resid  55 and name N  ) (resid  55 and name CA  )
       (resid  55 and name CB ) (resid  55 and name CG  )  10 180 30 2

assign (resid  56 and name N  ) (resid  56 and name CA  )
       (resid  56 and name CB ) (resid  56 and name CG1 )  10 180 30 2

assign (resid  58 and name N  ) (resid  58 and name CA  )
       (resid  58 and name CB ) (resid  58 and name CG  )  10 180 30 2

assign (resid  62 and name N  ) (resid  62 and name CA  )
       (resid  62 and name CB ) (resid  62 and name CG1 )  10  60 30 2

assign (resid  63 and name N  ) (resid  63 and name CA  )
       (resid  63 and name CB ) (resid  63 and name CG1 )  10 -60 30 2

assign (resid  64 and name N  ) (resid  64 and name CA  )
       (resid  64 and name CB ) (resid  64 and name CG1 )  10 -60 30 2

assign (resid  65 and name N  ) (resid  65 and name CA  )
       (resid  65 and name CB ) (resid  65 and name CG  )  10  30 30 2

assign (resid  68 and name N  ) (resid  68 and name CA  )
       (resid  68 and name CB ) (resid  68 and name CG  )  10 -60 30 2

assign (resid  69 and name N  ) (resid  69 and name CA  )
       (resid  69 and name CB ) (resid  69 and name CG  )  10 -60 30 2

assign (resid  69 and name CA ) (resid  69 and name CB  )
       (resid  69 and name CG ) (resid  69 and name CD  )  10 180 30 2

assign (resid  69 and name CB ) (resid  69 and name CG  )
       (resid  69 and name CD ) (resid  69 and name NE  )  10 180 30 2

assign (resid  69 and name CG ) (resid  69 and name CD  )
       (resid  69 and name NE ) (resid  69 and name CZ  )  10 180 30 2


assign (resid  71 and name N  ) (resid  71 and name CA  )
       (resid  71 and name CB ) (resid  71 and name CG1 )  10 180 30 2

assign (resid  72 and name N  ) (resid  72 and name CA  )
       (resid  72 and name CB ) (resid  72 and name CG1 )  10 -60 30 2

assign (resid  74 and name N  ) (resid  74 and name CA  )
       (resid  74 and name CB ) (resid  74 and name CG1 )  10 -60 30 2

assign (resid  79 and name N  ) (resid  79 and name CA  )
       (resid  79 and name CB ) (resid  79 and name CG1 )  10  60 30 2

assign (resid  80 and name N  ) (resid  80 and name CA  )
       (resid  80 and name CB ) (resid  80 and name CG1 )  10  60 30 2

assign (resid  82 and name N  ) (resid  82 and name CA  )
       (resid  82 and name CB ) (resid  82 and name CG1 )  10 180 30 2

assign (resid  83 and name N  ) (resid  83 and name CA  )
       (resid  83 and name CB ) (resid  83 and name CG  )  10 -60 30 2

assign (resid  84 and name N  ) (resid  84 and name CA  )
       (resid  84 and name CB ) (resid  84 and name CG  )  10 -60 30 2

assign (resid  85 and name N  ) (resid  85 and name CA  )
       (resid  85 and name CB ) (resid  85 and name CG  )  10 -60 30 2

assign (resid  88 and name N  ) (resid  88 and name CA  )
       (resid  88 and name CB ) (resid  88 and name CG  )  10 -60 30 2

assign (resid  90 and name N  ) (resid  90 and name CA  )
       (resid  90 and name CB ) (resid  90 and name CG  )  10 -30 30 2


! Chi2 L


assign (resid   4 and name CA ) (resid   4 and name CB  )
       (resid   4 and name CG ) (resid   4 and name CD1 )  10 180 30 2


assign (resid  68 and name CA ) (resid  68 and name CB  )
       (resid  68 and name CG ) (resid  68 and name CD1 )  10 180 30 2


assign (resid  83 and name CA ) (resid  83 and name CB  )
       (resid  83 and name CG ) (resid  83 and name CD1 )  10 180 30 2


assign (resid  84 and name CA ) (resid  84 and name CB  )
       (resid  84 and name CG ) (resid  84 and name CD1 )  10 180 30 2


assign (resid  85 and name CA ) (resid  85 and name CB  )
       (resid  85 and name CG ) (resid  85 and name CD1 )  10 180 30 2


! Chi2 I


assign (resid  14 and name CA  ) (resid  14 and name CB  )
       (resid  14 and name CG1 ) (resid  14 and name CD1 )  10 180 30 2


assign (resid  17 and name CA  ) (resid  17 and name CB  )
       (resid  17 and name CG1 ) (resid  17 and name CD1 )  10 180 30 2


assign (resid  18 and name CA  ) (resid  18 and name CB  )
       (resid  18 and name CG1 ) (resid  18 and name CD1 )  10 -60 30 2
       
       
assign (resid  19 and name CA  ) (resid  19 and name CB  )
       (resid  19 and name CG1 ) (resid  19 and name CD1 )  10 180 30 2
       
       
assign (resid  29 and name CA  ) (resid  29 and name CB  )
       (resid  29 and name CG1 ) (resid  29 and name CD1 )  10 180 30 2
       
       
assign (resid  37 and name CA  ) (resid  37 and name CB  )
       (resid  37 and name CG1 ) (resid  37 and name CD1 )  10 180 30 2
       
       
assign (resid  39 and name CA  ) (resid  39 and name CB  )
       (resid  39 and name CG1 ) (resid  39 and name CD1 )  10 180 30 2
       
       
assign (resid  63 and name CA  ) (resid  63 and name CB  )
       (resid  63 and name CG1 ) (resid  63 and name CD1 )  10 -60 30 2
       
       
assign (resid  64 and name CA  ) (resid  64 and name CB  )
       (resid  64 and name CG1 ) (resid  64 and name CD1 )  10 180 30 2
      
      
assign (resid  72 and name CA  ) (resid  72 and name CB  )
       (resid  72 and name CG1 ) (resid  72 and name CD1 )  10 180 30 2
       
       
assign (resid  74 and name CA  ) (resid  74 and name CB  )
       (resid  74 and name CG1 ) (resid  74 and name CD1 )  10 -60 30 2
       
       
assign (resid  80 and name CA  ) (resid  80 and name CB  )
       (resid  80 and name CG1 ) (resid  80 and name CD1 )  10 180 30 2



! Chi2 Pro


assign (resid  20 and name CA ) (resid  20 and name CB  )
       (resid  20 and name CG ) (resid  20 and name CD  )  10 -45 5  2


assign (resid  65 and name CA ) (resid  65 and name CB  )
       (resid  65 and name CG ) (resid  65 and name CD  )  10 -45 5  2


assign (resid  90 and name CA ) (resid  90 and name CB  )
       (resid  90 and name CG ) (resid  90 and name CD  )  10  45 5  2




!!!	J-COUPLING RESTRAINTS


!!    Non-glycine 3JHN-HA


assign(resid 6  and name c  )(resid 7  and name n )(resid 7  and name ca )(resid  7 and name c  )  7.81 1.0 

assign(resid 7  and name c  )(resid 8  and name n )(resid 8  and name ca )(resid  8 and name c  ) 10.02 1.0 

assign(resid 8  and name c  )(resid 9  and name n )(resid 9  and name ca )(resid  9 and name c  )  7.74 1.0 

assign(resid 10 and name c  )(resid 11 and name n )(resid 11 and name ca )(resid 11 and name c  )  6.78 1.0 

assign(resid 11 and name c  )(resid 12 and name n )(resid 12 and name ca )(resid 12 and name c  )  9.40 1.0 

assign(resid 12 and name c  )(resid 13 and name n )(resid 13 and name ca )(resid 13 and name c  )  3.52 1.0 

assign(resid 13 and name c  )(resid 14 and name n )(resid 14 and name ca )(resid 14 and name c  )  7.69 1.0 

assign(resid 15 and name c  )(resid 16 and name n )(resid 16 and name ca )(resid 16 and name c  )  7.04 1.0 

assign(resid 16 and name c  )(resid 17 and name n )(resid 17 and name ca )(resid 17 and name c  ) 10.10 1.0 

assign(resid 17 and name c  )(resid 18 and name n )(resid 18 and name ca )(resid 18 and name c  )  9.40 1.0 

assign(resid 18 and name c  )(resid 19 and name n )(resid 19 and name ca )(resid 19 and name c  )  6.81 1.0 

assign(resid 20 and name c  )(resid 21 and name n )(resid 21 and name ca )(resid 21 and name c  )  3.65 1.0 

assign(resid 22 and name c  )(resid 23 and name n )(resid 23 and name ca )(resid 23 and name c  )  6.18 1.0 

assign(resid 23 and name c  )(resid 24 and name n )(resid 24 and name ca )(resid 24 and name c  )  2.71 1.0 

assign(resid 24 and name c  )(resid 25 and name n )(resid 25 and name ca )(resid 25 and name c  )  5.01 1.0 

assign(resid 25 and name c  )(resid 26 and name n )(resid 26 and name ca )(resid 26 and name c  )  4.25 1.0 

assign(resid 26 and name c  )(resid 27 and name n )(resid 27 and name ca )(resid 27 and name c  )  8.09 1.0 

assign(resid 28 and name c  )(resid 29 and name n )(resid 29 and name ca )(resid 29 and name c  )  8.08 1.0 

assign(resid 29 and name c  )(resid 30 and name n )(resid 30 and name ca )(resid 30 and name c  ) 10.26 1.0 

assign(resid 32 and name c  )(resid 33 and name n )(resid 33 and name ca )(resid 33 and name c  )  6.22 1.0 

assign(resid 33 and name c  )(resid 34 and name n )(resid 34 and name ca )(resid 34 and name c  )  9.96 1.0 

assign(resid 34 and name c  )(resid 35 and name n )(resid 35 and name ca )(resid 35 and name c  )  9.88 1.0 

assign(resid 35 and name c  )(resid 36 and name n )(resid 36 and name ca )(resid 36 and name c  ) 10.39 1.0 

assign(resid 36 and name c  )(resid 37 and name n )(resid 37 and name ca )(resid 37 and name c  ) 10.09 1.0 

assign(resid 37 and name c  )(resid 38 and name n )(resid 38 and name ca )(resid 38 and name c  )  8.92 1.0 

assign(resid 38 and name c  )(resid 39 and name n )(resid 39 and name ca )(resid 39 and name c  ) 10.37 1.0 

assign(resid 39 and name c  )(resid 40 and name n )(resid 40 and name ca )(resid 40 and name c  )  8.20 1.0 

assign(resid 41 and name c  )(resid 42 and name n )(resid 42 and name ca )(resid 42 and name c  )  8.91 1.0 

assign(resid 42 and name c  )(resid 43 and name n )(resid 43 and name ca )(resid 43 and name c  )  9.07 1.0 

assign(resid 44 and name c  )(resid 45 and name n )(resid 45 and name ca )(resid 45 and name c  )  8.87 1.0 

assign(resid 45 and name c  )(resid 46 and name n )(resid 46 and name ca )(resid 46 and name c  )  9.66 1.0 

assign(resid 47 and name c  )(resid 48 and name n )(resid 48 and name ca )(resid 48 and name c  )  9.80 1.0 

assign(resid 48 and name c  )(resid 49 and name n )(resid 49 and name ca )(resid 49 and name c  ) 10.49 1.0 

assign(resid 50 and name c  )(resid 51 and name n )(resid 51 and name ca )(resid 51 and name c  ) 10.12 1.0 

assign(resid 51 and name c  )(resid 52 and name n )(resid 52 and name ca )(resid 52 and name c  )  7.45 1.0 

assign(resid 52 and name c  )(resid 53 and name n )(resid 53 and name ca )(resid 53 and name c  ) 10.14 1.0 

assign(resid 53 and name c  )(resid 54 and name n )(resid 54 and name ca )(resid 54 and name c  )  8.72 1.0 

assign(resid 54 and name c  )(resid 55 and name n )(resid 55 and name ca )(resid 55 and name c  )  8.21 1.0 

assign(resid 55 and name c  )(resid 56 and name n )(resid 56 and name ca )(resid 56 and name c  )  6.51 1.0 

assign(resid 57 and name c  )(resid 58 and name n )(resid 58 and name ca )(resid 58 and name c  )  4.37 1.0 

assign(resid 58 and name c  )(resid 59 and name n )(resid 59 and name ca )(resid 59 and name c  )  6.84 1.0 

assign(resid 60 and name c  )(resid 61 and name n )(resid 61 and name ca )(resid 61 and name c  )  6.01 1.0 

assign(resid 61 and name c  )(resid 62 and name n )(resid 62 and name ca )(resid 62 and name c  )  9.25 1.0 

assign(resid 62 and name c  )(resid 63 and name n )(resid 63 and name ca )(resid 63 and name c  )  9.35 1.0 

assign(resid 63 and name c  )(resid 64 and name n )(resid 64 and name ca )(resid 64 and name c  )  6.23 1.0 

assign(resid 65 and name c  )(resid 66 and name n )(resid 66 and name ca )(resid 66 and name c  )  2.55 1.0 

assign(resid 66 and name c  )(resid 67 and name n )(resid 67 and name ca )(resid 67 and name c  )  3.67 1.0 

assign(resid 67 and name c  )(resid 68 and name n )(resid 68 and name ca )(resid 68 and name c  )  7.98 1.0 

assign(resid 68 and name c  )(resid 69 and name n )(resid 69 and name ca )(resid 69 and name c  )  4.33 1.0 

assign(resid 69 and name c  )(resid 70 and name n )(resid 70 and name ca )(resid 70 and name c  )  5.52 1.0 

assign(resid 70 and name c  )(resid 71 and name n )(resid 71 and name ca )(resid 71 and name c  )  5.52 1.0 

assign(resid 71 and name c  )(resid 72 and name n )(resid 72 and name ca )(resid 72 and name c  )  7.97 1.0 

assign(resid 73 and name c  )(resid 74 and name n )(resid 74 and name ca )(resid 74 and name c  )  8.16 1.0 

assign(resid 74 and name c  )(resid 75 and name n )(resid 75 and name ca )(resid 75 and name c  ) 10.38 1.0 

assign(resid 77 and name c  )(resid 78 and name n )(resid 78 and name ca )(resid 78 and name c  )  7.08 1.0 

assign(resid 78 and name c  )(resid 79 and name n )(resid 79 and name ca )(resid 79 and name c  )  8.76 1.0 

assign(resid 79 and name c  )(resid 80 and name n )(resid 80 and name ca )(resid 80 and name c  ) 10.36 1.0 

assign(resid 80 and name c  )(resid 81 and name n )(resid 81 and name ca )(resid 81 and name c  ) 10.00 1.0 

assign(resid 81 and name c  )(resid 82 and name n )(resid 82 and name ca )(resid 82 and name c  )  9.86 1.0 

assign(resid 82 and name c  )(resid 83 and name n )(resid 83 and name ca )(resid 83 and name c  )  9.82 1.0 

assign(resid 83 and name c  )(resid 84 and name n )(resid 84 and name ca )(resid 84 and name c  )  6.37 1.0 

assign(resid 84 and name c  )(resid 85 and name n )(resid 85 and name ca )(resid 85 and name c  )  9.08 1.0 

assign(resid 86 and name c  )(resid 87 and name n )(resid 87 and name ca )(resid 87 and name c  )  8.02 1.0 



!!    Glycine 3JHN-HA2


assign(resid 14 and name c  )(resid 15 and name n )(resid 15 and name ca )(resid 15 and name c  )  6.13 1.0 

assign(resid 21 and name c  )(resid 22 and name n )(resid 22 and name ca )(resid 22 and name c  )  4.60 1.0 

assign(resid 27 and name c  )(resid 28 and name n )(resid 28 and name ca )(resid 28 and name c  )  6.56 1.5 

assign(resid 31 and name c  )(resid 32 and name n )(resid 32 and name ca )(resid 32 and name c  )  5.47 1.0 

assign(resid 43 and name c  )(resid 44 and name n )(resid 44 and name ca )(resid 44 and name c  )  6.81 1.5 

assign(resid 49 and name c  )(resid 50 and name n )(resid 50 and name ca )(resid 50 and name c  )  6.52 1.0 

assign(resid 56 and name c  )(resid 57 and name n )(resid 57 and name ca )(resid 57 and name c  )  9.69 1.0 

assign(resid 59 and name c  )(resid 60 and name n )(resid 60 and name ca )(resid 60 and name c  )  6.89 1.0 

assign(resid 72 and name c  )(resid 73 and name n )(resid 73 and name ca )(resid 73 and name c  )  6.73 1.0 

assign(resid 76 and name c  )(resid 77 and name n )(resid 77 and name ca )(resid 77 and name c  )  5.00 1.0 

assign(resid 85 and name c  )(resid 86 and name n )(resid 86 and name ca )(resid 86 and name c  )  5.40 1.0 



!!    Glycine 3JHN-HA1


assign(resid 14 and name c  )(resid 15 and name n )(resid 15 and name ca )(resid 15 and name c  )  6.95 1.0  

assign(resid 21 and name c  )(resid 22 and name n )(resid 22 and name ca )(resid 22 and name c  )  6.69 1.0  

assign(resid 27 and name c  )(resid 28 and name n )(resid 28 and name ca )(resid 28 and name c  )  6.56 1.5  

assign(resid 31 and name c  )(resid 32 and name n )(resid 32 and name ca )(resid 32 and name c  )  8.14 1.0  

assign(resid 43 and name c  )(resid 44 and name n )(resid 44 and name ca )(resid 44 and name c  )  3.70 1.5  

assign(resid 49 and name c  )(resid 50 and name n )(resid 50 and name ca )(resid 50 and name c  )  2.32 1.0  

assign(resid 56 and name c  )(resid 57 and name n )(resid 57 and name ca )(resid 57 and name c  )  4.93 1.0  

assign(resid 59 and name c  )(resid 60 and name n )(resid 60 and name ca )(resid 60 and name c  )  5.67 1.0  

assign(resid 72 and name c  )(resid 73 and name n )(resid 73 and name ca )(resid 73 and name c  )  6.84 1.0  

assign(resid 76 and name c  )(resid 77 and name n )(resid 77 and name ca )(resid 77 and name c  )  8.22 1.0  

assign(resid 85 and name c  )(resid 86 and name n )(resid 86 and name ca )(resid 86 and name c  )  2.69 1.0  



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1  84.440  13.230   1.597
    2   2H    MET   1          2H        MET   1  82.977  12.417   1.303
    3   3H    MET   1          3H        MET   1  83.001  14.112   1.425
    4    HA   MET   1           HA       MET   1  84.507  14.133  -0.579
    5   1HB   MET   1          2HB       MET   1  83.688  11.235  -0.322
    6   2HB   MET   1          1HB       MET   1  84.236  11.907  -1.858
    7   1HG   MET   1          2HG       MET   1  86.327  12.664  -0.750
    8   2HG   MET   1          1HG       MET   1  85.790  11.898   0.745
    9   1HE   MET   1          1HE       MET   1  88.604   9.519  -0.356
   10   2HE   MET   1          2HE       MET   1  87.896  10.466   0.950
   11   3HE   MET   1          3HE       MET   1  88.529  11.283  -0.478
   12    H    ASP   2           H        ASP   2  83.306  13.359  -2.866
   13    HA   ASP   2           HA       ASP   2  80.791  14.825  -2.880
   14   1HB   ASP   2          2HB       ASP   2  82.232  13.123  -4.941
   15   2HB   ASP   2          1HB       ASP   2  80.854  14.163  -5.299
   16    H    VAL   3           H        VAL   3  78.692  13.979  -3.088
   17    HA   VAL   3           HA       VAL   3  78.412  11.012  -3.023
   18    HB   VAL   3           HB       VAL   3  78.165  12.353  -0.824
   19   1HG1  VAL   3          1HG1      VAL   3  76.727  14.163  -1.880
   20   2HG1  VAL   3          2HG1      VAL   3  76.095  13.477  -0.382
   21   3HG1  VAL   3          3HG1      VAL   3  75.421  12.974  -1.936
   22   1HG2  VAL   3          1HG2      VAL   3  75.870  10.606  -1.749
   23   2HG2  VAL   3          2HG2      VAL   3  76.314  10.919  -0.071
   24   3HG2  VAL   3          3HG2      VAL   3  77.412  10.022  -1.122
   25    H    LEU   4           H        LEU   4  76.860  10.228  -4.428
   26    HA   LEU   4           HA       LEU   4  75.618  12.133  -6.305
   27   1HB   LEU   4          2HB       LEU   4  75.479   9.108  -6.162
   28   2HB   LEU   4          1HB       LEU   4  75.121  10.104  -7.565
   29    HG   LEU   4           HG       LEU   4  77.827   9.717  -6.241
   30   1HD1  LEU   4          1HD1      LEU   4  78.336   8.944  -8.651
   31   2HD1  LEU   4          2HD1      LEU   4  76.586   8.856  -8.851
   32   3HD1  LEU   4          3HD1      LEU   4  77.386   7.862  -7.631
   33   1HD2  LEU   4          1HD2      LEU   4  77.967  11.954  -6.932
   34   2HD2  LEU   4          2HD2      LEU   4  76.871  11.702  -8.296
   35   3HD2  LEU   4          3HD2      LEU   4  78.527  11.097  -8.373
   36    H    ALA   5           H        ALA   5  74.687  10.375  -3.453
   37    HA   ALA   5           HA       ALA   5  72.092  11.622  -3.367
   38   1HB   ALA   5          1HB       ALA   5  70.733   9.972  -4.202
   39   2HB   ALA   5          2HB       ALA   5  71.723   8.686  -3.512
   40   3HB   ALA   5          3HB       ALA   5  72.194   9.440  -5.034
   41    H    LYS   6           H        LYS   6  71.095  11.226  -1.292
   42    HA   LYS   6           HA       LYS   6  72.759   9.631   0.638
   43   1HB   LYS   6          2HB       LYS   6  73.228  12.102   0.577
   44   2HB   LYS   6          1HB       LYS   6  71.546  12.390   1.021
   45   1HG   LYS   6          2HG       LYS   6  71.861  11.123   3.101
   46   2HG   LYS   6          1HG       LYS   6  73.535  10.795   2.657
   47   1HD   LYS   6          2HD       LYS   6  73.696  13.410   2.439
   48   2HD   LYS   6          1HD       LYS   6  72.276  13.389   3.486
   49   1HE   LYS   6          2HE       LYS   6  73.649  11.773   4.984
   50   2HE   LYS   6          1HE       LYS   6  75.054  12.362   4.073
   51   1HZ   LYS   6          1HZ       LYS   6  74.272  14.648   4.533
   52   2HZ   LYS   6          2HZ       LYS   6  74.707  13.804   5.941
   53   3HZ   LYS   6          3HZ       LYS   6  73.069  14.013   5.545
   54    H    PHE   7           H        PHE   7  71.463   8.193   1.748
   55    HA   PHE   7           HA       PHE   7  68.711   8.996   2.515
   56   1HB   PHE   7          2HB       PHE   7  67.744   7.028   1.396
   57   2HB   PHE   7          1HB       PHE   7  68.588   8.047   0.235
   58    HD1  PHE   7           HD1      PHE   7  68.239   4.712   1.530
   59    HD2  PHE   7           HD2      PHE   7  71.118   7.439  -0.273
   60    HE1  PHE   7           HE1      PHE   7  69.664   2.756   0.844
   61    HE2  PHE   7           HE2      PHE   7  72.545   5.481  -0.951
   62    HZ   PHE   7           HZ       PHE   7  71.818   3.137  -0.387
   63    H    HIS   8           H        HIS   8  67.746   7.426   4.065
   64    HA   HIS   8           HA       HIS   8  69.883   6.068   5.683
   65   1HB   HIS   8          2HB       HIS   8  67.209   7.323   6.397
   66   2HB   HIS   8          1HB       HIS   8  68.290   6.550   7.556
   67    HD1  HIS   8           HD1      HIS   8  67.932   9.613   5.421
   68    HD2  HIS   8           HD2      HIS   8  70.655   8.032   8.154
   69    HE1  HIS   8           HE1      HIS   8  69.551  11.479   5.980
   70    H    THR   9           H        THR   9  69.587   3.929   6.238
   71    HA   THR   9           HA       THR   9  66.947   2.633   5.931
   72    HB   THR   9           HB       THR   9  68.104   2.604   3.687
   73    HG1  THR   9           HG1      THR   9  67.055   0.827   3.486
   74   1HG2  THR   9          1HG2      THR   9  70.429   2.459   4.464
   75   2HG2  THR   9          2HG2      THR   9  70.051   1.097   3.408
   76   3HG2  THR   9          3HG2      THR   9  70.108   0.869   5.157
   77    H    THR  10           H        THR  10  67.009   0.388   6.909
   78    HA   THR  10           HA       THR  10  69.213   0.173   8.922
   79    HB   THR  10           HB       THR  10  66.788   0.563   9.670
   80    HG1  THR  10           HG1      THR  10  67.490  -0.302  11.411
   81   1HG2  THR  10          1HG2      THR  10  66.199  -1.532   7.959
   82   2HG2  THR  10          2HG2      THR  10  65.136  -0.920   9.228
   83   3HG2  THR  10          3HG2      THR  10  66.192  -2.300   9.550
   84    H    VAL  11           H        VAL  11  69.969  -2.016   9.403
   85    HA   VAL  11           HA       VAL  11  70.357  -3.562   6.959
   86    HB   VAL  11           HB       VAL  11  71.171  -4.071   9.844
   87   1HG1  VAL  11          1HG1      VAL  11  72.819  -5.049   7.578
   88   2HG1  VAL  11          2HG1      VAL  11  71.276  -5.871   7.800
   89   3HG1  VAL  11          3HG1      VAL  11  72.447  -5.825   9.117
   90   1HG2  VAL  11          1HG2      VAL  11  73.408  -3.221   8.455
   91   2HG2  VAL  11          2HG2      VAL  11  72.422  -2.203   9.504
   92   3HG2  VAL  11          3HG2      VAL  11  72.133  -2.217   7.763
   93    H    HIS  12           H        HIS  12  69.341  -5.413   6.372
   94    HA   HIS  12           HA       HIS  12  67.469  -6.717   8.317
   95   1HB   HIS  12          2HB       HIS  12  67.370  -6.186   5.365
   96   2HB   HIS  12          1HB       HIS  12  66.542  -7.609   6.005
   97    HD1  HIS  12           HD1      HIS  12  66.809  -3.921   7.001
   98    HD2  HIS  12           HD2      HIS  12  63.974  -6.967   6.754
   99    HE1  HIS  12           HE1      HIS  12  64.609  -2.914   7.749
  100    H    ARG  13           H        ARG  13  67.214  -9.119   7.736
  101    HA   ARG  13           HA       ARG  13  69.481 -10.575   8.320
  102   1HB   ARG  13          2HB       ARG  13  67.068 -11.248   6.626
  103   2HB   ARG  13          1HB       ARG  13  68.204 -12.477   7.195
  104   1HG   ARG  13          2HG       ARG  13  67.791 -11.702   9.538
  105   2HG   ARG  13          1HG       ARG  13  66.569 -10.591   8.919
  106   1HD   ARG  13          2HD       ARG  13  65.380 -12.580   7.904
  107   2HD   ARG  13          1HD       ARG  13  66.523 -13.623   8.775
  108    HE   ARG  13           HE       ARG  13  65.257 -11.592  10.465
  109   1HH1  ARG  13          1HH1      ARG  13  65.009 -14.856   9.198
  110   2HH1  ARG  13          2HH1      ARG  13  63.984 -15.377  10.489
  111   1HH2  ARG  13          1HH2      ARG  13  63.932 -12.322  12.103
  112   2HH2  ARG  13          2HH2      ARG  13  63.381 -13.964  12.112
  113    H    ILE  14           H        ILE  14  71.013 -11.810   7.130
  114    HA   ILE  14           HA       ILE  14  72.585 -12.235   5.437
  115    HB   ILE  14           HB       ILE  14  70.407 -11.228   3.576
  116   1HG1  ILE  14          2HG1      ILE  14  70.979 -14.095   4.371
  117   2HG1  ILE  14          1HG1      ILE  14  69.742 -13.120   5.166
  118   1HG2  ILE  14          1HG2      ILE  14  71.689 -13.098   2.179
  119   2HG2  ILE  14          2HG2      ILE  14  73.017 -12.636   3.243
  120   3HG2  ILE  14          3HG2      ILE  14  72.253 -11.427   2.211
  121   1HD1  ILE  14          1HD1      ILE  14  68.433 -14.032   3.509
  122   2HD1  ILE  14          2HD1      ILE  14  69.791 -14.232   2.402
  123   3HD1  ILE  14          3HD1      ILE  14  69.053 -12.643   2.615
  124    H    GLY  15           H        GLY  15  71.755  -9.185   6.386
  125   1HA   GLY  15          2HA       GLY  15  73.006  -7.199   6.216
  126   2HA   GLY  15          1HA       GLY  15  74.066  -8.015   5.071
  127    H    ARG  16           H        ARG  16  70.703  -8.217   4.286
  128    HA   ARG  16           HA       ARG  16  71.173  -6.635   1.863
  129   1HB   ARG  16          2HB       ARG  16  69.999  -8.818   1.901
  130   2HB   ARG  16          1HB       ARG  16  68.755  -8.126   2.941
  131   1HG   ARG  16          2HG       ARG  16  68.084  -6.569   1.205
  132   2HG   ARG  16          1HG       ARG  16  69.423  -7.079   0.176
  133   1HD   ARG  16          2HD       ARG  16  67.380  -8.209  -0.569
  134   2HD   ARG  16          1HD       ARG  16  68.444  -9.411   0.187
  135    HE   ARG  16           HE       ARG  16  66.930  -9.566   1.996
  136   1HH1  ARG  16          1HH2      ARG  16  66.293  -6.798   0.057
  137   2HH1  ARG  16          2HH2      ARG  16  64.819  -6.386   0.868
  138   1HH2  ARG  16          1HH1      ARG  16  64.947  -9.020   3.101
  139   2HH2  ARG  16          2HH1      ARG  16  64.069  -7.631   2.569
  140    H    ILE  17           H        ILE  17  70.192  -4.664   1.370
  141    HA   ILE  17           HA       ILE  17  68.241  -3.528   3.324
  142    HB   ILE  17           HB       ILE  17  69.404  -1.346   3.150
  143   1HG1  ILE  17          2HG1      ILE  17  71.598  -2.815   1.660
  144   2HG1  ILE  17          1HG1      ILE  17  70.359  -1.871   0.837
  145   1HG2  ILE  17          1HG2      ILE  17  71.196  -3.665   3.931
  146   2HG2  ILE  17          2HG2      ILE  17  70.053  -2.822   4.978
  147   3HG2  ILE  17          3HG2      ILE  17  71.482  -1.982   4.377
  148   1HD1  ILE  17          1HD1      ILE  17  72.767  -0.917   1.997
  149   2HD1  ILE  17          2HD1      ILE  17  71.451  -0.300   2.996
  150   3HD1  ILE  17          3HD1      ILE  17  71.478   0.036   1.264
  151    H    ILE  18           H        ILE  18  66.800  -1.920   2.304
  152    HA   ILE  18           HA       ILE  18  66.730  -2.141  -0.691
  153    HB   ILE  18           HB       ILE  18  64.452  -1.721   1.276
  154   1HG1  ILE  18          2HG1      ILE  18  65.379  -3.990   1.490
  155   2HG1  ILE  18          1HG1      ILE  18  63.808  -4.051   0.696
  156   1HG2  ILE  18          1HG2      ILE  18  64.636  -1.937  -1.720
  157   2HG2  ILE  18          2HG2      ILE  18  63.721  -0.788  -0.741
  158   3HG2  ILE  18          3HG2      ILE  18  63.170  -2.458  -0.887
  159   1HD1  ILE  18          1HD1      ILE  18  64.923  -5.347  -0.821
  160   2HD1  ILE  18          2HD1      ILE  18  66.497  -4.684  -0.378
  161   3HD1  ILE  18          3HD1      ILE  18  65.437  -3.789  -1.469
  162    H    ILE  19           H        ILE  19  66.940  -0.224  -1.760
  163    HA   ILE  19           HA       ILE  19  67.037   2.324  -0.275
  164    HB   ILE  19           HB       ILE  19  67.217   1.633  -3.244
  165   1HG1  ILE  19          2HG1      ILE  19  69.304   2.039  -1.058
  166   2HG1  ILE  19          1HG1      ILE  19  68.995   0.560  -1.955
  167   1HG2  ILE  19          1HG2      ILE  19  68.154   4.152  -1.820
  168   2HG2  ILE  19          2HG2      ILE  19  66.578   4.030  -2.603
  169   3HG2  ILE  19          3HG2      ILE  19  68.051   3.870  -3.558
  170   1HD1  ILE  19          1HD1      ILE  19  69.516   2.558  -3.891
  171   2HD1  ILE  19          2HD1      ILE  19  70.554   1.202  -3.443
  172   3HD1  ILE  19          3HD1      ILE  19  70.732   2.758  -2.628
  173    HA   PRO  20           HA       PRO  20  62.728   3.335  -0.963
  174   1HB   PRO  20          2HB       PRO  20  62.933   6.060  -1.170
  175   2HB   PRO  20          1HB       PRO  20  63.006   5.211   0.384
  176   1HG   PRO  20          2HG       PRO  20  65.271   6.113  -1.364
  177   2HG   PRO  20          1HG       PRO  20  65.039   6.382   0.375
  178   1HD   PRO  20          2HD       PRO  20  66.643   4.446  -0.428
  179   2HD   PRO  20          1HD       PRO  20  65.497   4.133   0.903
  180    H    ALA  21           H        ALA  21  61.495   3.645  -2.818
  181    HA   ALA  21           HA       ALA  21  62.679   3.408  -5.380
  182   1HB   ALA  21          1HB       ALA  21  59.960   4.506  -4.583
  183   2HB   ALA  21          2HB       ALA  21  60.356   2.799  -4.777
  184   3HB   ALA  21          3HB       ALA  21  60.379   3.873  -6.175
  185    H    GLY  22           H        GLY  22  61.928   6.269  -3.474
  186   1HA   GLY  22          2HA       GLY  22  61.928   8.199  -5.608
  187   2HA   GLY  22          1HA       GLY  22  62.256   8.561  -3.911
  188    H    THR  23           H        THR  23  64.554   6.984  -3.509
  189    HA   THR  23           HA       THR  23  66.609   8.681  -4.647
  190    HB   THR  23           HB       THR  23  66.788   5.998  -3.235
  191    HG1  THR  23           HG1      THR  23  66.943   7.254  -1.387
  192   1HG2  THR  23          1HG2      THR  23  68.775   7.976  -4.183
  193   2HG2  THR  23          2HG2      THR  23  68.973   6.261  -3.822
  194   3HG2  THR  23          3HG2      THR  23  68.990   7.443  -2.514
  195    H    ARG  24           H        ARG  24  65.480   5.372  -5.361
  196    HA   ARG  24           HA       ARG  24  67.451   4.612  -7.300
  197   1HB   ARG  24          2HB       ARG  24  64.495   4.016  -7.581
  198   2HB   ARG  24          1HB       ARG  24  65.852   3.002  -8.047
  199   1HG   ARG  24          2HG       ARG  24  66.374   3.064  -5.450
  200   2HG   ARG  24          1HG       ARG  24  64.660   3.448  -5.343
  201   1HD   ARG  24          2HD       ARG  24  64.465   1.403  -7.052
  202   2HD   ARG  24          1HD       ARG  24  65.974   0.931  -6.237
  203    HE   ARG  24           HE       ARG  24  64.438   1.617  -4.113
  204   1HH1  ARG  24          1HH1      ARG  24  63.695  -0.402  -6.888
  205   2HH1  ARG  24          2HH1      ARG  24  62.549  -1.344  -6.005
  206   1HH2  ARG  24          1HH2      ARG  24  62.972   0.356  -3.029
  207   2HH2  ARG  24          2HH2      ARG  24  62.143  -0.927  -3.846
  208    H    LYS  25           H        LYS  25  64.431   6.437  -7.634
  209    HA   LYS  25           HA       LYS  25  64.465   6.707 -10.488
  210   1HB   LYS  25          2HB       LYS  25  62.503   6.997  -8.995
  211   2HB   LYS  25          1HB       LYS  25  63.239   8.451  -8.320
  212   1HG   LYS  25          2HG       LYS  25  63.204   9.507 -10.540
  213   2HG   LYS  25          1HG       LYS  25  62.469   8.056 -11.224
  214   1HD   LYS  25          2HD       LYS  25  60.567   8.343  -9.603
  215   2HD   LYS  25          1HD       LYS  25  61.274   9.887  -9.127
  216   1HE   LYS  25          2HE       LYS  25  61.254  10.229 -11.814
  217   2HE   LYS  25          1HE       LYS  25  59.846   9.164 -11.634
  218   1HZ   LYS  25          1HZ       LYS  25  59.336  11.566 -11.312
  219   2HZ   LYS  25          2HZ       LYS  25  60.340  11.554  -9.942
  220   3HZ   LYS  25          3HZ       LYS  25  58.938  10.596  -9.979
  221    H    PHE  26           H        PHE  26  65.412   9.012  -7.925
  222    HA   PHE  26           HA       PHE  26  66.379  11.116  -9.595
  223   1HB   PHE  26          2HB       PHE  26  65.944  11.215  -7.144
  224   2HB   PHE  26          1HB       PHE  26  67.351  10.190  -6.869
  225    HD1  PHE  26           HD1      PHE  26  69.594  11.077  -6.885
  226    HD2  PHE  26           HD2      PHE  26  66.239  13.515  -8.218
  227    HE1  PHE  26           HE1      PHE  26  71.086  13.101  -6.938
  228    HE2  PHE  26           HE2      PHE  26  67.731  15.540  -8.269
  229    HZ   PHE  26           HZ       PHE  26  70.154  15.333  -7.630
  230    H    TYR  27           H        TYR  27  67.950   8.183  -8.409
  231    HA   TYR  27           HA       TYR  27  70.601   8.974  -9.379
  232   1HB   TYR  27          2HB       TYR  27  69.947   7.662  -7.293
  233   2HB   TYR  27          1HB       TYR  27  69.620   6.302  -8.350
  234    HD1  TYR  27           HD1      TYR  27  71.620   5.590 -10.012
  235    HD2  TYR  27           HD2      TYR  27  72.076   8.014  -6.426
  236    HE1  TYR  27           HE1      TYR  27  74.057   4.992  -9.921
  237    HE2  TYR  27           HE2      TYR  27  74.506   7.413  -6.340
  238    HH   TYR  27           HH       TYR  27  75.862   4.912  -7.814
  239    H    GLY  28           H        GLY  28  67.880   7.331 -10.801
  240   1HA   GLY  28          2HA       GLY  28  67.651   6.505 -12.988
  241   2HA   GLY  28          1HA       GLY  28  69.328   6.969 -13.283
  242    H    ILE  29           H        ILE  29  68.118   4.759 -10.769
  243    HA   ILE  29           HA       ILE  29  70.119   2.760 -11.637
  244    HB   ILE  29           HB       ILE  29  68.237   2.897  -9.253
  245   1HG1  ILE  29          2HG1      ILE  29  71.196   3.524  -9.438
  246   2HG1  ILE  29          1HG1      ILE  29  69.924   4.739  -9.465
  247   1HG2  ILE  29          1HG2      ILE  29  69.197   0.985  -8.435
  248   2HG2  ILE  29          2HG2      ILE  29  70.770   1.345  -9.147
  249   3HG2  ILE  29          3HG2      ILE  29  69.491   0.652 -10.140
  250   1HD1  ILE  29          1HD1      ILE  29  69.213   3.298  -7.253
  251   2HD1  ILE  29          2HD1      ILE  29  70.211   4.751  -7.203
  252   3HD1  ILE  29          3HD1      ILE  29  70.972   3.157  -7.198
  253    H    GLU  30           H        GLU  30  69.623   0.910 -12.674
  254    HA   GLU  30           HA       GLU  30  66.812  -0.111 -12.599
  255   1HB   GLU  30          2HB       GLU  30  68.717  -0.006 -14.966
  256   2HB   GLU  30          1HB       GLU  30  67.129  -0.773 -14.980
  257   1HG   GLU  30          2HG       GLU  30  66.093   1.415 -14.403
  258   2HG   GLU  30          1HG       GLU  30  67.685   2.166 -14.477
  259    H    GLN  31           H        GLN  31  66.765  -2.511 -12.930
  260    HA   GLN  31           HA       GLN  31  68.656  -3.941 -11.354
  261   1HB   GLN  31          2HB       GLN  31  66.747  -4.802 -13.549
  262   2HB   GLN  31          1HB       GLN  31  67.574  -5.934 -12.477
  263   1HG   GLN  31          2HG       GLN  31  66.528  -4.917 -10.524
  264   2HG   GLN  31          1HG       GLN  31  65.781  -3.677 -11.532
  265   1HE2  GLN  31          1HE2      GLN  31  63.918  -4.997 -10.149
  266   2HE2  GLN  31          2HE2      GLN  31  63.130  -6.188 -11.066
  267    H    GLY  32           H        GLY  32  70.573  -4.980 -11.850
  268   1HA   GLY  32          2HA       GLY  32  72.168  -6.041 -13.298
  269   2HA   GLY  32          1HA       GLY  32  71.373  -5.302 -14.684
  270    H    ASP  33           H        ASP  33  71.475  -2.656 -12.918
  271    HA   ASP  33           HA       ASP  33  73.984  -1.673 -14.074
  272   1HB   ASP  33          2HB       ASP  33  71.879  -0.513 -12.226
  273   2HB   ASP  33          1HB       ASP  33  73.235   0.417 -12.860
  274    H    PHE  34           H        PHE  34  75.694  -0.665 -12.710
  275    HA   PHE  34           HA       PHE  34  75.972  -2.012 -10.042
  276   1HB   PHE  34          2HB       PHE  34  77.965  -1.061 -12.119
  277   2HB   PHE  34          1HB       PHE  34  78.439  -1.574 -10.500
  278    HD1  PHE  34           HD1      PHE  34  77.105  -2.667 -13.787
  279    HD2  PHE  34           HD2      PHE  34  78.221  -3.935  -9.771
  280    HE1  PHE  34           HE1      PHE  34  77.048  -5.068 -14.531
  281    HE2  PHE  34           HE2      PHE  34  78.163  -6.337 -10.515
  282    HZ   PHE  34           HZ       PHE  34  77.577  -6.904 -12.895
  283    H    VAL  35           H        VAL  35  76.308  -0.671  -8.277
  284    HA   VAL  35           HA       VAL  35  76.893   2.214  -8.807
  285    HB   VAL  35           HB       VAL  35  75.285   2.775  -6.991
  286   1HG1  VAL  35          1HG1      VAL  35  74.568   2.669  -9.396
  287   2HG1  VAL  35          2HG1      VAL  35  73.255   2.355  -8.264
  288   3HG1  VAL  35          3HG1      VAL  35  74.021   1.016  -9.119
  289   1HG2  VAL  35          1HG2      VAL  35  75.326   0.766  -5.659
  290   2HG2  VAL  35          2HG2      VAL  35  74.814  -0.221  -7.029
  291   3HG2  VAL  35          3HG2      VAL  35  73.689   0.927  -6.299
  292    H    GLU  36           H        GLU  36  78.097   3.223  -7.027
  293    HA   GLU  36           HA       GLU  36  79.497   1.217  -5.282
  294   1HB   GLU  36          2HB       GLU  36  80.807   2.259  -7.165
  295   2HB   GLU  36          1HB       GLU  36  80.504   3.841  -6.444
  296   1HG   GLU  36          2HG       GLU  36  81.603   3.056  -4.346
  297   2HG   GLU  36          1HG       GLU  36  81.980   1.532  -5.143
  298    H    ILE  37           H        ILE  37  79.092   1.555  -3.157
  299    HA   ILE  37           HA       ILE  37  78.175   4.271  -2.306
  300    HB   ILE  37           HB       ILE  37  76.337   2.779  -2.999
  301   1HG1  ILE  37          2HG1      ILE  37  76.160   2.781  -0.012
  302   2HG1  ILE  37          1HG1      ILE  37  76.329   4.325  -0.845
  303   1HG2  ILE  37          1HG2      ILE  37  75.887   0.708  -1.711
  304   2HG2  ILE  37          2HG2      ILE  37  77.402   0.935  -0.837
  305   3HG2  ILE  37          3HG2      ILE  37  77.424   0.621  -2.573
  306   1HD1  ILE  37          1HD1      ILE  37  74.385   2.907  -2.320
  307   2HD1  ILE  37          2HD1      ILE  37  74.109   4.270  -1.236
  308   3HD1  ILE  37          3HD1      ILE  37  73.991   2.622  -0.623
  309    H    LYS  38           H        LYS  38  78.222   4.594   0.034
  310    HA   LYS  38           HA       LYS  38  79.917   2.664   1.567
  311   1HB   LYS  38          2HB       LYS  38  81.132   4.707   0.636
  312   2HB   LYS  38          1HB       LYS  38  80.123   5.684   1.710
  313   1HG   LYS  38          2HG       LYS  38  80.940   4.420   3.651
  314   2HG   LYS  38          1HG       LYS  38  81.926   3.414   2.590
  315   1HD   LYS  38          2HD       LYS  38  83.119   5.483   1.828
  316   2HD   LYS  38          1HD       LYS  38  82.206   6.403   3.024
  317   1HE   LYS  38          2HE       LYS  38  83.408   5.548   4.793
  318   2HE   LYS  38          1HE       LYS  38  83.626   3.970   4.011
  319   1HZ   LYS  38          1HZ       LYS  38  84.936   6.499   3.161
  320   2HZ   LYS  38          2HZ       LYS  38  85.152   4.973   2.447
  321   3HZ   LYS  38          3HZ       LYS  38  85.695   5.257   4.031
  322    H    ILE  39           H        ILE  39  79.348   2.484   3.770
  323    HA   ILE  39           HA       ILE  39  76.880   3.978   4.614
  324    HB   ILE  39           HB       ILE  39  76.510   1.978   6.082
  325   1HG1  ILE  39          2HG1      ILE  39  78.709   0.649   4.484
  326   2HG1  ILE  39          1HG1      ILE  39  79.016   1.385   6.058
  327   1HG2  ILE  39          1HG2      ILE  39  75.213   1.654   4.249
  328   2HG2  ILE  39          2HG2      ILE  39  76.373   0.370   3.903
  329   3HG2  ILE  39          3HG2      ILE  39  76.542   1.943   3.124
  330   1HD1  ILE  39          1HD1      ILE  39  77.444  -1.058   5.379
  331   2HD1  ILE  39          2HD1      ILE  39  76.867  -0.068   6.720
  332   3HD1  ILE  39          3HD1      ILE  39  78.495  -0.743   6.760
  333    H    VAL  40           H        VAL  40  76.812   4.752   6.765
  334    HA   VAL  40           HA       VAL  40  79.296   4.524   8.403
  335    HB   VAL  40           HB       VAL  40  77.795   7.082   7.730
  336   1HG1  VAL  40          1HG1      VAL  40  80.473   7.078   9.043
  337   2HG1  VAL  40          2HG1      VAL  40  79.096   6.623  10.045
  338   3HG1  VAL  40          3HG1      VAL  40  79.125   8.195   9.245
  339   1HG2  VAL  40          1HG2      VAL  40  80.321   5.821   6.702
  340   2HG2  VAL  40          2HG2      VAL  40  80.221   7.579   6.798
  341   3HG2  VAL  40          3HG2      VAL  40  79.065   6.683   5.813
  342    H    LYS  41           H        LYS  41  78.701   3.874  10.404
  343    HA   LYS  41           HA       LYS  41  76.121   4.845  11.567
  344   1HB   LYS  41          2HB       LYS  41  75.979   2.482  10.714
  345   2HB   LYS  41          1HB       LYS  41  77.283   2.055  11.822
  346   1HG   LYS  41          2HG       LYS  41  75.865   2.941  13.709
  347   2HG   LYS  41          1HG       LYS  41  74.541   3.111  12.555
  348   1HD   LYS  41          2HD       LYS  41  74.781   0.670  12.014
  349   2HD   LYS  41          1HD       LYS  41  75.966   0.548  13.314
  350   1HE   LYS  41          2HE       LYS  41  73.092   1.480  13.666
  351   2HE   LYS  41          1HE       LYS  41  73.721  -0.116  14.119
  352   1HZ   LYS  41          1HZ       LYS  41  73.870   1.243  16.040
  353   2HZ   LYS  41          2HZ       LYS  41  74.572   2.523  15.173
  354   3HZ   LYS  41          3HZ       LYS  41  75.446   1.090  15.436
  355    H    TYR  42           H        TYR  42  76.301   5.348  13.783
  356    HA   TYR  42           HA       TYR  42  79.098   5.417  14.826
  357   1HB   TYR  42          2HB       TYR  42  77.621   7.473  14.512
  358   2HB   TYR  42          1HB       TYR  42  76.635   6.857  15.841
  359    HD1  TYR  42           HD1      TYR  42  80.169   7.789  14.919
  360    HD2  TYR  42           HD2      TYR  42  77.267   7.232  18.120
  361    HE1  TYR  42           HE1      TYR  42  81.808   8.745  16.568
  362    HE2  TYR  42           HE2      TYR  42  78.905   8.190  19.771
  363    HH   TYR  42           HH       TYR  42  81.193  10.000  19.275
  364    H    GLU  43           H        GLU  43  79.673   4.145  16.544
  365    HA   GLU  43           HA       GLU  43  77.511   3.081  18.328
  366   1HB   GLU  43          2HB       GLU  43  79.893   1.631  17.124
  367   2HB   GLU  43          1HB       GLU  43  78.808   0.938  18.330
  368   1HG   GLU  43          2HG       GLU  43  76.897   1.291  16.785
  369   2HG   GLU  43          1HG       GLU  43  78.011   1.912  15.571
  370    H    GLY  44           H        GLY  44  77.969   3.497  20.451
  371   1HA   GLY  44          2HA       GLY  44  79.143   4.144  22.375
  372   2HA   GLY  44          1HA       GLY  44  80.537   3.318  21.679
  373    H    GLU  45           H        GLU  45  82.223   4.710  21.671
  374    HA   GLU  45           HA       GLU  45  81.736   7.576  20.977
  375   1HB   GLU  45          2HB       GLU  45  83.850   7.982  22.136
  376   2HB   GLU  45          1HB       GLU  45  82.797   7.009  23.158
  377   1HG   GLU  45          2HG       GLU  45  84.007   4.965  22.463
  378   2HG   GLU  45          1HG       GLU  45  85.053   5.935  21.431
  379    H    GLU  46           H        GLU  46  82.308   4.980  19.177
  380    HA   GLU  46           HA       GLU  46  84.380   6.336  17.497
  381   1HB   GLU  46          2HB       GLU  46  85.292   4.086  17.042
  382   2HB   GLU  46          1HB       GLU  46  85.302   4.443  18.767
  383   1HG   GLU  46          2HG       GLU  46  82.795   3.266  18.324
  384   2HG   GLU  46          1HG       GLU  46  83.895   2.329  17.320
  385    HA   PRO  47           HA       PRO  47  81.153   5.621  14.415
  386   1HB   PRO  47          2HB       PRO  47  82.876   6.737  12.377
  387   2HB   PRO  47          1HB       PRO  47  81.446   7.467  13.123
  388   1HG   PRO  47          2HG       PRO  47  84.037   8.334  13.467
  389   2HG   PRO  47          1HG       PRO  47  82.678   8.709  14.535
  390   1HD   PRO  47          2HD       PRO  47  84.891   6.774  14.909
  391   2HD   PRO  47          1HD       PRO  47  83.968   7.698  16.114
  392    H    LYS  48           H        LYS  48  80.869   3.894  13.017
  393    HA   LYS  48           HA       LYS  48  83.293   2.383  12.096
  394   1HB   LYS  48          2HB       LYS  48  80.420   1.498  12.549
  395   2HB   LYS  48          1HB       LYS  48  81.732   0.455  12.000
  396   1HG   LYS  48          2HG       LYS  48  81.784   1.987  14.614
  397   2HG   LYS  48          1HG       LYS  48  81.280   0.301  14.473
  398   1HD   LYS  48          2HD       LYS  48  83.503  -0.196  13.403
  399   2HD   LYS  48          1HD       LYS  48  83.997   1.453  13.789
  400   1HE   LYS  48          2HE       LYS  48  84.797   0.254  15.651
  401   2HE   LYS  48          1HE       LYS  48  83.211   0.801  16.230
  402   1HZ   LYS  48          1HZ       LYS  48  82.227  -1.245  15.613
  403   2HZ   LYS  48          2HZ       LYS  48  83.635  -1.645  16.477
  404   3HZ   LYS  48          3HZ       LYS  48  83.615  -1.755  14.782
  405    H    GLU  49           H        GLU  49  83.516   2.147   9.867
  406    HA   GLU  49           HA       GLU  49  81.252   3.065   8.127
  407   1HB   GLU  49          2HB       GLU  49  84.193   3.806   7.998
  408   2HB   GLU  49          1HB       GLU  49  82.980   4.296   6.814
  409   1HG   GLU  49          2HG       GLU  49  81.699   5.420   8.626
  410   2HG   GLU  49          1HG       GLU  49  82.969   4.985   9.768
  411    H    GLY  50           H        GLY  50  81.476   2.327   5.868
  412   1HA   GLY  50          2HA       GLY  50  83.436   0.244   5.237
  413   2HA   GLY  50          1HA       GLY  50  81.785  -0.351   5.414
  414    H    THR  51           H        THR  51  83.751   0.196   3.029
  415    HA   THR  51           HA       THR  51  81.676   1.517   1.299
  416    HB   THR  51           HB       THR  51  84.637   1.501   0.714
  417    HG1  THR  51           HG1      THR  51  84.979   2.877   2.240
  418   1HG2  THR  51          1HG2      THR  51  82.520   2.327  -0.756
  419   2HG2  THR  51          2HG2      THR  51  84.113   3.079  -0.855
  420   3HG2  THR  51          3HG2      THR  51  82.857   3.805   0.147
  421    H    PHE  52           H        PHE  52  81.111   0.335  -0.539
  422    HA   PHE  52           HA       PHE  52  82.918  -1.738  -1.578
  423   1HB   PHE  52          2HB       PHE  52  81.501  -3.613  -1.084
  424   2HB   PHE  52          1HB       PHE  52  81.656  -2.706   0.414
  425    HD1  PHE  52           HD1      PHE  52  79.377  -4.151  -1.966
  426    HD2  PHE  52           HD2      PHE  52  79.748  -0.944   0.959
  427    HE1  PHE  52           HE1      PHE  52  76.876  -3.949  -1.874
  428    HE2  PHE  52           HE2      PHE  52  77.240  -0.743   1.052
  429    HZ   PHE  52           HZ       PHE  52  75.806  -2.247  -0.373
  430    H    THR  53           H        THR  53  81.777  -2.910  -3.490
  431    HA   THR  53           HA       THR  53  80.047  -0.967  -4.983
  432    HB   THR  53           HB       THR  53  81.785  -3.258  -5.965
  433    HG1  THR  53           HG1      THR  53  83.220  -1.785  -5.412
  434   1HG2  THR  53          1HG2      THR  53  80.111  -2.889  -7.594
  435   2HG2  THR  53          2HG2      THR  53  81.478  -1.925  -8.155
  436   3HG2  THR  53          3HG2      THR  53  80.125  -1.145  -7.334
  437    H    ALA  54           H        ALA  54  78.048  -1.726  -5.736
  438    HA   ALA  54           HA       ALA  54  77.322  -4.568  -5.165
  439   1HB   ALA  54          1HB       ALA  54  75.322  -2.505  -4.482
  440   2HB   ALA  54          2HB       ALA  54  76.783  -2.454  -3.498
  441   3HB   ALA  54          3HB       ALA  54  75.819  -3.929  -3.567
  442    H    ARG  55           H        ARG  55  75.708  -5.404  -6.512
  443    HA   ARG  55           HA       ARG  55  74.993  -3.788  -8.906
  444   1HB   ARG  55          2HB       ARG  55  75.942  -6.167  -8.934
  445   2HB   ARG  55          1HB       ARG  55  74.389  -6.688  -8.281
  446   1HG   ARG  55          2HG       ARG  55  73.266  -5.568 -10.231
  447   2HG   ARG  55          1HG       ARG  55  74.865  -5.260 -10.910
  448   1HD   ARG  55          2HD       ARG  55  75.301  -7.765 -10.756
  449   2HD   ARG  55          1HD       ARG  55  73.576  -7.952 -10.382
  450    HE   ARG  55           HE       ARG  55  74.098  -6.291 -12.737
  451   1HH1  ARG  55          1HH1      ARG  55  73.528  -9.553 -11.573
  452   2HH1  ARG  55          2HH1      ARG  55  72.960 -10.100 -13.110
  453   1HH2  ARG  55          1HH2      ARG  55  73.356  -7.056 -14.696
  454   2HH2  ARG  55          2HH2      ARG  55  72.863  -8.709 -14.857
  455    H    VAL  56           H        VAL  56  72.818  -3.335  -9.405
  456    HA   VAL  56           HA       VAL  56  70.937  -3.247  -7.164
  457    HB   VAL  56           HB       VAL  56  70.756  -2.518 -10.107
  458   1HG1  VAL  56          1HG1      VAL  56  68.906  -0.967  -8.754
  459   2HG1  VAL  56          2HG1      VAL  56  68.740  -2.531  -7.954
  460   3HG1  VAL  56          3HG1      VAL  56  68.525  -2.404  -9.702
  461   1HG2  VAL  56          1HG2      VAL  56  71.555  -0.446  -9.522
  462   2HG2  VAL  56          2HG2      VAL  56  72.330  -1.374  -8.238
  463   3HG2  VAL  56          3HG2      VAL  56  70.829  -0.506  -7.916
  464    H    GLY  57           H        GLY  57  69.553  -4.841  -6.675
  465   1HA   GLY  57          2HA       GLY  57  68.966  -6.940  -8.711
  466   2HA   GLY  57          1HA       GLY  57  68.821  -7.162  -6.968
  467    H    GLU  58           H        GLU  58  66.650  -7.958  -7.676
  468    HA   GLU  58           HA       GLU  58  64.630  -6.279  -8.792
  469   1HB   GLU  58          2HB       GLU  58  64.591  -8.773  -8.494
  470   2HB   GLU  58          1HB       GLU  58  64.349  -8.522  -6.766
  471   1HG   GLU  58          2HG       GLU  58  62.282  -7.235  -7.266
  472   2HG   GLU  58          1HG       GLU  58  62.507  -7.571  -8.979
  473    H    GLN  59           H        GLN  59  62.943  -5.098  -7.741
  474    HA   GLN  59           HA       GLN  59  62.104  -3.543  -6.188
  475   1HB   GLN  59          2HB       GLN  59  63.117  -5.835  -4.505
  476   2HB   GLN  59          1HB       GLN  59  62.285  -4.459  -3.782
  477   1HG   GLN  59          2HG       GLN  59  60.335  -4.847  -5.209
  478   2HG   GLN  59          1HG       GLN  59  61.165  -6.176  -6.014
  479   1HE2  GLN  59          1HE2      GLN  59  61.194  -8.221  -4.967
  480   2HE2  GLN  59          2HE2      GLN  59  60.456  -8.510  -3.467
  481    H    GLY  60           H        GLY  60  65.170  -3.461  -6.929
  482   1HA   GLY  60          2HA       GLY  60  66.758  -1.784  -6.506
  483   2HA   GLY  60          1HA       GLY  60  65.597  -1.073  -5.388
  484    H    SER  61           H        SER  61  66.514  -4.375  -4.815
  485    HA   SER  61           HA       SER  61  67.542  -3.666  -2.184
  486   1HB   SER  61          2HB       SER  61  67.559  -6.048  -1.872
  487   2HB   SER  61          1HB       SER  61  66.167  -5.702  -2.895
  488    HG   SER  61           HG       SER  61  67.135  -6.639  -4.537
  489    H    VAL  62           H        VAL  62  69.677  -3.916  -1.440
  490    HA   VAL  62           HA       VAL  62  71.791  -4.677  -3.395
  491    HB   VAL  62           HB       VAL  62  71.558  -2.219  -3.422
  492   1HG1  VAL  62          1HG1      VAL  62  72.061  -2.440  -0.439
  493   2HG1  VAL  62          2HG1      VAL  62  70.566  -1.903  -1.205
  494   3HG1  VAL  62          3HG1      VAL  62  72.031  -0.930  -1.348
  495   1HG2  VAL  62          1HG2      VAL  62  73.827  -1.787  -3.295
  496   2HG2  VAL  62          2HG2      VAL  62  73.860  -3.550  -3.278
  497   3HG2  VAL  62          3HG2      VAL  62  74.013  -2.651  -1.768
  498    H    ILE  63           H        ILE  63  73.575  -5.717  -2.375
  499    HA   ILE  63           HA       ILE  63  73.085  -6.458   0.485
  500    HB   ILE  63           HB       ILE  63  74.647  -7.851  -1.719
  501   1HG1  ILE  63          2HG1      ILE  63  72.246  -7.749  -2.266
  502   2HG1  ILE  63          1HG1      ILE  63  72.705  -9.393  -1.834
  503   1HG2  ILE  63          1HG2      ILE  63  75.503  -8.815   0.189
  504   2HG2  ILE  63          2HG2      ILE  63  74.057  -9.808   0.000
  505   3HG2  ILE  63          3HG2      ILE  63  74.062  -8.465   1.142
  506   1HD1  ILE  63          1HD1      ILE  63  71.384  -7.393   0.026
  507   2HD1  ILE  63          2HD1      ILE  63  71.834  -9.044   0.449
  508   3HD1  ILE  63          3HD1      ILE  63  70.577  -8.752  -0.753
  509    H    ILE  64           H        ILE  64  74.500  -5.652   1.955
  510    HA   ILE  64           HA       ILE  64  77.117  -4.512   1.204
  511    HB   ILE  64           HB       ILE  64  75.749  -5.073   3.864
  512   1HG1  ILE  64          2HG1      ILE  64  76.096  -2.376   2.567
  513   2HG1  ILE  64          1HG1      ILE  64  74.736  -3.405   2.121
  514   1HG2  ILE  64          1HG2      ILE  64  78.251  -4.842   3.978
  515   2HG2  ILE  64          2HG2      ILE  64  77.386  -3.571   4.842
  516   3HG2  ILE  64          3HG2      ILE  64  78.089  -3.239   3.259
  517   1HD1  ILE  64          1HD1      ILE  64  74.480  -3.616   4.760
  518   2HD1  ILE  64          2HD1      ILE  64  73.788  -2.249   3.888
  519   3HD1  ILE  64          3HD1      ILE  64  75.327  -2.069   4.731
  520    HA   PRO  65           HA       PRO  65  79.287  -8.381   1.574
  521   1HB   PRO  65          2HB       PRO  65  81.752  -7.499   2.367
  522   2HB   PRO  65          1HB       PRO  65  81.151  -7.296   0.706
  523   1HG   PRO  65          2HG       PRO  65  81.049  -5.350   2.984
  524   2HG   PRO  65          1HG       PRO  65  81.643  -5.092   1.332
  525   1HD   PRO  65          2HD       PRO  65  79.210  -4.294   1.982
  526   2HD   PRO  65          1HD       PRO  65  79.478  -5.118   0.424
  527    H    LYS  66           H        LYS  66  79.319  -9.858   3.228
  528    HA   LYS  66           HA       LYS  66  78.537  -9.305   5.889
  529   1HB   LYS  66          2HB       LYS  66  78.497 -11.502   4.690
  530   2HB   LYS  66          1HB       LYS  66  80.249 -11.595   4.870
  531   1HG   LYS  66          2HG       LYS  66  79.987 -11.465   7.335
  532   2HG   LYS  66          1HG       LYS  66  78.235 -11.443   7.132
  533   1HD   LYS  66          2HD       LYS  66  78.411 -13.638   5.924
  534   2HD   LYS  66          1HD       LYS  66  80.126 -13.673   6.332
  535   1HE   LYS  66          2HE       LYS  66  79.271 -13.290   8.795
  536   2HE   LYS  66          1HE       LYS  66  77.748 -13.940   8.154
  537   1HZ   LYS  66          1HZ       LYS  66  80.405 -15.214   7.777
  538   2HZ   LYS  66          2HZ       LYS  66  78.899 -15.846   7.309
  539   3HZ   LYS  66          3HZ       LYS  66  79.283 -15.689   8.957
  540    H    ALA  67           H        ALA  67  81.769  -9.451   4.470
  541    HA   ALA  67           HA       ALA  67  83.353  -9.544   6.830
  542   1HB   ALA  67          1HB       ALA  67  83.992  -7.968   4.325
  543   2HB   ALA  67          2HB       ALA  67  84.002  -9.731   4.356
  544   3HB   ALA  67          3HB       ALA  67  85.117  -8.825   5.379
  545    H    LEU  68           H        LEU  68  81.871  -6.785   5.160
  546    HA   LEU  68           HA       LEU  68  83.045  -4.790   6.945
  547   1HB   LEU  68          2HB       LEU  68  80.826  -4.756   4.880
  548   2HB   LEU  68          1HB       LEU  68  81.374  -3.314   5.731
  549    HG   LEU  68           HG       LEU  68  83.109  -5.106   3.995
  550   1HD1  LEU  68          1HD1      LEU  68  82.595  -2.222   3.413
  551   2HD1  LEU  68          2HD1      LEU  68  81.299  -3.365   3.061
  552   3HD1  LEU  68          3HD1      LEU  68  82.877  -3.559   2.298
  553   1HD2  LEU  68          1HD2      LEU  68  84.500  -4.169   5.711
  554   2HD2  LEU  68          2HD2      LEU  68  83.690  -2.605   5.607
  555   3HD2  LEU  68          3HD2      LEU  68  84.732  -3.148   4.292
  556    H    ARG  69           H        ARG  69  79.994  -6.613   6.806
  557    HA   ARG  69           HA       ARG  69  78.446  -5.130   8.692
  558   1HB   ARG  69          2HB       ARG  69  78.653  -8.147   8.362
  559   2HB   ARG  69          1HB       ARG  69  77.289  -7.275   9.046
  560   1HG   ARG  69          2HG       ARG  69  77.034  -6.121   6.800
  561   2HG   ARG  69          1HG       ARG  69  78.225  -7.263   6.170
  562   1HD   ARG  69          2HD       ARG  69  76.639  -9.040   7.378
  563   2HD   ARG  69          1HD       ARG  69  75.425  -7.781   7.092
  564    HE   ARG  69           HE       ARG  69  76.658  -7.900   4.663
  565   1HH1  ARG  69          1HH1      ARG  69  75.378 -10.427   6.742
  566   2HH1  ARG  69          2HH1      ARG  69  75.077 -11.491   5.416
  567   1HH2  ARG  69          1HH2      ARG  69  76.236  -9.320   2.997
  568   2HH2  ARG  69          2HH2      ARG  69  75.553 -10.876   3.325
  569    H    ASP  70           H        ASP  70  80.759  -7.789   9.180
  570    HA   ASP  70           HA       ASP  70  80.420  -7.970  12.029
  571   1HB   ASP  70          2HB       ASP  70  82.670  -8.810  10.171
  572   2HB   ASP  70          1HB       ASP  70  82.497  -9.359  11.837
  573    H    VAL  71           H        VAL  71  82.979  -6.440  10.044
  574    HA   VAL  71           HA       VAL  71  84.605  -5.505  12.197
  575    HB   VAL  71           HB       VAL  71  84.080  -4.419   9.405
  576   1HG1  VAL  71          1HG1      VAL  71  85.167  -2.713  10.802
  577   2HG1  VAL  71          2HG1      VAL  71  86.302  -3.347   9.610
  578   3HG1  VAL  71          3HG1      VAL  71  86.398  -3.879  11.289
  579   1HG2  VAL  71          1HG2      VAL  71  84.871  -6.750   9.478
  580   2HG2  VAL  71          2HG2      VAL  71  86.218  -6.268  10.509
  581   3HG2  VAL  71          3HG2      VAL  71  86.130  -5.689   8.845
  582    H    ILE  72           H        ILE  72  81.813  -4.033  10.588
  583    HA   ILE  72           HA       ILE  72  82.033  -1.520  12.062
  584    HB   ILE  72           HB       ILE  72  79.869  -2.693  10.275
  585   1HG1  ILE  72          2HG1      ILE  72  82.092  -0.728   9.626
  586   2HG1  ILE  72          1HG1      ILE  72  82.149  -2.449   9.242
  587   1HG2  ILE  72          1HG2      ILE  72  79.466  -0.596  11.898
  588   2HG2  ILE  72          2HG2      ILE  72  78.827  -0.625  10.258
  589   3HG2  ILE  72          3HG2      ILE  72  80.319   0.246  10.609
  590   1HD1  ILE  72          1HD1      ILE  72  79.809  -1.964   8.116
  591   2HD1  ILE  72          2HD1      ILE  72  81.302  -1.587   7.254
  592   3HD1  ILE  72          3HD1      ILE  72  80.410  -0.303   8.073
  593    H    GLY  73           H        GLY  73  80.507  -4.601  12.679
  594   1HA   GLY  73          2HA       GLY  73  79.434  -5.297  14.656
  595   2HA   GLY  73          1HA       GLY  73  79.637  -3.660  15.282
  596    H    ILE  74           H        ILE  74  78.006  -4.483  12.253
  597    HA   ILE  74           HA       ILE  74  75.683  -2.895  13.118
  598    HB   ILE  74           HB       ILE  74  76.318  -4.333  10.519
  599   1HG1  ILE  74          2HG1      ILE  74  78.062  -2.690  11.098
  600   2HG1  ILE  74          1HG1      ILE  74  77.105  -2.117   9.736
  601   1HG2  ILE  74          1HG2      ILE  74  74.785  -2.290   9.761
  602   2HG2  ILE  74          2HG2      ILE  74  74.164  -2.460  11.403
  603   3HG2  ILE  74          3HG2      ILE  74  74.081  -3.820  10.282
  604   1HD1  ILE  74          1HD1      ILE  74  76.897  -0.201  10.939
  605   2HD1  ILE  74          2HD1      ILE  74  77.383  -0.988  12.441
  606   3HD1  ILE  74          3HD1      ILE  74  75.712  -1.101  11.888
  607    H    LYS  75           H        LYS  75  73.600  -3.679  13.425
  608    HA   LYS  75           HA       LYS  75  73.211  -6.657  13.327
  609   1HB   LYS  75          2HB       LYS  75  72.669  -4.578  15.442
  610   2HB   LYS  75          1HB       LYS  75  71.770  -6.095  15.427
  611   1HG   LYS  75          2HG       LYS  75  73.594  -7.342  16.027
  612   2HG   LYS  75          1HG       LYS  75  74.717  -6.323  15.126
  613   1HD   LYS  75          2HD       LYS  75  74.173  -4.527  16.932
  614   2HD   LYS  75          1HD       LYS  75  73.575  -5.890  17.879
  615   1HE   LYS  75          2HE       LYS  75  75.680  -6.704  18.260
  616   2HE   LYS  75          1HE       LYS  75  76.231  -6.305  16.620
  617   1HZ   LYS  75          1HZ       LYS  75  77.198  -4.878  18.417
  618   2HZ   LYS  75          2HZ       LYS  75  75.639  -4.257  18.684
  619   3HZ   LYS  75          3HZ       LYS  75  76.404  -4.024  17.185
  620    HA   PRO  76           HA       PRO  76  69.432  -5.992  11.098
  621   1HB   PRO  76          2HB       PRO  76  68.008  -7.677  13.080
  622   2HB   PRO  76          1HB       PRO  76  68.165  -7.890  11.327
  623   1HG   PRO  76          2HG       PRO  76  69.488  -9.415  13.107
  624   2HG   PRO  76          1HG       PRO  76  70.128  -9.026  11.504
  625   1HD   PRO  76          2HD       PRO  76  70.952  -8.004  14.155
  626   2HD   PRO  76          1HD       PRO  76  71.890  -8.174  12.657
  627    H    GLY  77           H        GLY  77  67.947  -4.345  11.213
  628   1HA   GLY  77          2HA       GLY  77  66.159  -3.095  12.174
  629   2HA   GLY  77          1HA       GLY  77  66.562  -3.770  13.748
  630    H    GLU  78           H        GLU  78  69.460  -2.698  12.469
  631    HA   GLU  78           HA       GLU  78  69.300  -0.183  14.050
  632   1HB   GLU  78          2HB       GLU  78  71.392  -2.123  13.192
  633   2HB   GLU  78          1HB       GLU  78  71.895  -0.446  13.407
  634   1HG   GLU  78          2HG       GLU  78  70.831  -0.469  15.673
  635   2HG   GLU  78          1HG       GLU  78  70.501  -2.188  15.459
  636    H    VAL  79           H        VAL  79  69.407   1.793  13.082
  637    HA   VAL  79           HA       VAL  79  69.283   1.865  10.138
  638    HB   VAL  79           HB       VAL  79  67.629   2.986  11.587
  639   1HG1  VAL  79          1HG1      VAL  79  69.874   3.728  13.101
  640   2HG1  VAL  79          2HG1      VAL  79  68.211   4.245  13.367
  641   3HG1  VAL  79          3HG1      VAL  79  69.296   5.239  12.398
  642   1HG2  VAL  79          1HG2      VAL  79  69.197   5.193  10.274
  643   2HG2  VAL  79          2HG2      VAL  79  67.455   4.924  10.284
  644   3HG2  VAL  79          3HG2      VAL  79  68.498   3.906   9.291
  645    H    ILE  80           H        ILE  80  70.864   2.609   8.845
  646    HA   ILE  80           HA       ILE  80  73.161   4.123  10.028
  647    HB   ILE  80           HB       ILE  80  74.554   2.960   8.319
  648   1HG1  ILE  80          2HG1      ILE  80  72.029   1.386   7.716
  649   2HG1  ILE  80          1HG1      ILE  80  72.696   2.650   6.678
  650   1HG2  ILE  80          1HG2      ILE  80  73.982   1.987  10.657
  651   2HG2  ILE  80          2HG2      ILE  80  74.697   0.903   9.464
  652   3HG2  ILE  80          3HG2      ILE  80  72.962   0.851   9.775
  653   1HD1  ILE  80          1HD1      ILE  80  74.588   1.385   6.129
  654   2HD1  ILE  80          2HD1      ILE  80  73.329   0.151   6.201
  655   3HD1  ILE  80          3HD1      ILE  80  74.438   0.360   7.557
  656    H    GLU  81           H        GLU  81  74.112   5.663   8.491
  657    HA   GLU  81           HA       GLU  81  72.147   6.780   6.545
  658   1HB   GLU  81          2HB       GLU  81  73.144   8.202   8.348
  659   2HB   GLU  81          1HB       GLU  81  74.745   7.874   7.686
  660   1HG   GLU  81          2HG       GLU  81  74.007   8.858   5.515
  661   2HG   GLU  81          1HG       GLU  81  72.465   9.276   6.263
  662    H    VAL  82           H        VAL  82  72.541   6.541   4.401
  663    HA   VAL  82           HA       VAL  82  75.074   5.178   3.607
  664    HB   VAL  82           HB       VAL  82  72.249   5.140   2.485
  665   1HG1  VAL  82          1HG1      VAL  82  73.771   4.697   0.684
  666   2HG1  VAL  82          2HG1      VAL  82  73.151   3.134   1.219
  667   3HG1  VAL  82          3HG1      VAL  82  74.767   3.654   1.700
  668   1HG2  VAL  82          1HG2      VAL  82  73.828   3.334   4.308
  669   2HG2  VAL  82          2HG2      VAL  82  72.524   2.681   3.315
  670   3HG2  VAL  82          3HG2      VAL  82  72.182   3.936   4.508
  671    H    LEU  83           H        LEU  83  76.355   6.163   2.145
  672    HA   LEU  83           HA       LEU  83  75.304   8.525   0.611
  673   1HB   LEU  83          2HB       LEU  83  78.175   7.870   1.389
  674   2HB   LEU  83          1HB       LEU  83  77.569   9.401   0.772
  675    HG   LEU  83           HG       LEU  83  76.849   8.167   3.449
  676   1HD1  LEU  83          1HD1      LEU  83  78.455  10.663   2.846
  677   2HD1  LEU  83          2HD1      LEU  83  79.186   9.092   3.185
  678   3HD1  LEU  83          3HD1      LEU  83  78.214   9.898   4.418
  679   1HD2  LEU  83          1HD2      LEU  83  75.777  10.401   3.834
  680   2HD2  LEU  83          2HD2      LEU  83  74.995   9.456   2.566
  681   3HD2  LEU  83          3HD2      LEU  83  76.069  10.788   2.137
  682    H    LEU  84           H        LEU  84  75.389   8.274  -1.626
  683    HA   LEU  84           HA       LEU  84  76.652   5.889  -2.828
  684   1HB   LEU  84          2HB       LEU  84  74.953   8.199  -3.699
  685   2HB   LEU  84          1HB       LEU  84  75.869   7.308  -4.921
  686    HG   LEU  84           HG       LEU  84  74.342   5.709  -2.918
  687   1HD1  LEU  84          1HD1      LEU  84  72.507   6.006  -4.959
  688   2HD1  LEU  84          2HD1      LEU  84  73.122   7.648  -4.774
  689   3HD1  LEU  84          3HD1      LEU  84  72.412   6.813  -3.394
  690   1HD2  LEU  84          1HD2      LEU  84  75.411   4.316  -4.417
  691   2HD2  LEU  84          2HD2      LEU  84  75.364   5.508  -5.718
  692   3HD2  LEU  84          3HD2      LEU  84  73.917   4.580  -5.316
  693    H    LEU  85           H        LEU  85  78.576   5.924  -4.000
  694    HA   LEU  85           HA       LEU  85  80.180   8.439  -3.807
  695   1HB   LEU  85          2HB       LEU  85  80.687   5.512  -3.533
  696   2HB   LEU  85          1HB       LEU  85  82.000   6.498  -4.180
  697    HG   LEU  85           HG       LEU  85  80.515   7.316  -1.683
  698   1HD1  LEU  85          1HD1      LEU  85  83.046   5.650  -1.774
  699   2HD1  LEU  85          2HD1      LEU  85  81.448   4.980  -1.445
  700   3HD1  LEU  85          3HD1      LEU  85  82.154   6.157  -0.339
  701   1HD2  LEU  85          1HD2      LEU  85  82.892   8.304  -1.303
  702   2HD2  LEU  85          2HD2      LEU  85  81.858   9.078  -2.505
  703   3HD2  LEU  85          3HD2      LEU  85  83.140   7.981  -3.019
  704    H    GLY  86           H        GLY  86  79.157   5.843  -6.009
  705   1HA   GLY  86          2HA       GLY  86  79.685   7.510  -8.350
  706   2HA   GLY  86          1HA       GLY  86  80.882   6.234  -8.172
  707    H    HIS  87           H        HIS  87  79.658   5.904 -10.415
  708    HA   HIS  87           HA       HIS  87  77.769   3.645  -9.988
  709   1HB   HIS  87          2HB       HIS  87  76.190   4.664 -11.628
  710   2HB   HIS  87          1HB       HIS  87  76.385   5.666 -10.197
  711    HD1  HIS  87           HD1      HIS  87  76.933   5.637 -13.863
  712    HD2  HIS  87           HD2      HIS  87  78.012   8.039 -10.632
  713    HE1  HIS  87           HE1      HIS  87  77.786   7.812 -14.841
  714    H    TYR  88           H        TYR  88  77.732   2.171 -11.789
  715    HA   TYR  88           HA       TYR  88  79.530   2.812 -14.089
  716   1HB   TYR  88          2HB       TYR  88  79.426   0.263 -12.440
  717   2HB   TYR  88          1HB       TYR  88  80.370   0.463 -13.917
  718    HD1  TYR  88           HD1      TYR  88  80.050   1.409 -10.338
  719    HD2  TYR  88           HD2      TYR  88  82.366   1.933 -13.992
  720    HE1  TYR  88           HE1      TYR  88  81.913   2.453  -9.008
  721    HE2  TYR  88           HE2      TYR  88  84.227   2.976 -12.662
  722    HH   TYR  88           HH       TYR  88  84.972   2.759 -10.028
  723    H    LYS  89           H        LYS  89  78.666   2.154 -16.057
  724    HA   LYS  89           HA       LYS  89  76.101   0.591 -15.972
  725   1HB   LYS  89          2HB       LYS  89  75.990   3.078 -16.447
  726   2HB   LYS  89          1HB       LYS  89  76.918   2.771 -17.915
  727   1HG   LYS  89          2HG       LYS  89  75.178   1.263 -18.740
  728   2HG   LYS  89          1HG       LYS  89  74.262   1.470 -17.247
  729   1HD   LYS  89          2HD       LYS  89  75.029   3.911 -18.804
  730   2HD   LYS  89          1HD       LYS  89  73.688   2.923 -19.387
  731   1HE   LYS  89          2HE       LYS  89  72.714   3.062 -17.029
  732   2HE   LYS  89          1HE       LYS  89  73.931   4.314 -16.704
  733   1HZ   LYS  89          1HZ       LYS  89  72.112   4.365 -19.050
  734   2HZ   LYS  89          2HZ       LYS  89  73.142   5.606 -18.515
  735   3HZ   LYS  89          3HZ       LYS  89  71.777   5.177 -17.599
  736    HA   PRO  90           HA       PRO  90  77.953  -2.352 -18.765
  737   1HB   PRO  90          2HB       PRO  90  75.319  -2.168 -20.194
  738   2HB   PRO  90          1HB       PRO  90  76.199  -3.610 -19.637
  739   1HG   PRO  90          2HG       PRO  90  74.125  -2.814 -18.273
  740   2HG   PRO  90          1HG       PRO  90  75.608  -3.251 -17.401
  741   1HD   PRO  90          2HD       PRO  90  74.562  -0.519 -18.074
  742   2HD   PRO  90          1HD       PRO  90  75.235  -1.120 -16.538
  743    H    ARG  91           H        ARG  91  78.947  -2.308 -20.836
  744    HA   ARG  91           HA       ARG  91  78.408   0.127 -22.510
  745   1HB   ARG  91          2HB       ARG  91  80.538   0.115 -21.187
  746   2HB   ARG  91          1HB       ARG  91  81.017  -1.354 -22.038
  747   1HG   ARG  91          2HG       ARG  91  80.846  -0.138 -24.196
  748   2HG   ARG  91          1HG       ARG  91  80.431   1.333 -23.317
  749   1HD   ARG  91          2HD       ARG  91  82.613   1.173 -22.093
  750   2HD   ARG  91          1HD       ARG  91  83.039  -0.215 -23.115
  751    HE   ARG  91           HE       ARG  91  83.325   1.262 -24.939
  752   1HH1  ARG  91          1HH2      ARG  91  81.639   2.775 -22.352
  753   2HH1  ARG  91          2HH2      ARG  91  81.665   4.354 -23.064
  754   1HH2  ARG  91          1HH1      ARG  91  83.367   3.386 -25.911
  755   2HH2  ARG  91          2HH1      ARG  91  82.631   4.692 -25.051
  756    H    ASN  92           H        ASN  92  78.216  -0.225 -24.725
  757    HA   ASN  92           HA       ASN  92  78.512  -3.054 -25.693
  758   1HB   ASN  92          2HB       ASN  92  76.176  -2.019 -25.326
  759   2HB   ASN  92          1HB       ASN  92  76.548  -0.992 -26.711
  760   1HD2  ASN  92          1HD2      ASN  92  74.790  -2.118 -27.919
  761   2HD2  ASN  92          2HD2      ASN  92  75.067  -3.663 -28.566
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  85.373  14.731  -0.505
    2   2H    MET   1          2H        MET   1  83.850  15.390  -0.137
    3   3H    MET   1          3H        MET   1  84.484  15.531  -1.708
    4    HA   MET   1           HA       MET   1  84.422  13.048  -1.879
    5   1HB   MET   1          2HB       MET   1  84.464  12.864   0.633
    6   2HB   MET   1          1HB       MET   1  82.791  13.425   0.652
    7   1HG   MET   1          2HG       MET   1  82.200  11.509  -0.862
    8   2HG   MET   1          1HG       MET   1  83.847  10.910  -0.668
    9   1HE   MET   1          1HE       MET   1  84.265  11.513   2.846
   10   2HE   MET   1          2HE       MET   1  84.972  10.858   1.371
   11   3HE   MET   1          3HE       MET   1  84.394   9.763   2.625
   12    H    ASP   2           H        ASP   2  83.203  13.410  -3.723
   13    HA   ASP   2           HA       ASP   2  80.641  14.827  -3.694
   14   1HB   ASP   2          2HB       ASP   2  82.096  13.137  -5.757
   15   2HB   ASP   2          1HB       ASP   2  80.657  14.098  -6.096
   16    H    VAL   3           H        VAL   3  78.586  13.883  -3.710
   17    HA   VAL   3           HA       VAL   3  78.454  10.909  -3.617
   18    HB   VAL   3           HB       VAL   3  78.288  12.225  -1.415
   19   1HG1  VAL   3          1HG1      VAL   3  75.466  12.790  -2.343
   20   2HG1  VAL   3          2HG1      VAL   3  76.750  14.003  -2.396
   21   3HG1  VAL   3          3HG1      VAL   3  76.242  13.325  -0.848
   22   1HG2  VAL   3          1HG2      VAL   3  77.616   9.953  -1.395
   23   2HG2  VAL   3          2HG2      VAL   3  76.181  10.285  -2.366
   24   3HG2  VAL   3          3HG2      VAL   3  76.255  10.825  -0.688
   25    H    LEU   4           H        LEU   4  76.782  10.009  -4.824
   26    HA   LEU   4           HA       LEU   4  75.444  11.810  -6.731
   27   1HB   LEU   4          2HB       LEU   4  75.329   8.788  -6.456
   28   2HB   LEU   4          1HB       LEU   4  74.928   9.730  -7.888
   29    HG   LEU   4           HG       LEU   4  77.675   9.403  -6.629
   30   1HD1  LEU   4          1HD1      LEU   4  77.234   7.507  -7.950
   31   2HD1  LEU   4          2HD1      LEU   4  78.114   8.575  -9.044
   32   3HD1  LEU   4          3HD1      LEU   4  76.359   8.443  -9.163
   33   1HD2  LEU   4          1HD2      LEU   4  78.292  10.714  -8.843
   34   2HD2  LEU   4          2HD2      LEU   4  77.812  11.609  -7.397
   35   3HD2  LEU   4          3HD2      LEU   4  76.646  11.334  -8.696
   36    H    ALA   5           H        ALA   5  74.623  10.188  -3.763
   37    HA   ALA   5           HA       ALA   5  72.040  11.462  -3.653
   38   1HB   ALA   5          1HB       ALA   5  72.017   9.262  -5.246
   39   2HB   ALA   5          2HB       ALA   5  70.619   9.770  -4.297
   40   3HB   ALA   5          3HB       ALA   5  71.689   8.508  -3.686
   41    H    LYS   6           H        LYS   6  71.012  11.069  -1.561
   42    HA   LYS   6           HA       LYS   6  72.667   9.511   0.398
   43   1HB   LYS   6          2HB       LYS   6  73.199  11.935   0.445
   44   2HB   LYS   6          1HB       LYS   6  71.494  12.298   0.709
   45   1HG   LYS   6          2HG       LYS   6  71.606  10.864   2.791
   46   2HG   LYS   6          1HG       LYS   6  73.352  10.790   2.564
   47   1HD   LYS   6          2HD       LYS   6  71.783  13.372   2.790
   48   2HD   LYS   6          1HD       LYS   6  72.629  12.609   4.136
   49   1HE   LYS   6          2HE       LYS   6  74.735  12.680   2.663
   50   2HE   LYS   6          1HE       LYS   6  73.825  13.790   1.618
   51   1HZ   LYS   6          1HZ       LYS   6  73.371  15.188   3.517
   52   2HZ   LYS   6          2HZ       LYS   6  75.050  14.976   3.365
   53   3HZ   LYS   6          3HZ       LYS   6  74.186  14.119   4.551
   54    H    PHE   7           H        PHE   7  71.369   8.098   1.524
   55    HA   PHE   7           HA       PHE   7  68.605   8.907   2.237
   56   1HB   PHE   7          2HB       PHE   7  67.666   6.879   1.199
   57   2HB   PHE   7          1HB       PHE   7  68.497   7.866   0.001
   58    HD1  PHE   7           HD1      PHE   7  68.225   4.583   1.469
   59    HD2  PHE   7           HD2      PHE   7  71.009   7.277  -0.524
   60    HE1  PHE   7           HE1      PHE   7  69.687   2.627   0.862
   61    HE2  PHE   7           HE2      PHE   7  72.471   5.321  -1.123
   62    HZ   PHE   7           HZ       PHE   7  71.809   2.992  -0.424
   63    H    HIS   8           H        HIS   8  67.647   7.410   3.853
   64    HA   HIS   8           HA       HIS   8  69.782   6.162   5.558
   65   1HB   HIS   8          2HB       HIS   8  67.044   7.336   6.172
   66   2HB   HIS   8          1HB       HIS   8  68.148   6.675   7.378
   67    HD1  HIS   8           HD1      HIS   8  70.361   8.008   7.835
   68    HD2  HIS   8           HD2      HIS   8  67.736   9.903   5.209
   69    HE1  HIS   8           HE1      HIS   8  71.166  10.399   7.620
   70    H    THR   9           H        THR   9  69.553   4.025   6.157
   71    HA   THR   9           HA       THR   9  66.950   2.651   5.910
   72    HB   THR   9           HB       THR   9  68.065   2.591   3.651
   73    HG1  THR   9           HG1      THR   9  66.947   0.838   3.627
   74   1HG2  THR   9          1HG2      THR   9  70.056   1.160   3.365
   75   2HG2  THR   9          2HG2      THR   9  70.142   0.935   5.113
   76   3HG2  THR   9          3HG2      THR   9  70.409   2.534   4.415
   77    H    THR  10           H        THR  10  67.079   0.437   6.932
   78    HA   THR  10           HA       THR  10  69.329   0.291   8.902
   79    HB   THR  10           HB       THR  10  66.940   0.697   9.723
   80    HG1  THR  10           HG1      THR  10  67.693  -0.161  11.446
   81   1HG2  THR  10          1HG2      THR  10  66.297  -2.155   9.633
   82   2HG2  THR  10          2HG2      THR  10  66.281  -1.398   8.036
   83   3HG2  THR  10          3HG2      THR  10  65.256  -0.762   9.325
   84    H    VAL  11           H        VAL  11  70.071  -1.903   9.434
   85    HA   VAL  11           HA       VAL  11  70.427  -3.504   7.024
   86    HB   VAL  11           HB       VAL  11  71.237  -3.970   9.917
   87   1HG1  VAL  11          1HG1      VAL  11  72.804  -5.565   9.097
   88   2HG1  VAL  11          2HG1      VAL  11  72.560  -5.061   7.425
   89   3HG1  VAL  11          3HG1      VAL  11  71.291  -5.945   8.273
   90   1HG2  VAL  11          1HG2      VAL  11  72.519  -2.131   9.543
   91   2HG2  VAL  11          2HG2      VAL  11  72.225  -2.168   7.804
   92   3HG2  VAL  11          3HG2      VAL  11  73.485  -3.181   8.508
   93    H    HIS  12           H        HIS  12  69.414  -5.388   6.493
   94    HA   HIS  12           HA       HIS  12  67.518  -6.601   8.474
   95   1HB   HIS  12          2HB       HIS  12  67.422  -6.166   5.507
   96   2HB   HIS  12          1HB       HIS  12  66.575  -7.556   6.194
   97    HD1  HIS  12           HD1      HIS  12  66.894  -3.838   7.057
   98    HD2  HIS  12           HD2      HIS  12  64.019  -6.853   6.932
   99    HE1  HIS  12           HE1      HIS  12  64.712  -2.775   7.775
  100    H    ARG  13           H        ARG  13  67.233  -9.014   7.969
  101    HA   ARG  13           HA       ARG  13  69.480 -10.476   8.608
  102   1HB   ARG  13          2HB       ARG  13  67.064 -11.179   6.932
  103   2HB   ARG  13          1HB       ARG  13  68.183 -12.402   7.546
  104   1HG   ARG  13          2HG       ARG  13  67.772 -11.554   9.860
  105   2HG   ARG  13          1HG       ARG  13  66.577 -10.433   9.206
  106   1HD   ARG  13          2HD       ARG  13  65.362 -12.437   8.231
  107   2HD   ARG  13          1HD       ARG  13  66.461 -13.465   9.171
  108    HE   ARG  13           HE       ARG  13  65.595 -11.694  11.067
  109   1HH1  ARG  13          1HH1      ARG  13  63.851 -13.644   8.725
  110   2HH1  ARG  13          2HH1      ARG  13  62.447 -13.752   9.725
  111   1HH2  ARG  13          1HH2      ARG  13  63.754 -11.870  12.312
  112   2HH2  ARG  13          2HH2      ARG  13  62.389 -12.763  11.729
  113    H    ILE  14           H        ILE  14  71.013 -11.756   7.472
  114    HA   ILE  14           HA       ILE  14  72.582 -12.261   5.799
  115    HB   ILE  14           HB       ILE  14  70.389 -11.350   3.905
  116   1HG1  ILE  14          2HG1      ILE  14  70.975 -14.173   4.834
  117   2HG1  ILE  14          1HG1      ILE  14  69.745 -13.162   5.595
  118   1HG2  ILE  14          1HG2      ILE  14  72.216 -11.617   2.528
  119   2HG2  ILE  14          2HG2      ILE  14  71.668 -13.292   2.597
  120   3HG2  ILE  14          3HG2      ILE  14  73.003 -12.757   3.619
  121   1HD1  ILE  14          1HD1      ILE  14  69.765 -14.410   2.889
  122   2HD1  ILE  14          2HD1      ILE  14  69.028 -12.812   3.030
  123   3HD1  ILE  14          3HD1      ILE  14  68.418 -14.155   4.000
  124    H    GLY  15           H        GLY  15  71.773  -9.168   6.604
  125   1HA   GLY  15          2HA       GLY  15  73.031  -7.197   6.321
  126   2HA   GLY  15          1HA       GLY  15  74.068  -8.071   5.198
  127    H    ARG  16           H        ARG  16  70.694  -8.296   4.483
  128    HA   ARG  16           HA       ARG  16  71.123  -6.861   1.964
  129   1HB   ARG  16          2HB       ARG  16  69.894  -9.033   2.268
  130   2HB   ARG  16          1HB       ARG  16  68.652  -8.158   3.161
  131   1HG   ARG  16          2HG       ARG  16  68.236  -6.737   1.175
  132   2HG   ARG  16          1HG       ARG  16  69.451  -7.650   0.280
  133   1HD   ARG  16          2HD       ARG  16  68.077  -9.751   0.864
  134   2HD   ARG  16          1HD       ARG  16  66.784  -8.627   1.324
  135    HE   ARG  16           HE       ARG  16  67.974  -8.048  -1.288
  136   1HH1  ARG  16          1HH1      ARG  16  65.469  -9.822   0.416
  137   2HH1  ARG  16          2HH1      ARG  16  64.489  -9.976  -0.999
  138   1HH2  ARG  16          1HH2      ARG  16  66.666  -8.285  -3.081
  139   2HH2  ARG  16          2HH2      ARG  16  65.154  -9.118  -2.952
  140    H    ILE  17           H        ILE  17  70.184  -4.886   1.391
  141    HA   ILE  17           HA       ILE  17  68.310  -3.604   3.332
  142    HB   ILE  17           HB       ILE  17  69.523  -1.466   3.023
  143   1HG1  ILE  17          2HG1      ILE  17  71.645  -3.057   1.558
  144   2HG1  ILE  17          1HG1      ILE  17  70.404  -2.133   0.715
  145   1HG2  ILE  17          1HG2      ILE  17  71.414  -3.700   3.810
  146   2HG2  ILE  17          2HG2      ILE  17  70.161  -3.039   4.859
  147   3HG2  ILE  17          3HG2      ILE  17  71.498  -2.017   4.330
  148   1HD1  ILE  17          1HD1      ILE  17  71.373  -0.133   1.214
  149   2HD1  ILE  17          2HD1      ILE  17  72.818  -1.104   1.501
  150   3HD1  ILE  17          3HD1      ILE  17  71.787  -0.639   2.854
  151    H    ILE  18           H        ILE  18  66.821  -2.105   2.289
  152    HA   ILE  18           HA       ILE  18  66.740  -2.345  -0.705
  153    HB   ILE  18           HB       ILE  18  64.446  -1.955   1.248
  154   1HG1  ILE  18          2HG1      ILE  18  65.413  -4.200   1.523
  155   2HG1  ILE  18          1HG1      ILE  18  63.856  -4.311   0.710
  156   1HG2  ILE  18          1HG2      ILE  18  64.682  -2.177  -1.736
  157   2HG2  ILE  18          2HG2      ILE  18  63.672  -1.098  -0.769
  158   3HG2  ILE  18          3HG2      ILE  18  63.233  -2.799  -0.941
  159   1HD1  ILE  18          1HD1      ILE  18  66.602  -4.783  -0.375
  160   2HD1  ILE  18          2HD1      ILE  18  65.382  -4.132  -1.470
  161   3HD1  ILE  18          3HD1      ILE  18  65.112  -5.680  -0.669
  162    H    ILE  19           H        ILE  19  66.941  -0.415  -1.757
  163    HA   ILE  19           HA       ILE  19  66.963   2.122  -0.253
  164    HB   ILE  19           HB       ILE  19  67.180   1.486  -3.231
  165   1HG1  ILE  19          2HG1      ILE  19  69.264   1.862  -1.037
  166   2HG1  ILE  19          1HG1      ILE  19  68.953   0.389  -1.943
  167   1HG2  ILE  19          1HG2      ILE  19  68.079   3.969  -1.721
  168   2HG2  ILE  19          2HG2      ILE  19  66.529   3.859  -2.557
  169   3HG2  ILE  19          3HG2      ILE  19  68.034   3.733  -3.469
  170   1HD1  ILE  19          1HD1      ILE  19  69.462   2.395  -3.871
  171   2HD1  ILE  19          2HD1      ILE  19  70.508   1.044  -3.431
  172   3HD1  ILE  19          3HD1      ILE  19  70.682   2.597  -2.612
  173    HA   PRO  20           HA       PRO  20  62.631   3.018  -0.985
  174   1HB   PRO  20          2HB       PRO  20  62.764   5.754  -1.037
  175   2HB   PRO  20          1HB       PRO  20  62.820   4.823   0.470
  176   1HG   PRO  20          2HG       PRO  20  65.103   5.880  -1.164
  177   2HG   PRO  20          1HG       PRO  20  64.818   6.048   0.580
  178   1HD   PRO  20          2HD       PRO  20  66.498   4.204  -0.283
  179   2HD   PRO  20          1HD       PRO  20  65.329   3.787   0.999
  180    H    ALA  21           H        ALA  21  61.441   3.399  -2.859
  181    HA   ALA  21           HA       ALA  21  62.699   3.325  -5.393
  182   1HB   ALA  21          1HB       ALA  21  59.946   4.426  -4.745
  183   2HB   ALA  21          2HB       ALA  21  60.329   2.704  -4.752
  184   3HB   ALA  21          3HB       ALA  21  60.451   3.641  -6.241
  185    H    GLY  22           H        GLY  22  61.832   6.070  -3.367
  186   1HA   GLY  22          2HA       GLY  22  61.878   8.110  -5.398
  187   2HA   GLY  22          1HA       GLY  22  62.142   8.387  -3.674
  188    H    THR  23           H        THR  23  64.439   6.828  -3.261
  189    HA   THR  23           HA       THR  23  66.501   8.604  -4.243
  190    HB   THR  23           HB       THR  23  66.670   5.872  -2.927
  191    HG1  THR  23           HG1      THR  23  66.856   7.149  -1.035
  192   1HG2  THR  23          1HG2      THR  23  68.830   7.309  -2.076
  193   2HG2  THR  23          2HG2      THR  23  68.672   7.898  -3.731
  194   3HG2  THR  23          3HG2      THR  23  68.873   6.173  -3.424
  195    H    ARG  24           H        ARG  24  65.449   5.321  -5.161
  196    HA   ARG  24           HA       ARG  24  67.504   4.673  -7.051
  197   1HB   ARG  24          2HB       ARG  24  64.561   4.087  -7.470
  198   2HB   ARG  24          1HB       ARG  24  65.936   3.108  -7.961
  199   1HG   ARG  24          2HG       ARG  24  66.392   3.011  -5.356
  200   2HG   ARG  24          1HG       ARG  24  64.676   3.387  -5.267
  201   1HD   ARG  24          2HD       ARG  24  64.521   1.444  -7.095
  202   2HD   ARG  24          1HD       ARG  24  66.013   0.927  -6.276
  203    HE   ARG  24           HE       ARG  24  64.423   1.497  -4.153
  204   1HH1  ARG  24          1HH1      ARG  24  63.784  -0.392  -7.039
  205   2HH1  ARG  24          2HH1      ARG  24  62.620  -1.384  -6.237
  206   1HH2  ARG  24          1HH2      ARG  24  62.933   0.188  -3.175
  207   2HH2  ARG  24          2HH2      ARG  24  62.138  -1.063  -4.073
  208    H    LYS  25           H        LYS  25  64.530   6.561  -7.379
  209    HA   LYS  25           HA       LYS  25  64.621   6.994 -10.205
  210   1HB   LYS  25          2HB       LYS  25  62.662   7.316  -8.706
  211   2HB   LYS  25          1HB       LYS  25  63.471   8.695  -7.963
  212   1HG   LYS  25          2HG       LYS  25  63.525   9.834 -10.153
  213   2HG   LYS  25          1HG       LYS  25  62.685   8.464 -10.879
  214   1HD   LYS  25          2HD       LYS  25  60.810   8.829  -9.253
  215   2HD   LYS  25          1HD       LYS  25  61.631  10.290  -8.703
  216   1HE   LYS  25          2HE       LYS  25  61.445  11.305 -10.899
  217   2HE   LYS  25          1HE       LYS  25  60.812   9.796 -11.587
  218   1HZ   LYS  25          1HZ       LYS  25  58.993   9.909  -9.948
  219   2HZ   LYS  25          2HZ       LYS  25  58.976  11.222 -11.026
  220   3HZ   LYS  25          3HZ       LYS  25  59.557  11.426  -9.443
  221    H    PHE  26           H        PHE  26  65.670   9.089  -7.507
  222    HA   PHE  26           HA       PHE  26  66.709  11.253  -9.034
  223   1HB   PHE  26          2HB       PHE  26  66.304  11.182  -6.573
  224   2HB   PHE  26          1HB       PHE  26  67.695  10.112  -6.398
  225    HD1  PHE  26           HD1      PHE  26  69.934  10.970  -6.305
  226    HD2  PHE  26           HD2      PHE  26  66.648  13.530  -7.580
  227    HE1  PHE  26           HE1      PHE  26  71.465  12.965  -6.246
  228    HE2  PHE  26           HE2      PHE  26  68.179  15.525  -7.520
  229    HZ   PHE  26           HZ       PHE  26  70.587  15.242  -6.853
  230    H    TYR  27           H        TYR  27  68.255   8.230  -8.004
  231    HA   TYR  27           HA       TYR  27  70.867   8.997  -9.128
  232   1HB   TYR  27          2HB       TYR  27  70.501   7.728  -7.019
  233   2HB   TYR  27          1HB       TYR  27  69.806   6.412  -7.947
  234    HD1  TYR  27           HD1      TYR  27  71.311   5.323  -9.824
  235    HD2  TYR  27           HD2      TYR  27  72.835   7.853  -6.627
  236    HE1  TYR  27           HE1      TYR  27  73.593   4.324 -10.127
  237    HE2  TYR  27           HE2      TYR  27  75.126   6.866  -6.947
  238    HH   TYR  27           HH       TYR  27  76.163   4.868  -7.850
  239    H    GLY  28           H        GLY  28  68.017   7.423 -10.358
  240   1HA   GLY  28          2HA       GLY  28  67.620   6.602 -12.525
  241   2HA   GLY  28          1HA       GLY  28  69.291   6.996 -12.930
  242    H    ILE  29           H        ILE  29  68.074   4.842 -10.356
  243    HA   ILE  29           HA       ILE  29  70.001   2.777 -11.185
  244    HB   ILE  29           HB       ILE  29  67.949   2.898  -8.942
  245   1HG1  ILE  29          2HG1      ILE  29  70.932   3.455  -8.926
  246   2HG1  ILE  29          1HG1      ILE  29  69.676   4.687  -8.890
  247   1HG2  ILE  29          1HG2      ILE  29  68.466   0.665  -8.890
  248   2HG2  ILE  29          2HG2      ILE  29  69.907   1.242  -8.055
  249   3HG2  ILE  29          3HG2      ILE  29  69.971   0.885  -9.780
  250   1HD1  ILE  29          1HD1      ILE  29  68.930   2.992  -6.827
  251   2HD1  ILE  29          2HD1      ILE  29  69.793   4.519  -6.637
  252   3HD1  ILE  29          3HD1      ILE  29  70.693   3.001  -6.718
  253    H    GLU  30           H        GLU  30  69.504   1.099 -12.463
  254    HA   GLU  30           HA       GLU  30  66.700   0.057 -12.489
  255   1HB   GLU  30          2HB       GLU  30  68.615   0.350 -14.832
  256   2HB   GLU  30          1HB       GLU  30  67.032  -0.422 -14.911
  257   1HG   GLU  30          2HG       GLU  30  65.981   1.711 -14.178
  258   2HG   GLU  30          1HG       GLU  30  67.568   2.476 -14.190
  259    H    GLN  31           H        GLN  31  66.666  -2.310 -12.917
  260    HA   GLN  31           HA       GLN  31  68.578  -3.801 -11.442
  261   1HB   GLN  31          2HB       GLN  31  66.659  -4.570 -13.662
  262   2HB   GLN  31          1HB       GLN  31  67.503  -5.747 -12.654
  263   1HG   GLN  31          2HG       GLN  31  66.473  -4.822 -10.642
  264   2HG   GLN  31          1HG       GLN  31  65.693  -3.557 -11.592
  265   1HE2  GLN  31          1HE2      GLN  31  63.843  -4.920 -10.273
  266   2HE2  GLN  31          2HE2      GLN  31  63.076  -6.105 -11.216
  267    H    GLY  32           H        GLY  32  70.499  -4.804 -11.992
  268   1HA   GLY  32          2HA       GLY  32  72.088  -5.795 -13.498
  269   2HA   GLY  32          1HA       GLY  32  71.284  -4.992 -14.842
  270    H    ASP  33           H        ASP  33  71.391  -2.432 -12.949
  271    HA   ASP  33           HA       ASP  33  73.885  -1.386 -14.080
  272   1HB   ASP  33          2HB       ASP  33  71.811  -0.331 -12.135
  273   2HB   ASP  33          1HB       ASP  33  73.155   0.633 -12.744
  274    H    PHE  34           H        PHE  34  75.671  -0.560 -12.754
  275    HA   PHE  34           HA       PHE  34  75.931  -1.935 -10.099
  276   1HB   PHE  34          2HB       PHE  34  77.924  -1.058 -12.206
  277   2HB   PHE  34          1HB       PHE  34  78.411  -1.562 -10.588
  278    HD1  PHE  34           HD1      PHE  34  76.901  -2.664 -13.811
  279    HD2  PHE  34           HD2      PHE  34  78.224  -3.902  -9.849
  280    HE1  PHE  34           HE1      PHE  34  76.760  -5.074 -14.517
  281    HE2  PHE  34           HE2      PHE  34  78.082  -6.312 -10.555
  282    HZ   PHE  34           HZ       PHE  34  77.350  -6.898 -12.889
  283    H    VAL  35           H        VAL  35  76.320  -0.617  -8.331
  284    HA   VAL  35           HA       VAL  35  77.011   2.246  -8.850
  285    HB   VAL  35           HB       VAL  35  75.419   2.864  -7.039
  286   1HG1  VAL  35          1HG1      VAL  35  74.010   1.153  -9.105
  287   2HG1  VAL  35          2HG1      VAL  35  74.757   2.700  -9.503
  288   3HG1  VAL  35          3HG1      VAL  35  73.426   2.635  -8.347
  289   1HG2  VAL  35          1HG2      VAL  35  73.743   1.074  -6.369
  290   2HG2  VAL  35          2HG2      VAL  35  75.367   0.856  -5.711
  291   3HG2  VAL  35          3HG2      VAL  35  74.837  -0.111  -7.088
  292    H    GLU  36           H        GLU  36  78.293   3.189  -7.127
  293    HA   GLU  36           HA       GLU  36  79.575   1.156  -5.326
  294   1HB   GLU  36          2HB       GLU  36  80.952   2.124  -7.198
  295   2HB   GLU  36          1HB       GLU  36  80.696   3.726  -6.504
  296   1HG   GLU  36          2HG       GLU  36  81.730   2.929  -4.376
  297   2HG   GLU  36          1HG       GLU  36  82.066   1.383  -5.149
  298    H    ILE  37           H        ILE  37  79.121   1.525  -3.224
  299    HA   ILE  37           HA       ILE  37  78.248   4.275  -2.427
  300    HB   ILE  37           HB       ILE  37  76.412   2.784  -3.120
  301   1HG1  ILE  37          2HG1      ILE  37  76.179   2.825  -0.138
  302   2HG1  ILE  37          1HG1      ILE  37  76.387   4.358  -0.981
  303   1HG2  ILE  37          1HG2      ILE  37  75.930   0.752  -1.730
  304   2HG2  ILE  37          2HG2      ILE  37  77.501   0.961  -0.956
  305   3HG2  ILE  37          3HG2      ILE  37  77.408   0.618  -2.684
  306   1HD1  ILE  37          1HD1      ILE  37  74.175   4.330  -1.411
  307   2HD1  ILE  37          2HD1      ILE  37  74.023   2.684  -0.799
  308   3HD1  ILE  37          3HD1      ILE  37  74.456   2.961  -2.486
  309    H    LYS  38           H        LYS  38  78.266   4.657  -0.103
  310    HA   LYS  38           HA       LYS  38  79.966   2.788   1.504
  311   1HB   LYS  38          2HB       LYS  38  80.958   4.993   0.437
  312   2HB   LYS  38          1HB       LYS  38  80.118   5.780   1.774
  313   1HG   LYS  38          2HG       LYS  38  81.644   3.403   2.605
  314   2HG   LYS  38          1HG       LYS  38  82.653   4.662   1.899
  315   1HD   LYS  38          2HD       LYS  38  80.582   5.392   3.952
  316   2HD   LYS  38          1HD       LYS  38  82.139   4.739   4.465
  317   1HE   LYS  38          2HE       LYS  38  82.949   6.609   2.633
  318   2HE   LYS  38          1HE       LYS  38  81.510   7.391   3.318
  319   1HZ   LYS  38          1HZ       LYS  38  82.373   6.756   5.548
  320   2HZ   LYS  38          2HZ       LYS  38  83.342   7.892   4.737
  321   3HZ   LYS  38          3HZ       LYS  38  83.818   6.262   4.808
  322    H    ILE  39           H        ILE  39  79.305   2.584   3.677
  323    HA   ILE  39           HA       ILE  39  76.868   4.146   4.483
  324    HB   ILE  39           HB       ILE  39  76.401   2.159   5.934
  325   1HG1  ILE  39          2HG1      ILE  39  78.647   0.826   4.394
  326   2HG1  ILE  39          1HG1      ILE  39  78.836   1.448   6.033
  327   1HG2  ILE  39          1HG2      ILE  39  76.251   0.558   3.754
  328   2HG2  ILE  39          2HG2      ILE  39  76.499   2.122   2.976
  329   3HG2  ILE  39          3HG2      ILE  39  75.135   1.887   4.071
  330   1HD1  ILE  39          1HD1      ILE  39  77.340  -0.932   5.073
  331   2HD1  ILE  39          2HD1      ILE  39  76.584  -0.004   6.368
  332   3HD1  ILE  39          3HD1      ILE  39  78.198  -0.679   6.593
  333    H    VAL  40           H        VAL  40  76.790   4.917   6.638
  334    HA   VAL  40           HA       VAL  40  79.259   4.636   8.297
  335    HB   VAL  40           HB       VAL  40  77.822   7.224   7.598
  336   1HG1  VAL  40          1HG1      VAL  40  79.951   8.166   8.738
  337   2HG1  VAL  40          2HG1      VAL  40  80.136   6.550   9.421
  338   3HG1  VAL  40          3HG1      VAL  40  78.695   7.501   9.782
  339   1HG2  VAL  40          1HG2      VAL  40  79.086   6.885   5.693
  340   2HG2  VAL  40          2HG2      VAL  40  80.247   5.848   6.522
  341   3HG2  VAL  40          3HG2      VAL  40  80.332   7.599   6.716
  342    H    LYS  41           H        LYS  41  78.671   4.103  10.344
  343    HA   LYS  41           HA       LYS  41  76.106   5.161  11.451
  344   1HB   LYS  41          2HB       LYS  41  75.864   2.778  10.723
  345   2HB   LYS  41          1HB       LYS  41  77.185   2.346  11.810
  346   1HG   LYS  41          2HG       LYS  41  75.865   3.350  13.702
  347   2HG   LYS  41          1HG       LYS  41  74.516   3.554  12.585
  348   1HD   LYS  41          2HD       LYS  41  74.460   1.135  12.178
  349   2HD   LYS  41          1HD       LYS  41  75.844   0.911  13.249
  350   1HE   LYS  41          2HE       LYS  41  73.570   2.416  14.428
  351   2HE   LYS  41          1HE       LYS  41  73.278   0.695  14.115
  352   1HZ   LYS  41          1HZ       LYS  41  75.220   0.100  15.306
  353   2HZ   LYS  41          2HZ       LYS  41  74.374   1.190  16.297
  354   3HZ   LYS  41          3HZ       LYS  41  75.736   1.711  15.425
  355    H    TYR  42           H        TYR  42  76.245   5.646  13.690
  356    HA   TYR  42           HA       TYR  42  79.026   5.708  14.789
  357   1HB   TYR  42          2HB       TYR  42  77.517   7.764  14.507
  358   2HB   TYR  42          1HB       TYR  42  76.548   7.102  15.825
  359    HD1  TYR  42           HD1      TYR  42  80.042   8.145  14.896
  360    HD2  TYR  42           HD2      TYR  42  77.212   7.374  18.116
  361    HE1  TYR  42           HE1      TYR  42  81.683   9.073  16.556
  362    HE2  TYR  42           HE2      TYR  42  78.854   8.305  19.781
  363    HH   TYR  42           HH       TYR  42  80.906  10.064  19.575
  364    H    GLU  43           H        GLU  43  79.549   4.341  16.458
  365    HA   GLU  43           HA       GLU  43  77.345   3.223  18.146
  366   1HB   GLU  43          2HB       GLU  43  78.425   0.994  17.893
  367   2HB   GLU  43          1HB       GLU  43  77.885   1.637  16.343
  368   1HG   GLU  43          2HG       GLU  43  80.231   2.521  15.995
  369   2HG   GLU  43          1HG       GLU  43  80.712   1.624  17.436
  370    H    GLY  44           H        GLY  44  77.872   3.200  20.302
  371   1HA   GLY  44          2HA       GLY  44  79.106   3.559  22.265
  372   2HA   GLY  44          1HA       GLY  44  80.488   2.877  21.407
  373    H    GLU  45           H        GLU  45  82.150   4.293  21.550
  374    HA   GLU  45           HA       GLU  45  81.583   7.217  21.323
  375   1HB   GLU  45          2HB       GLU  45  83.726   7.493  22.460
  376   2HB   GLU  45          1HB       GLU  45  82.737   6.342  23.351
  377   1HG   GLU  45          2HG       GLU  45  83.964   4.468  22.292
  378   2HG   GLU  45          1HG       GLU  45  84.953   5.623  21.401
  379    H    GLU  46           H        GLU  46  82.312   4.827  19.187
  380    HA   GLU  46           HA       GLU  46  84.113   6.616  17.603
  381   1HB   GLU  46          2HB       GLU  46  85.268   4.546  16.857
  382   2HB   GLU  46          1HB       GLU  46  85.361   4.759  18.603
  383   1HG   GLU  46          2HG       GLU  46  83.413   3.214  18.857
  384   2HG   GLU  46          1HG       GLU  46  83.441   2.943  17.115
  385    HA   PRO  47           HA       PRO  47  81.021   5.734  14.435
  386   1HB   PRO  47          2HB       PRO  47  82.696   6.963  12.429
  387   2HB   PRO  47          1HB       PRO  47  81.231   7.617  13.180
  388   1HG   PRO  47          2HG       PRO  47  83.792   8.587  13.542
  389   2HG   PRO  47          1HG       PRO  47  82.405   8.912  14.589
  390   1HD   PRO  47          2HD       PRO  47  84.690   7.075  15.005
  391   2HD   PRO  47          1HD       PRO  47  83.696   7.947  16.193
  392    H    LYS  48           H        LYS  48  80.880   4.087  12.859
  393    HA   LYS  48           HA       LYS  48  83.442   2.853  11.921
  394   1HB   LYS  48          2HB       LYS  48  80.832   1.543  12.729
  395   2HB   LYS  48          1HB       LYS  48  82.123   0.694  11.877
  396   1HG   LYS  48          2HG       LYS  48  83.576   1.779  13.866
  397   2HG   LYS  48          1HG       LYS  48  82.021   1.654  14.691
  398   1HD   LYS  48          2HD       LYS  48  81.891  -0.736  14.062
  399   2HD   LYS  48          1HD       LYS  48  83.466  -0.603  13.279
  400   1HE   LYS  48          2HE       LYS  48  84.559  -0.128  15.384
  401   2HE   LYS  48          1HE       LYS  48  82.999   0.021  16.217
  402   1HZ   LYS  48          1HZ       LYS  48  83.986  -2.417  14.832
  403   2HZ   LYS  48          2HZ       LYS  48  82.495  -2.264  15.632
  404   3HZ   LYS  48          3HZ       LYS  48  83.946  -2.197  16.513
  405    H    GLU  49           H        GLU  49  83.451   2.250   9.722
  406    HA   GLU  49           HA       GLU  49  81.058   3.050   8.101
  407   1HB   GLU  49          2HB       GLU  49  83.968   3.818   7.711
  408   2HB   GLU  49          1HB       GLU  49  82.662   4.226   6.598
  409   1HG   GLU  49          2HG       GLU  49  81.504   5.435   8.440
  410   2HG   GLU  49          1HG       GLU  49  82.866   5.084   9.501
  411    H    GLY  50           H        GLY  50  81.306   2.297   5.784
  412   1HA   GLY  50          2HA       GLY  50  83.192   0.128   5.243
  413   2HA   GLY  50          1HA       GLY  50  81.516  -0.404   5.396
  414    H    THR  51           H        THR  51  83.549   0.034   3.043
  415    HA   THR  51           HA       THR  51  81.563   1.403   1.247
  416    HB   THR  51           HB       THR  51  84.555   1.382   0.823
  417    HG1  THR  51           HG1      THR  51  84.727   3.184   2.051
  418   1HG2  THR  51          1HG2      THR  51  82.828   3.693   0.140
  419   2HG2  THR  51          2HG2      THR  51  82.521   2.213  -0.771
  420   3HG2  THR  51          3HG2      THR  51  84.127   2.943  -0.788
  421    H    PHE  52           H        PHE  52  81.048   0.229  -0.603
  422    HA   PHE  52           HA       PHE  52  82.903  -1.787  -1.652
  423   1HB   PHE  52          2HB       PHE  52  81.510  -3.703  -1.231
  424   2HB   PHE  52          1HB       PHE  52  81.651  -2.840   0.294
  425    HD1  PHE  52           HD1      PHE  52  79.393  -4.295  -2.077
  426    HD2  PHE  52           HD2      PHE  52  79.719  -1.073   0.836
  427    HE1  PHE  52           HE1      PHE  52  76.889  -4.134  -1.979
  428    HE2  PHE  52           HE2      PHE  52  77.209  -0.913   0.936
  429    HZ   PHE  52           HZ       PHE  52  75.796  -2.444  -0.479
  430    H    THR  53           H        THR  53  81.804  -2.943  -3.603
  431    HA   THR  53           HA       THR  53  80.065  -0.991  -5.077
  432    HB   THR  53           HB       THR  53  81.843  -3.244  -6.077
  433    HG1  THR  53           HG1      THR  53  83.206  -1.533  -6.686
  434   1HG2  THR  53          1HG2      THR  53  81.537  -1.933  -8.258
  435   2HG2  THR  53          2HG2      THR  53  80.203  -1.111  -7.449
  436   3HG2  THR  53          3HG2      THR  53  80.143  -2.856  -7.696
  437    H    ALA  54           H        ALA  54  78.067  -1.739  -5.814
  438    HA   ALA  54           HA       ALA  54  77.373  -4.608  -5.352
  439   1HB   ALA  54          1HB       ALA  54  76.835  -2.563  -3.595
  440   2HB   ALA  54          2HB       ALA  54  75.892  -4.049  -3.705
  441   3HB   ALA  54          3HB       ALA  54  75.360  -2.601  -4.558
  442    H    ARG  55           H        ARG  55  75.737  -5.399  -6.703
  443    HA   ARG  55           HA       ARG  55  74.979  -3.692  -9.021
  444   1HB   ARG  55          2HB       ARG  55  75.935  -6.064  -9.163
  445   2HB   ARG  55          1HB       ARG  55  74.395  -6.617  -8.505
  446   1HG   ARG  55          2HG       ARG  55  73.234  -5.420 -10.385
  447   2HG   ARG  55          1HG       ARG  55  74.819  -5.079 -11.080
  448   1HD   ARG  55          2HD       ARG  55  75.261  -7.588 -11.039
  449   2HD   ARG  55          1HD       ARG  55  73.543  -7.794 -10.642
  450    HE   ARG  55           HE       ARG  55  74.021  -6.034 -12.934
  451   1HH1  ARG  55          1HH1      ARG  55  73.479  -9.344 -11.900
  452   2HH1  ARG  55          2HH1      ARG  55  72.885  -9.827 -13.449
  453   1HH2  ARG  55          1HH2      ARG  55  73.247  -6.717 -14.910
  454   2HH2  ARG  55          2HH2      ARG  55  72.754  -8.362 -15.132
  455    H    VAL  56           H        VAL  56  72.805  -3.210  -9.453
  456    HA   VAL  56           HA       VAL  56  70.956  -3.241  -7.183
  457    HB   VAL  56           HB       VAL  56  70.732  -2.344 -10.077
  458   1HG1  VAL  56          1HG1      VAL  56  68.617  -2.786  -8.337
  459   2HG1  VAL  56          2HG1      VAL  56  68.600  -1.669  -9.701
  460   3HG1  VAL  56          3HG1      VAL  56  68.973  -1.079  -8.081
  461   1HG2  VAL  56          1HG2      VAL  56  71.532  -0.295  -9.386
  462   2HG2  VAL  56          2HG2      VAL  56  72.364  -1.313  -8.211
  463   3HG2  VAL  56          3HG2      VAL  56  70.881  -0.477  -7.757
  464    H    GLY  57           H        GLY  57  69.561  -4.845  -6.773
  465   1HA   GLY  57          2HA       GLY  57  68.965  -6.845  -8.905
  466   2HA   GLY  57          1HA       GLY  57  68.817  -7.144  -7.174
  467    H    GLU  58           H        GLU  58  66.649  -7.901  -7.880
  468    HA   GLU  58           HA       GLU  58  64.625  -6.194  -8.948
  469   1HB   GLU  58          2HB       GLU  58  64.583  -8.693  -8.715
  470   2HB   GLU  58          1HB       GLU  58  64.362  -8.491  -6.977
  471   1HG   GLU  58          2HG       GLU  58  62.284  -7.206  -7.409
  472   2HG   GLU  58          1HG       GLU  58  62.490  -7.473  -9.136
  473    H    GLN  59           H        GLN  59  62.968  -5.005  -7.872
  474    HA   GLN  59           HA       GLN  59  62.144  -3.482  -6.278
  475   1HB   GLN  59          2HB       GLN  59  63.115  -5.827  -4.638
  476   2HB   GLN  59          1HB       GLN  59  62.253  -4.470  -3.911
  477   1HG   GLN  59          2HG       GLN  59  60.315  -4.861  -5.270
  478   2HG   GLN  59          1HG       GLN  59  61.177  -6.020  -6.277
  479   1HE2  GLN  59          1HE2      GLN  59  59.428  -7.592  -5.649
  480   2HE2  GLN  59          2HE2      GLN  59  59.530  -8.382  -4.151
  481    H    GLY  60           H        GLY  60  65.204  -3.414  -7.002
  482   1HA   GLY  60          2HA       GLY  60  66.823  -1.786  -6.507
  483   2HA   GLY  60          1HA       GLY  60  65.672  -1.103  -5.361
  484    H    SER  61           H        SER  61  66.525  -4.439  -4.924
  485    HA   SER  61           HA       SER  61  67.550  -3.857  -2.262
  486   1HB   SER  61          2HB       SER  61  67.588  -6.467  -3.804
  487   2HB   SER  61          1HB       SER  61  67.546  -6.258  -2.056
  488    HG   SER  61           HG       SER  61  65.465  -6.496  -2.458
  489    H    VAL  62           H        VAL  62  69.678  -4.092  -1.527
  490    HA   VAL  62           HA       VAL  62  71.785  -4.912  -3.462
  491    HB   VAL  62           HB       VAL  62  71.589  -2.453  -3.538
  492   1HG1  VAL  62          1HG1      VAL  62  72.035  -1.113  -1.519
  493   2HG1  VAL  62          2HG1      VAL  62  72.144  -2.589  -0.559
  494   3HG1  VAL  62          3HG1      VAL  62  70.609  -2.127  -1.295
  495   1HG2  VAL  62          1HG2      VAL  62  74.034  -3.227  -1.926
  496   2HG2  VAL  62          2HG2      VAL  62  73.902  -1.932  -3.116
  497   3HG2  VAL  62          3HG2      VAL  62  73.838  -3.616  -3.635
  498    H    ILE  63           H        ILE  63  73.589  -5.907  -2.414
  499    HA   ILE  63           HA       ILE  63  73.059  -6.671   0.431
  500    HB   ILE  63           HB       ILE  63  74.741  -7.976  -1.739
  501   1HG1  ILE  63          2HG1      ILE  63  72.351  -7.967  -2.345
  502   2HG1  ILE  63          1HG1      ILE  63  72.873  -9.596  -1.924
  503   1HG2  ILE  63          1HG2      ILE  63  74.144  -9.963  -0.023
  504   2HG2  ILE  63          2HG2      ILE  63  74.155  -8.610   1.108
  505   3HG2  ILE  63          3HG2      ILE  63  75.589  -8.966   0.145
  506   1HD1  ILE  63          1HD1      ILE  63  71.413  -7.681  -0.076
  507   2HD1  ILE  63          2HD1      ILE  63  71.934  -9.313   0.344
  508   3HD1  ILE  63          3HD1      ILE  63  70.694  -9.072  -0.887
  509    H    ILE  64           H        ILE  64  74.410  -5.846   1.958
  510    HA   ILE  64           HA       ILE  64  76.994  -4.585   1.281
  511    HB   ILE  64           HB       ILE  64  75.611  -5.239   3.911
  512   1HG1  ILE  64          2HG1      ILE  64  75.819  -2.568   2.497
  513   2HG1  ILE  64          1HG1      ILE  64  74.442  -3.650   2.286
  514   1HG2  ILE  64          1HG2      ILE  64  77.814  -3.224   3.404
  515   2HG2  ILE  64          2HG2      ILE  64  78.134  -4.862   3.973
  516   3HG2  ILE  64          3HG2      ILE  64  77.177  -3.758   4.959
  517   1HD1  ILE  64          1HD1      ILE  64  73.701  -3.358   4.462
  518   2HD1  ILE  64          2HD1      ILE  64  74.415  -1.773   4.164
  519   3HD1  ILE  64          3HD1      ILE  64  75.313  -2.989   5.072
  520    HA   PRO  65           HA       PRO  65  79.292  -8.372   1.589
  521   1HB   PRO  65          2HB       PRO  65  81.727  -7.419   2.395
  522   2HB   PRO  65          1HB       PRO  65  81.113  -7.205   0.740
  523   1HG   PRO  65          2HG       PRO  65  80.949  -5.310   3.057
  524   2HG   PRO  65          1HG       PRO  65  81.529  -4.998   1.408
  525   1HD   PRO  65          2HD       PRO  65  79.070  -4.300   2.080
  526   2HD   PRO  65          1HD       PRO  65  79.363  -5.082   0.505
  527    H    LYS  66           H        LYS  66  79.414  -9.885   3.205
  528    HA   LYS  66           HA       LYS  66  78.620  -9.444   5.885
  529   1HB   LYS  66          2HB       LYS  66  78.674 -11.609   4.652
  530   2HB   LYS  66          1HB       LYS  66  80.434 -11.606   4.763
  531   1HG   LYS  66          2HG       LYS  66  79.714 -12.958   6.580
  532   2HG   LYS  66          1HG       LYS  66  80.108 -11.399   7.304
  533   1HD   LYS  66          2HD       LYS  66  77.751 -10.753   7.282
  534   2HD   LYS  66          1HD       LYS  66  77.323 -12.257   6.465
  535   1HE   LYS  66          2HE       LYS  66  78.502 -13.401   8.519
  536   2HE   LYS  66          1HE       LYS  66  78.203 -11.842   9.313
  537   1HZ   LYS  66          1HZ       LYS  66  76.284 -13.234   9.609
  538   2HZ   LYS  66          2HZ       LYS  66  76.194 -13.550   7.942
  539   3HZ   LYS  66          3HZ       LYS  66  75.882 -11.987   8.532
  540    H    ALA  67           H        ALA  67  81.849  -9.401   4.446
  541    HA   ALA  67           HA       ALA  67  83.444  -9.476   6.797
  542   1HB   ALA  67          1HB       ALA  67  84.588  -9.685   4.771
  543   2HB   ALA  67          2HB       ALA  67  84.973  -8.019   5.203
  544   3HB   ALA  67          3HB       ALA  67  83.706  -8.354   4.023
  545    H    LEU  68           H        LEU  68  81.853  -6.739   5.188
  546    HA   LEU  68           HA       LEU  68  82.976  -4.740   6.996
  547   1HB   LEU  68          2HB       LEU  68  80.733  -4.739   4.957
  548   2HB   LEU  68          1HB       LEU  68  81.255  -3.294   5.820
  549    HG   LEU  68           HG       LEU  68  83.017  -5.018   4.044
  550   1HD1  LEU  68          1HD1      LEU  68  82.724  -3.461   2.366
  551   2HD1  LEU  68          2HD1      LEU  68  82.413  -2.145   3.499
  552   3HD1  LEU  68          3HD1      LEU  68  81.148  -3.323   3.147
  553   1HD2  LEU  68          1HD2      LEU  68  84.517  -4.099   5.588
  554   2HD2  LEU  68          2HD2      LEU  68  83.535  -2.656   5.834
  555   3HD2  LEU  68          3HD2      LEU  68  84.477  -2.839   4.354
  556    H    ARG  69           H        ARG  69  79.972  -6.643   6.865
  557    HA   ARG  69           HA       ARG  69  78.417  -5.215   8.796
  558   1HB   ARG  69          2HB       ARG  69  78.660  -8.225   8.430
  559   2HB   ARG  69          1HB       ARG  69  77.284  -7.370   9.110
  560   1HG   ARG  69          2HG       ARG  69  77.047  -6.204   6.859
  561   2HG   ARG  69          1HG       ARG  69  78.229  -7.360   6.239
  562   1HD   ARG  69          2HD       ARG  69  76.622  -9.115   7.452
  563   2HD   ARG  69          1HD       ARG  69  75.422  -7.846   7.153
  564    HE   ARG  69           HE       ARG  69  76.666  -7.992   4.730
  565   1HH1  ARG  69          1HH1      ARG  69  75.345 -10.490   6.820
  566   2HH1  ARG  69          2HH1      ARG  69  75.029 -11.554   5.497
  567   1HH2  ARG  69          1HH2      ARG  69  76.221  -9.412   3.070
  568   2HH2  ARG  69          2HH2      ARG  69  75.514 -10.956   3.403
  569    H    ASP  70           H        ASP  70  80.766  -7.859   9.204
  570    HA   ASP  70           HA       ASP  70  80.475  -8.086  12.054
  571   1HB   ASP  70          2HB       ASP  70  82.708  -8.868  10.151
  572   2HB   ASP  70          1HB       ASP  70  82.565  -9.446  11.810
  573    H    VAL  71           H        VAL  71  82.968  -6.479  10.049
  574    HA   VAL  71           HA       VAL  71  84.626  -5.556  12.182
  575    HB   VAL  71           HB       VAL  71  84.016  -4.415   9.429
  576   1HG1  VAL  71          1HG1      VAL  71  86.231  -3.326   9.605
  577   2HG1  VAL  71          2HG1      VAL  71  86.377  -3.902  11.266
  578   3HG1  VAL  71          3HG1      VAL  71  85.122  -2.735  10.844
  579   1HG2  VAL  71          1HG2      VAL  71  86.444  -6.012  10.203
  580   2HG2  VAL  71          2HG2      VAL  71  85.709  -5.809   8.613
  581   3HG2  VAL  71          3HG2      VAL  71  84.935  -6.840   9.817
  582    H    ILE  72           H        ILE  72  81.782  -4.093  10.652
  583    HA   ILE  72           HA       ILE  72  81.990  -1.617  12.187
  584    HB   ILE  72           HB       ILE  72  79.816  -2.764  10.398
  585   1HG1  ILE  72          2HG1      ILE  72  81.993  -0.743   9.775
  586   2HG1  ILE  72          1HG1      ILE  72  82.083  -2.452   9.346
  587   1HG2  ILE  72          1HG2      ILE  72  79.132  -0.893  11.977
  588   2HG2  ILE  72          2HG2      ILE  72  78.955  -0.512  10.264
  589   3HG2  ILE  72          3HG2      ILE  72  80.327   0.125  11.174
  590   1HD1  ILE  72          1HD1      ILE  72  81.199  -1.511   7.396
  591   2HD1  ILE  72          2HD1      ILE  72  80.234  -0.332   8.285
  592   3HD1  ILE  72          3HD1      ILE  72  79.742  -2.029   8.247
  593    H    GLY  73           H        GLY  73  80.534  -4.732  12.775
  594   1HA   GLY  73          2HA       GLY  73  79.456  -5.473  14.733
  595   2HA   GLY  73          1HA       GLY  73  79.647  -3.848  15.390
  596    H    ILE  74           H        ILE  74  78.016  -4.622  12.347
  597    HA   ILE  74           HA       ILE  74  75.691  -3.064  13.251
  598    HB   ILE  74           HB       ILE  74  76.366  -4.427  10.623
  599   1HG1  ILE  74          2HG1      ILE  74  78.040  -2.740  11.279
  600   2HG1  ILE  74          1HG1      ILE  74  77.092  -2.169   9.910
  601   1HG2  ILE  74          1HG2      ILE  74  74.118  -3.983  10.355
  602   2HG2  ILE  74          2HG2      ILE  74  74.773  -2.410   9.900
  603   3HG2  ILE  74          3HG2      ILE  74  74.130  -2.662  11.523
  604   1HD1  ILE  74          1HD1      ILE  74  76.813  -0.287  11.159
  605   2HD1  ILE  74          2HD1      ILE  74  77.264  -1.104  12.655
  606   3HD1  ILE  74          3HD1      ILE  74  75.617  -1.238  12.040
  607    H    LYS  75           H        LYS  75  73.584  -3.838  13.435
  608    HA   LYS  75           HA       LYS  75  73.156  -6.794  13.230
  609   1HB   LYS  75          2HB       LYS  75  72.036  -6.682  15.429
  610   2HB   LYS  75          1HB       LYS  75  73.691  -6.096  15.549
  611   1HG   LYS  75          2HG       LYS  75  72.306  -3.787  14.944
  612   2HG   LYS  75          1HG       LYS  75  71.152  -4.655  15.951
  613   1HD   LYS  75          2HD       LYS  75  74.044  -4.311  16.760
  614   2HD   LYS  75          1HD       LYS  75  72.804  -3.130  17.181
  615   1HE   LYS  75          2HE       LYS  75  71.713  -4.588  18.633
  616   2HE   LYS  75          1HE       LYS  75  72.291  -6.032  17.776
  617   1HZ   LYS  75          1HZ       LYS  75  74.498  -5.639  18.545
  618   2HZ   LYS  75          2HZ       LYS  75  73.477  -5.585  19.902
  619   3HZ   LYS  75          3HZ       LYS  75  74.069  -4.145  19.223
  620    HA   PRO  76           HA       PRO  76  69.346  -5.916  11.195
  621   1HB   PRO  76          2HB       PRO  76  67.498  -7.373  12.723
  622   2HB   PRO  76          1HB       PRO  76  68.442  -8.002  11.361
  623   1HG   PRO  76          2HG       PRO  76  68.904  -8.283  14.272
  624   2HG   PRO  76          1HG       PRO  76  69.264  -9.407  12.953
  625   1HD   PRO  76          2HD       PRO  76  71.177  -7.967  14.190
  626   2HD   PRO  76          1HD       PRO  76  71.277  -8.409  12.472
  627    H    GLY  77           H        GLY  77  67.976  -4.177  11.317
  628   1HA   GLY  77          2HA       GLY  77  66.278  -2.814  12.299
  629   2HA   GLY  77          1HA       GLY  77  66.680  -3.487  13.875
  630    H    GLU  78           H        GLU  78  69.600  -2.606  12.479
  631    HA   GLU  78           HA       GLU  78  69.672  -0.094  14.064
  632   1HB   GLU  78          2HB       GLU  78  71.529  -2.191  13.157
  633   2HB   GLU  78          1HB       GLU  78  72.195  -0.565  13.031
  634   1HG   GLU  78          2HG       GLU  78  71.449  -0.178  15.423
  635   2HG   GLU  78          1HG       GLU  78  71.061  -1.895  15.507
  636    H    VAL  79           H        VAL  79  69.626   1.878  13.085
  637    HA   VAL  79           HA       VAL  79  69.381   1.965  10.150
  638    HB   VAL  79           HB       VAL  79  67.761   3.038  11.673
  639   1HG1  VAL  79          1HG1      VAL  79  69.409   5.324  12.430
  640   2HG1  VAL  79          2HG1      VAL  79  70.047   3.824  13.099
  641   3HG1  VAL  79          3HG1      VAL  79  68.384   4.301  13.436
  642   1HG2  VAL  79          1HG2      VAL  79  67.955   4.015   9.480
  643   2HG2  VAL  79          2HG2      VAL  79  69.412   4.897   9.940
  644   3HG2  VAL  79          3HG2      VAL  79  67.854   5.347  10.632
  645    H    ILE  80           H        ILE  80  70.890   2.756   8.798
  646    HA   ILE  80           HA       ILE  80  73.195   4.322   9.894
  647    HB   ILE  80           HB       ILE  80  74.571   3.143   8.184
  648   1HG1  ILE  80          2HG1      ILE  80  72.064   1.512   7.673
  649   2HG1  ILE  80          1HG1      ILE  80  72.685   2.760   6.591
  650   1HG2  ILE  80          1HG2      ILE  80  73.098   0.974   9.649
  651   2HG2  ILE  80          2HG2      ILE  80  73.954   2.209  10.574
  652   3HG2  ILE  80          3HG2      ILE  80  74.835   1.195   9.432
  653   1HD1  ILE  80          1HD1      ILE  80  74.491   1.486   5.929
  654   2HD1  ILE  80          2HD1      ILE  80  73.353   0.186   6.286
  655   3HD1  ILE  80          3HD1      ILE  80  74.584   0.630   7.468
  656    H    GLU  81           H        GLU  81  74.086   5.843   8.297
  657    HA   GLU  81           HA       GLU  81  72.078   6.839   6.329
  658   1HB   GLU  81          2HB       GLU  81  73.026   8.381   8.044
  659   2HB   GLU  81          1HB       GLU  81  74.644   8.047   7.425
  660   1HG   GLU  81          2HG       GLU  81  73.938   8.900   5.195
  661   2HG   GLU  81          1HG       GLU  81  72.362   9.301   5.868
  662    H    VAL  82           H        VAL  82  72.478   6.539   4.188
  663    HA   VAL  82           HA       VAL  82  75.047   5.215   3.441
  664    HB   VAL  82           HB       VAL  82  72.228   5.082   2.310
  665   1HG1  VAL  82          1HG1      VAL  82  74.792   3.664   1.549
  666   2HG1  VAL  82          2HG1      VAL  82  73.749   4.638   0.514
  667   3HG1  VAL  82          3HG1      VAL  82  73.196   3.066   1.093
  668   1HG2  VAL  82          1HG2      VAL  82  72.630   2.629   3.184
  669   2HG2  VAL  82          2HG2      VAL  82  72.145   3.890   4.318
  670   3HG2  VAL  82          3HG2      VAL  82  73.837   3.402   4.212
  671    H    LEU  83           H        LEU  83  76.325   6.233   2.002
  672    HA   LEU  83           HA       LEU  83  75.217   8.506   0.383
  673   1HB   LEU  83          2HB       LEU  83  78.095   7.963   1.213
  674   2HB   LEU  83          1HB       LEU  83  77.454   9.454   0.535
  675    HG   LEU  83           HG       LEU  83  76.716   8.291   3.239
  676   1HD1  LEU  83          1HD1      LEU  83  78.017  10.103   4.172
  677   2HD1  LEU  83          2HD1      LEU  83  78.306  10.783   2.570
  678   3HD1  LEU  83          3HD1      LEU  83  79.038   9.240   3.020
  679   1HD2  LEU  83          1HD2      LEU  83  74.864   9.526   2.246
  680   2HD2  LEU  83          2HD2      LEU  83  75.934  10.873   1.851
  681   3HD2  LEU  83          3HD2      LEU  83  75.578  10.493   3.537
  682    H    LEU  84           H        LEU  84  75.277   8.145  -1.834
  683    HA   LEU  84           HA       LEU  84  76.677   5.803  -2.960
  684   1HB   LEU  84          2HB       LEU  84  74.846   7.982  -3.905
  685   2HB   LEU  84          1HB       LEU  84  75.805   7.102  -5.099
  686    HG   LEU  84           HG       LEU  84  74.369   5.503  -3.027
  687   1HD1  LEU  84          1HD1      LEU  84  72.992   7.384  -4.701
  688   2HD1  LEU  84          2HD1      LEU  84  72.305   6.182  -3.615
  689   3HD1  LEU  84          3HD1      LEU  84  72.637   5.762  -5.293
  690   1HD2  LEU  84          1HD2      LEU  84  75.494   4.079  -4.434
  691   2HD2  LEU  84          2HD2      LEU  84  75.461   5.215  -5.783
  692   3HD2  LEU  84          3HD2      LEU  84  74.029   4.259  -5.399
  693    H    LEU  85           H        LEU  85  78.615   5.911  -4.098
  694    HA   LEU  85           HA       LEU  85  80.082   8.506  -3.926
  695   1HB   LEU  85          2HB       LEU  85  80.729   5.608  -3.649
  696   2HB   LEU  85          1HB       LEU  85  81.999   6.661  -4.277
  697    HG   LEU  85           HG       LEU  85  80.441   7.346  -1.781
  698   1HD1  LEU  85          1HD1      LEU  85  82.198   6.345  -0.458
  699   2HD1  LEU  85          2HD1      LEU  85  83.124   5.943  -1.904
  700   3HD1  LEU  85          3HD1      LEU  85  81.603   5.115  -1.573
  701   1HD2  LEU  85          1HD2      LEU  85  83.129   8.198  -2.907
  702   2HD2  LEU  85          2HD2      LEU  85  82.482   8.720  -1.352
  703   3HD2  LEU  85          3HD2      LEU  85  81.667   9.181  -2.847
  704    H    GLY  86           H        GLY  86  79.210   5.873  -6.140
  705   1HA   GLY  86          2HA       GLY  86  79.738   7.564  -8.473
  706   2HA   GLY  86          1HA       GLY  86  80.957   6.312  -8.266
  707    H    HIS  87           H        HIS  87  79.777   5.976 -10.538
  708    HA   HIS  87           HA       HIS  87  77.780   3.783 -10.145
  709   1HB   HIS  87          2HB       HIS  87  76.411   4.825 -11.946
  710   2HB   HIS  87          1HB       HIS  87  76.585   5.900 -10.564
  711    HD1  HIS  87           HD1      HIS  87  77.748   5.440 -14.116
  712    HD2  HIS  87           HD2      HIS  87  78.070   8.261 -11.064
  713    HE1  HIS  87           HE1      HIS  87  78.747   7.518 -15.164
  714    H    TYR  88           H        TYR  88  77.805   2.207 -11.852
  715    HA   TYR  88           HA       TYR  88  79.815   2.602 -14.029
  716   1HB   TYR  88          2HB       TYR  88  79.464   0.219 -12.182
  717   2HB   TYR  88          1HB       TYR  88  80.478   0.203 -13.626
  718    HD1  TYR  88           HD1      TYR  88  80.126   1.427 -10.155
  719    HD2  TYR  88           HD2      TYR  88  82.520   1.643 -13.788
  720    HE1  TYR  88           HE1      TYR  88  82.000   2.491  -8.858
  721    HE2  TYR  88           HE2      TYR  88  84.394   2.706 -12.491
  722    HH   TYR  88           HH       TYR  88  84.007   4.030  -9.423
  723    H    LYS  89           H        LYS  89  79.095   1.833 -16.013
  724    HA   LYS  89           HA       LYS  89  76.352   0.645 -16.092
  725   1HB   LYS  89          2HB       LYS  89  77.404   2.846 -17.294
  726   2HB   LYS  89          1HB       LYS  89  77.714   1.635 -18.539
  727   1HG   LYS  89          2HG       LYS  89  75.417   1.102 -18.756
  728   2HG   LYS  89          1HG       LYS  89  75.006   1.888 -17.231
  729   1HD   LYS  89          2HD       LYS  89  75.636   4.082 -18.219
  730   2HD   LYS  89          1HD       LYS  89  75.954   3.275 -19.755
  731   1HE   LYS  89          2HE       LYS  89  73.273   3.076 -18.352
  732   2HE   LYS  89          1HE       LYS  89  73.636   4.327 -19.558
  733   1HZ   LYS  89          1HZ       LYS  89  74.410   2.497 -21.038
  734   2HZ   LYS  89          2HZ       LYS  89  72.742   2.465 -20.717
  735   3HZ   LYS  89          3HZ       LYS  89  73.784   1.384 -19.923
  736    HA   PRO  90           HA       PRO  90  77.969  -3.310 -17.385
  737   1HB   PRO  90          2HB       PRO  90  75.630  -3.236 -19.268
  738   2HB   PRO  90          1HB       PRO  90  76.133  -4.524 -18.150
  739   1HG   PRO  90          2HG       PRO  90  74.098  -3.032 -17.494
  740   2HG   PRO  90          1HG       PRO  90  75.344  -3.366 -16.275
  741   1HD   PRO  90          2HD       PRO  90  74.937  -0.886 -17.916
  742   2HD   PRO  90          1HD       PRO  90  75.292  -1.043 -16.177
  743    H    ARG  91           H        ARG  91  79.311  -4.028 -19.072
  744    HA   ARG  91           HA       ARG  91  79.257  -2.513 -21.651
  745   1HB   ARG  91          2HB       ARG  91  81.728  -2.338 -21.484
  746   2HB   ARG  91          1HB       ARG  91  80.935  -1.539 -20.128
  747   1HG   ARG  91          2HG       ARG  91  81.257  -3.674 -18.803
  748   2HG   ARG  91          1HG       ARG  91  82.258  -4.265 -20.129
  749   1HD   ARG  91          2HD       ARG  91  83.727  -2.250 -19.867
  750   2HD   ARG  91          1HD       ARG  91  82.771  -1.789 -18.444
  751    HE   ARG  91           HE       ARG  91  83.749  -3.580 -17.250
  752   1HH1  ARG  91          1HH1      ARG  91  84.361  -3.961 -20.685
  753   2HH1  ARG  91          2HH1      ARG  91  85.436  -5.292 -20.439
  754   1HH2  ARG  91          1HH2      ARG  91  85.146  -5.302 -16.996
  755   2HH2  ARG  91          2HH2      ARG  91  85.877  -6.043 -18.380
  756    H    ASN  92           H        ASN  92  80.287  -3.702 -23.429
  757    HA   ASN  92           HA       ASN  92  80.591  -5.660 -24.715
  758   1HB   ASN  92          2HB       ASN  92  81.776  -6.476 -22.041
  759   2HB   ASN  92          1HB       ASN  92  82.038  -7.345 -23.553
  760   1HD2  ASN  92          1HD2      ASN  92  84.171  -6.063 -22.037
  761   2HD2  ASN  92          2HD2      ASN  92  84.804  -4.820 -23.005
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1  84.697  13.674   0.731
    2   2H    MET   1          2H        MET   1  83.050  13.261   0.684
    3   3H    MET   1          3H        MET   1  83.532  14.872   0.440
    4    HA   MET   1           HA       MET   1  84.671  14.225  -1.619
    5   1HB   MET   1          2HB       MET   1  83.629  11.563  -0.640
    6   2HB   MET   1          1HB       MET   1  84.080  11.813  -2.327
    7   1HG   MET   1          2HG       MET   1  86.325  12.592  -1.567
    8   2HG   MET   1          1HG       MET   1  85.870  12.188   0.089
    9   1HE   MET   1          1HE       MET   1  87.204  10.160  -3.413
   10   2HE   MET   1          2HE       MET   1  85.818  11.246  -3.378
   11   3HE   MET   1          3HE       MET   1  85.561   9.505  -3.444
   12    H    ASP   2           H        ASP   2  83.289  13.346  -3.637
   13    HA   ASP   2           HA       ASP   2  80.758  14.825  -3.620
   14   1HB   ASP   2          2HB       ASP   2  82.164  13.064  -5.656
   15   2HB   ASP   2          1HB       ASP   2  80.741  14.044  -6.006
   16    H    VAL   3           H        VAL   3  78.679  13.917  -3.649
   17    HA   VAL   3           HA       VAL   3  78.492  10.950  -3.491
   18    HB   VAL   3           HB       VAL   3  78.335  12.327  -1.312
   19   1HG1  VAL   3          1HG1      VAL   3  76.784  14.073  -2.321
   20   2HG1  VAL   3          2HG1      VAL   3  76.268  13.410  -0.769
   21   3HG1  VAL   3          3HG1      VAL   3  75.512  12.849  -2.265
   22   1HG2  VAL   3          1HG2      VAL   3  77.675  10.019  -1.341
   23   2HG2  VAL   3          2HG2      VAL   3  76.172  10.399  -2.182
   24   3HG2  VAL   3          3HG2      VAL   3  76.400  10.905  -0.507
   25    H    LEU   4           H        LEU   4  76.816  10.068  -4.696
   26    HA   LEU   4           HA       LEU   4  75.519  11.854  -6.641
   27   1HB   LEU   4          2HB       LEU   4  75.334   8.847  -6.287
   28   2HB   LEU   4          1HB       LEU   4  74.956   9.755  -7.745
   29    HG   LEU   4           HG       LEU   4  77.694   9.408  -6.472
   30   1HD1  LEU   4          1HD1      LEU   4  76.350   8.375  -8.958
   31   2HD1  LEU   4          2HD1      LEU   4  77.245   7.480  -7.728
   32   3HD1  LEU   4          3HD1      LEU   4  78.107   8.506  -8.877
   33   1HD2  LEU   4          1HD2      LEU   4  77.876  11.586  -7.304
   34   2HD2  LEU   4          2HD2      LEU   4  76.707  11.295  -8.598
   35   3HD2  LEU   4          3HD2      LEU   4  78.339  10.640  -8.724
   36    H    ALA   5           H        ALA   5  74.658  10.231  -3.671
   37    HA   ALA   5           HA       ALA   5  72.119  11.592  -3.525
   38   1HB   ALA   5          1HB       ALA   5  72.000   9.455  -5.173
   39   2HB   ALA   5          2HB       ALA   5  70.638   9.939  -4.162
   40   3HB   ALA   5          3HB       ALA   5  71.709   8.639  -3.637
   41    H    LYS   6           H        LYS   6  71.079  11.174  -1.437
   42    HA   LYS   6           HA       LYS   6  72.715   9.545   0.481
   43   1HB   LYS   6          2HB       LYS   6  73.248  11.973   0.585
   44   2HB   LYS   6          1HB       LYS   6  71.546  12.321   0.881
   45   1HG   LYS   6          2HG       LYS   6  71.702  10.788   2.905
   46   2HG   LYS   6          1HG       LYS   6  73.448  10.785   2.664
   47   1HD   LYS   6          2HD       LYS   6  71.803  13.309   2.979
   48   2HD   LYS   6          1HD       LYS   6  72.645  12.517   4.311
   49   1HE   LYS   6          2HE       LYS   6  74.786  12.935   3.351
   50   2HE   LYS   6          1HE       LYS   6  74.082  13.346   1.775
   51   1HZ   LYS   6          1HZ       LYS   6  73.022  15.248   2.715
   52   2HZ   LYS   6          2HZ       LYS   6  74.664  15.317   3.146
   53   3HZ   LYS   6          3HZ       LYS   6  73.504  14.823   4.285
   54    H    PHE   7           H        PHE   7  71.411   8.110   1.562
   55    HA   PHE   7           HA       PHE   7  68.648   8.908   2.295
   56   1HB   PHE   7          2HB       PHE   7  67.704   6.914   1.201
   57   2HB   PHE   7          1HB       PHE   7  68.546   7.924   0.029
   58    HD1  PHE   7           HD1      PHE   7  68.259   4.613   1.439
   59    HD2  PHE   7           HD2      PHE   7  71.048   7.330  -0.515
   60    HE1  PHE   7           HE1      PHE   7  69.713   2.662   0.799
   61    HE2  PHE   7           HE2      PHE   7  72.501   5.378  -1.150
   62    HZ   PHE   7           HZ       PHE   7  71.834   3.041  -0.487
   63    H    HIS   8           H        HIS   8  67.686   7.351   3.866
   64    HA   HIS   8           HA       HIS   8  69.831   6.047   5.519
   65   1HB   HIS   8          2HB       HIS   8  67.142   7.291   6.196
   66   2HB   HIS   8          1HB       HIS   8  68.223   6.550   7.375
   67    HD1  HIS   8           HD1      HIS   8  67.846   9.570   5.187
   68    HD2  HIS   8           HD2      HIS   8  70.581   8.057   7.946
   69    HE1  HIS   8           HE1      HIS   8  69.450  11.458   5.713
   70    H    THR   9           H        THR   9  69.571   3.912   6.092
   71    HA   THR   9           HA       THR   9  66.944   2.579   5.845
   72    HB   THR   9           HB       THR   9  68.058   2.533   3.581
   73    HG1  THR   9           HG1      THR   9  66.654   0.856   4.347
   74   1HG2  THR   9          1HG2      THR   9  70.106   0.817   5.012
   75   2HG2  THR   9          2HG2      THR   9  70.401   2.427   4.353
   76   3HG2  THR   9          3HG2      THR   9  70.026   1.085   3.271
   77    H    THR  10           H        THR  10  67.053   0.349   6.851
   78    HA   THR  10           HA       THR  10  69.291   0.191   8.832
   79    HB   THR  10           HB       THR  10  66.883   0.590   9.616
   80    HG1  THR  10           HG1      THR  10  67.616  -0.246  11.358
   81   1HG2  THR  10          1HG2      THR  10  66.266  -1.534   7.951
   82   2HG2  THR  10          2HG2      THR  10  65.222  -0.895   9.221
   83   3HG2  THR  10          3HG2      THR  10  66.278  -2.271   9.555
   84    H    VAL  11           H        VAL  11  70.003  -2.015   9.393
   85    HA   VAL  11           HA       VAL  11  70.426  -3.603   6.984
   86    HB   VAL  11           HB       VAL  11  71.167  -4.071   9.896
   87   1HG1  VAL  11          1HG1      VAL  11  72.164  -5.295   7.306
   88   2HG1  VAL  11          2HG1      VAL  11  71.390  -6.132   8.652
   89   3HG1  VAL  11          3HG1      VAL  11  73.007  -5.456   8.846
   90   1HG2  VAL  11          1HG2      VAL  11  72.203  -2.275   7.800
   91   2HG2  VAL  11          2HG2      VAL  11  73.446  -3.283   8.537
   92   3HG2  VAL  11          3HG2      VAL  11  72.455  -2.230   9.545
   93    H    HIS  12           H        HIS  12  69.429  -5.476   6.413
   94    HA   HIS  12           HA       HIS  12  67.500  -6.730   8.335
   95   1HB   HIS  12          2HB       HIS  12  67.429  -6.200   5.381
   96   2HB   HIS  12          1HB       HIS  12  66.571  -7.608   6.017
   97    HD1  HIS  12           HD1      HIS  12  66.886  -3.912   6.975
   98    HD2  HIS  12           HD2      HIS  12  64.015  -6.927   6.772
   99    HE1  HIS  12           HE1      HIS  12  64.698  -2.867   7.702
  100    H    ARG  13           H        ARG  13  67.212  -9.130   7.750
  101    HA   ARG  13           HA       ARG  13  69.451 -10.626   8.341
  102   1HB   ARG  13          2HB       ARG  13  67.040 -11.253   6.628
  103   2HB   ARG  13          1HB       ARG  13  68.151 -12.502   7.200
  104   1HG   ARG  13          2HG       ARG  13  67.732 -11.738   9.543
  105   2HG   ARG  13          1HG       ARG  13  66.538 -10.597   8.924
  106   1HD   ARG  13          2HD       ARG  13  65.321 -12.556   7.881
  107   2HD   ARG  13          1HD       ARG  13  66.431 -13.626   8.760
  108    HE   ARG  13           HE       ARG  13  65.576 -11.952  10.747
  109   1HH1  ARG  13          1HH1      ARG  13  63.819 -13.791   8.328
  110   2HH1  ARG  13          2HH1      ARG  13  62.423 -13.956   9.333
  111   1HH2  ARG  13          1HH2      ARG  13  63.746 -12.199  11.999
  112   2HH2  ARG  13          2HH2      ARG  13  62.380 -13.069  11.384
  113    H    ILE  14           H        ILE  14  70.973 -11.880   7.158
  114    HA   ILE  14           HA       ILE  14  72.547 -12.329   5.473
  115    HB   ILE  14           HB       ILE  14  70.395 -11.284   3.602
  116   1HG1  ILE  14          2HG1      ILE  14  70.914 -14.163   4.390
  117   2HG1  ILE  14          1HG1      ILE  14  69.695 -13.169   5.191
  118   1HG2  ILE  14          1HG2      ILE  14  72.233 -11.517   2.237
  119   2HG2  ILE  14          2HG2      ILE  14  71.658 -13.184   2.218
  120   3HG2  ILE  14          3HG2      ILE  14  72.987 -12.722   3.281
  121   1HD1  ILE  14          1HD1      ILE  14  69.723 -14.263   2.419
  122   2HD1  ILE  14          2HD1      ILE  14  69.009 -12.665   2.647
  123   3HD1  ILE  14          3HD1      ILE  14  68.370 -14.053   3.530
  124    H    GLY  15           H        GLY  15  71.760  -9.264   6.417
  125   1HA   GLY  15          2HA       GLY  15  73.040  -7.297   6.250
  126   2HA   GLY  15          1HA       GLY  15  74.092  -8.128   5.109
  127    H    ARG  16           H        ARG  16  70.728  -8.286   4.314
  128    HA   ARG  16           HA       ARG  16  71.214  -6.699   1.896
  129   1HB   ARG  16          2HB       ARG  16  69.980  -8.854   1.937
  130   2HB   ARG  16          1HB       ARG  16  68.760  -8.126   2.981
  131   1HG   ARG  16          2HG       ARG  16  68.204  -6.494   1.232
  132   2HG   ARG  16          1HG       ARG  16  69.456  -7.165   0.188
  133   1HD   ARG  16          2HD       ARG  16  67.334  -8.134  -0.494
  134   2HD   ARG  16          1HD       ARG  16  68.243  -9.401   0.354
  135    HE   ARG  16           HE       ARG  16  66.565  -7.768   2.118
  136   1HH1  ARG  16          1HH1      ARG  16  66.693 -10.634   0.095
  137   2HH1  ARG  16          2HH1      ARG  16  65.391 -11.398   0.936
  138   1HH2  ARG  16          1HH2      ARG  16  64.892  -8.804   3.164
  139   2HH2  ARG  16          2HH2      ARG  16  64.383 -10.378   2.651
  140    H    ILE  17           H        ILE  17  70.218  -4.731   1.400
  141    HA   ILE  17           HA       ILE  17  68.333  -3.562   3.394
  142    HB   ILE  17           HB       ILE  17  69.486  -1.383   3.144
  143   1HG1  ILE  17          2HG1      ILE  17  71.620  -2.883   1.598
  144   2HG1  ILE  17          1HG1      ILE  17  70.365  -1.927   0.815
  145   1HG2  ILE  17          1HG2      ILE  17  71.520  -1.935   4.392
  146   2HG2  ILE  17          2HG2      ILE  17  71.407  -3.615   3.867
  147   3HG2  ILE  17          3HG2      ILE  17  70.183  -2.943   4.944
  148   1HD1  ILE  17          1HD1      ILE  17  71.656  -0.101   1.102
  149   2HD1  ILE  17          2HD1      ILE  17  72.817  -1.026   2.055
  150   3HD1  ILE  17          3HD1      ILE  17  71.435  -0.268   2.845
  151    H    ILE  18           H        ILE  18  66.818  -2.037   2.382
  152    HA   ILE  18           HA       ILE  18  66.705  -2.280  -0.611
  153    HB   ILE  18           HB       ILE  18  64.446  -1.855   1.375
  154   1HG1  ILE  18          2HG1      ILE  18  65.397  -4.110   1.638
  155   2HG1  ILE  18          1HG1      ILE  18  63.822  -4.207   0.854
  156   1HG2  ILE  18          1HG2      ILE  18  63.188  -2.693  -0.792
  157   2HG2  ILE  18          2HG2      ILE  18  64.628  -2.086  -1.611
  158   3HG2  ILE  18          3HG2      ILE  18  63.646  -0.996  -0.630
  159   1HD1  ILE  18          1HD1      ILE  18  65.411  -3.992  -1.332
  160   2HD1  ILE  18          2HD1      ILE  18  64.962  -5.540  -0.617
  161   3HD1  ILE  18          3HD1      ILE  18  66.520  -4.809  -0.232
  162    H    ILE  19           H        ILE  19  66.920  -0.370  -1.682
  163    HA   ILE  19           HA       ILE  19  67.004   2.184  -0.213
  164    HB   ILE  19           HB       ILE  19  67.144   1.514  -3.188
  165   1HG1  ILE  19          2HG1      ILE  19  69.292   1.874  -1.053
  166   2HG1  ILE  19          1HG1      ILE  19  68.924   0.392  -1.925
  167   1HG2  ILE  19          1HG2      ILE  19  68.121   3.990  -1.718
  168   2HG2  ILE  19          2HG2      ILE  19  66.556   3.903  -2.529
  169   3HG2  ILE  19          3HG2      ILE  19  68.044   3.739  -3.462
  170   1HD1  ILE  19          1HD1      ILE  19  70.447   0.989  -3.468
  171   2HD1  ILE  19          2HD1      ILE  19  70.680   2.550  -2.680
  172   3HD1  ILE  19          3HD1      ILE  19  69.419   2.358  -3.899
  173    HA   PRO  20           HA       PRO  20  62.669   3.132  -0.869
  174   1HB   PRO  20          2HB       PRO  20  62.842   5.866  -0.946
  175   2HB   PRO  20          1HB       PRO  20  62.907   4.945   0.567
  176   1HG   PRO  20          2HG       PRO  20  65.179   5.955  -1.111
  177   2HG   PRO  20          1HG       PRO  20  64.926   6.140   0.637
  178   1HD   PRO  20          2HD       PRO  20  66.564   4.264  -0.239
  179   2HD   PRO  20          1HD       PRO  20  65.408   3.874   1.063
  180    H    ALA  21           H        ALA  21  61.453   3.512  -2.725
  181    HA   ALA  21           HA       ALA  21  62.668   3.404  -5.279
  182   1HB   ALA  21          1HB       ALA  21  60.246   4.321  -5.898
  183   2HB   ALA  21          2HB       ALA  21  59.956   4.058  -4.178
  184   3HB   ALA  21          3HB       ALA  21  60.448   2.711  -5.205
  185    H    GLY  22           H        GLY  22  61.861   6.175  -3.262
  186   1HA   GLY  22          2HA       GLY  22  61.898   8.197  -5.311
  187   2HA   GLY  22          1HA       GLY  22  62.190   8.485  -3.594
  188    H    THR  23           H        THR  23  64.477   6.902  -3.203
  189    HA   THR  23           HA       THR  23  66.543   8.649  -4.229
  190    HB   THR  23           HB       THR  23  66.701   5.927  -2.889
  191    HG1  THR  23           HG1      THR  23  66.806   8.543  -1.801
  192   1HG2  THR  23          1HG2      THR  23  68.891   7.322  -2.079
  193   2HG2  THR  23          2HG2      THR  23  68.709   7.943  -3.721
  194   3HG2  THR  23          3HG2      THR  23  68.897   6.210  -3.448
  195    H    ARG  24           H        ARG  24  65.442   5.368  -5.106
  196    HA   ARG  24           HA       ARG  24  67.461   4.683  -7.021
  197   1HB   ARG  24          2HB       ARG  24  64.504   4.136  -7.387
  198   2HB   ARG  24          1HB       ARG  24  65.855   3.137  -7.902
  199   1HG   ARG  24          2HG       ARG  24  66.360   3.045  -5.304
  200   2HG   ARG  24          1HG       ARG  24  64.649   3.438  -5.186
  201   1HD   ARG  24          2HD       ARG  24  64.441   1.492  -7.005
  202   2HD   ARG  24          1HD       ARG  24  65.942   0.961  -6.213
  203    HE   ARG  24           HE       ARG  24  64.387   1.557  -4.064
  204   1HH1  ARG  24          1HH1      ARG  24  63.709  -0.353  -6.927
  205   2HH1  ARG  24          2HH1      ARG  24  62.559  -1.342  -6.101
  206   1HH2  ARG  24          1HH2      ARG  24  62.914   0.252  -3.055
  207   2HH2  ARG  24          2HH2      ARG  24  62.109  -1.006  -3.932
  208    H    LYS  25           H        LYS  25  64.502   6.598  -7.323
  209    HA   LYS  25           HA       LYS  25  64.568   7.010 -10.154
  210   1HB   LYS  25          2HB       LYS  25  62.622   7.345  -8.644
  211   2HB   LYS  25          1HB       LYS  25  63.439   8.726  -7.912
  212   1HG   LYS  25          2HG       LYS  25  63.476   9.859 -10.102
  213   2HG   LYS  25          1HG       LYS  25  62.637   8.486 -10.824
  214   1HD   LYS  25          2HD       LYS  25  60.768   8.848  -9.187
  215   2HD   LYS  25          1HD       LYS  25  61.586  10.315  -8.648
  216   1HE   LYS  25          2HE       LYS  25  61.493  11.188 -10.993
  217   2HE   LYS  25          1HE       LYS  25  60.551   9.755 -11.450
  218   1HZ   LYS  25          1HZ       LYS  25  59.027  11.480 -10.844
  219   2HZ   LYS  25          2HZ       LYS  25  59.846  11.771  -9.384
  220   3HZ   LYS  25          3HZ       LYS  25  59.005  10.313  -9.615
  221    H    PHE  26           H        PHE  26  65.645   9.124  -7.482
  222    HA   PHE  26           HA       PHE  26  66.660  11.279  -9.032
  223   1HB   PHE  26          2HB       PHE  26  66.286  11.224  -6.568
  224   2HB   PHE  26          1HB       PHE  26  67.679  10.156  -6.401
  225    HD1  PHE  26           HD1      PHE  26  69.915  11.015  -6.319
  226    HD2  PHE  26           HD2      PHE  26  66.624  13.564  -7.607
  227    HE1  PHE  26           HE1      PHE  26  71.446  13.012  -6.287
  228    HE2  PHE  26           HE2      PHE  26  68.155  15.559  -7.573
  229    HZ   PHE  26           HZ       PHE  26  70.566  15.283  -6.913
  230    H    TYR  27           H        TYR  27  68.238   8.276  -7.992
  231    HA   TYR  27           HA       TYR  27  70.827   9.049  -9.166
  232   1HB   TYR  27          2HB       TYR  27  70.501   7.821  -7.025
  233   2HB   TYR  27          1HB       TYR  27  69.812   6.478  -7.916
  234    HD1  TYR  27           HD1      TYR  27  72.837   7.965  -6.648
  235    HD2  TYR  27           HD2      TYR  27  71.309   5.388  -9.807
  236    HE1  TYR  27           HE1      TYR  27  75.137   7.002  -6.987
  237    HE2  TYR  27           HE2      TYR  27  73.604   4.429 -10.139
  238    HH   TYR  27           HH       TYR  27  76.035   4.663  -7.948
  239    H    GLY  28           H        GLY  28  67.974   7.422 -10.321
  240   1HA   GLY  28          2HA       GLY  28  67.552   6.560 -12.468
  241   2HA   GLY  28          1HA       GLY  28  69.212   6.968 -12.906
  242    H    ILE  29           H        ILE  29  68.069   4.843 -10.277
  243    HA   ILE  29           HA       ILE  29  70.005   2.784 -11.109
  244    HB   ILE  29           HB       ILE  29  67.997   2.915  -8.827
  245   1HG1  ILE  29          2HG1      ILE  29  70.965   3.541  -8.871
  246   2HG1  ILE  29          1HG1      ILE  29  69.685   4.748  -8.844
  247   1HG2  ILE  29          1HG2      ILE  29  70.472   1.326  -8.540
  248   2HG2  ILE  29          2HG2      ILE  29  69.331   0.687  -9.722
  249   3HG2  ILE  29          3HG2      ILE  29  68.823   0.940  -8.053
  250   1HD1  ILE  29          1HD1      ILE  29  69.881   4.627  -6.585
  251   2HD1  ILE  29          2HD1      ILE  29  70.744   3.088  -6.657
  252   3HD1  ILE  29          3HD1      ILE  29  68.980   3.118  -6.735
  253    H    GLU  30           H        GLU  30  69.479   1.103 -12.395
  254    HA   GLU  30           HA       GLU  30  66.678   0.047 -12.338
  255   1HB   GLU  30          2HB       GLU  30  68.543   0.348 -14.721
  256   2HB   GLU  30          1HB       GLU  30  66.958  -0.425 -14.768
  257   1HG   GLU  30          2HG       GLU  30  65.925   1.707 -14.003
  258   2HG   GLU  30          1HG       GLU  30  67.511   2.470 -14.050
  259    H    GLN  31           H        GLN  31  66.632  -2.317 -12.794
  260    HA   GLN  31           HA       GLN  31  68.554  -3.824 -11.353
  261   1HB   GLN  31          2HB       GLN  31  66.620  -4.577 -13.567
  262   2HB   GLN  31          1HB       GLN  31  67.460  -5.757 -12.561
  263   1HG   GLN  31          2HG       GLN  31  66.439  -4.823 -10.547
  264   2HG   GLN  31          1HG       GLN  31  65.658  -3.561 -11.499
  265   1HE2  GLN  31          1HE2      GLN  31  63.792  -4.890 -10.194
  266   2HE2  GLN  31          2HE2      GLN  31  63.031  -6.091 -11.123
  267    H    GLY  32           H        GLY  32  70.472  -4.814 -11.926
  268   1HA   GLY  32          2HA       GLY  32  72.042  -5.810 -13.445
  269   2HA   GLY  32          1HA       GLY  32  71.220  -5.015 -14.784
  270    H    ASP  33           H        ASP  33  71.359  -2.443 -12.912
  271    HA   ASP  33           HA       ASP  33  73.858  -1.416 -14.056
  272   1HB   ASP  33          2HB       ASP  33  71.803  -0.334 -12.105
  273   2HB   ASP  33          1HB       ASP  33  73.141   0.617 -12.745
  274    H    PHE  34           H        PHE  34  75.665  -0.628 -12.742
  275    HA   PHE  34           HA       PHE  34  75.885  -1.963 -10.062
  276   1HB   PHE  34          2HB       PHE  34  77.914  -1.161 -12.167
  277   2HB   PHE  34          1HB       PHE  34  78.371  -1.667 -10.541
  278    HD1  PHE  34           HD1      PHE  34  76.830  -2.751 -13.761
  279    HD2  PHE  34           HD2      PHE  34  78.146  -3.993  -9.797
  280    HE1  PHE  34           HE1      PHE  34  76.632  -5.161 -14.451
  281    HE2  PHE  34           HE2      PHE  34  77.947  -6.405 -10.488
  282    HZ   PHE  34           HZ       PHE  34  77.189  -6.988 -12.814
  283    H    VAL  35           H        VAL  35  76.293  -0.620  -8.317
  284    HA   VAL  35           HA       VAL  35  77.012   2.228  -8.890
  285    HB   VAL  35           HB       VAL  35  75.444   2.881  -7.071
  286   1HG1  VAL  35          1HG1      VAL  35  74.068   1.157  -9.153
  287   2HG1  VAL  35          2HG1      VAL  35  74.733   2.755  -9.490
  288   3HG1  VAL  35          3HG1      VAL  35  73.408   2.576  -8.340
  289   1HG2  VAL  35          1HG2      VAL  35  73.773   1.128  -6.338
  290   2HG2  VAL  35          2HG2      VAL  35  75.410   0.871  -5.728
  291   3HG2  VAL  35          3HG2      VAL  35  74.814  -0.086  -7.085
  292    H    GLU  36           H        GLU  36  78.267   3.212  -7.157
  293    HA   GLU  36           HA       GLU  36  79.594   1.200  -5.366
  294   1HB   GLU  36          2HB       GLU  36  80.950   2.205  -7.233
  295   2HB   GLU  36          1HB       GLU  36  80.658   3.798  -6.534
  296   1HG   GLU  36          2HG       GLU  36  81.711   3.020  -4.410
  297   2HG   GLU  36          1HG       GLU  36  82.080   1.483  -5.186
  298    H    ILE  37           H        ILE  37  79.119   1.546  -3.265
  299    HA   ILE  37           HA       ILE  37  78.225   4.281  -2.444
  300    HB   ILE  37           HB       ILE  37  76.393   2.795  -3.165
  301   1HG1  ILE  37          2HG1      ILE  37  76.228   2.870  -0.163
  302   2HG1  ILE  37          1HG1      ILE  37  76.282   4.373  -1.083
  303   1HG2  ILE  37          1HG2      ILE  37  77.435   0.953  -0.991
  304   2HG2  ILE  37          2HG2      ILE  37  77.427   0.629  -2.726
  305   3HG2  ILE  37          3HG2      ILE  37  75.905   0.740  -1.842
  306   1HD1  ILE  37          1HD1      ILE  37  74.060   4.155  -1.395
  307   2HD1  ILE  37          2HD1      ILE  37  74.068   2.524  -0.730
  308   3HD1  ILE  37          3HD1      ILE  37  74.404   2.780  -2.442
  309    H    LYS  38           H        LYS  38  78.240   4.622  -0.103
  310    HA   LYS  38           HA       LYS  38  79.902   2.690   1.463
  311   1HB   LYS  38          2HB       LYS  38  81.126   4.727   0.514
  312   2HB   LYS  38          1HB       LYS  38  80.132   5.706   1.600
  313   1HG   LYS  38          2HG       LYS  38  80.959   4.437   3.530
  314   2HG   LYS  38          1HG       LYS  38  81.922   3.416   2.459
  315   1HD   LYS  38          2HD       LYS  38  83.130   5.472   1.681
  316   2HD   LYS  38          1HD       LYS  38  82.245   6.401   2.892
  317   1HE   LYS  38          2HE       LYS  38  83.498   5.572   4.623
  318   2HE   LYS  38          1HE       LYS  38  83.604   3.956   3.897
  319   1HZ   LYS  38          1HZ       LYS  38  85.081   6.390   3.047
  320   2HZ   LYS  38          2HZ       LYS  38  85.074   4.928   2.181
  321   3HZ   LYS  38          3HZ       LYS  38  85.745   4.993   3.741
  322    H    ILE  39           H        ILE  39  79.311   2.518   3.654
  323    HA   ILE  39           HA       ILE  39  76.857   4.043   4.482
  324    HB   ILE  39           HB       ILE  39  76.440   2.044   5.932
  325   1HG1  ILE  39          2HG1      ILE  39  78.681   0.727   4.378
  326   2HG1  ILE  39          1HG1      ILE  39  78.918   1.411   5.987
  327   1HG2  ILE  39          1HG2      ILE  39  76.329   0.440   3.746
  328   2HG2  ILE  39          2HG2      ILE  39  76.530   2.013   2.973
  329   3HG2  ILE  39          3HG2      ILE  39  75.176   1.734   4.071
  330   1HD1  ILE  39          1HD1      ILE  39  77.384  -1.007   5.162
  331   2HD1  ILE  39          2HD1      ILE  39  76.730  -0.054   6.494
  332   3HD1  ILE  39          3HD1      ILE  39  78.356  -0.730   6.607
  333    H    VAL  40           H        VAL  40  76.784   4.817   6.640
  334    HA   VAL  40           HA       VAL  40  79.251   4.541   8.296
  335    HB   VAL  40           HB       VAL  40  77.810   7.128   7.603
  336   1HG1  VAL  40          1HG1      VAL  40  78.639   7.378   9.817
  337   2HG1  VAL  40          2HG1      VAL  40  79.890   8.088   8.797
  338   3HG1  VAL  40          3HG1      VAL  40  80.107   6.468   9.458
  339   1HG2  VAL  40          1HG2      VAL  40  80.589   6.137   6.868
  340   2HG2  VAL  40          2HG2      VAL  40  79.910   7.710   6.445
  341   3HG2  VAL  40          3HG2      VAL  40  79.218   6.239   5.761
  342    H    LYS  41           H        LYS  41  78.667   3.991  10.338
  343    HA   LYS  41           HA       LYS  41  76.094   4.996  11.460
  344   1HB   LYS  41          2HB       LYS  41  75.734   2.717  10.593
  345   2HB   LYS  41          1HB       LYS  41  77.111   2.136  11.524
  346   1HG   LYS  41          2HG       LYS  41  75.032   1.622  12.717
  347   2HG   LYS  41          1HG       LYS  41  75.958   2.820  13.620
  348   1HD   LYS  41          2HD       LYS  41  74.544   4.602  12.896
  349   2HD   LYS  41          1HD       LYS  41  73.785   3.597  11.666
  350   1HE   LYS  41          2HE       LYS  41  72.445   2.485  13.206
  351   2HE   LYS  41          1HE       LYS  41  73.608   2.712  14.528
  352   1HZ   LYS  41          1HZ       LYS  41  71.690   4.208  14.733
  353   2HZ   LYS  41          2HZ       LYS  41  72.060   4.888  13.221
  354   3HZ   LYS  41          3HZ       LYS  41  73.137   5.066  14.523
  355    H    TYR  42           H        TYR  42  76.205   5.366  13.696
  356    HA   TYR  42           HA       TYR  42  78.974   5.428  14.802
  357   1HB   TYR  42          2HB       TYR  42  77.457   7.460  14.552
  358   2HB   TYR  42          1HB       TYR  42  76.450   6.758  15.819
  359    HD1  TYR  42           HD1      TYR  42  79.912   7.980  15.032
  360    HD2  TYR  42           HD2      TYR  42  77.072   6.890  18.149
  361    HE1  TYR  42           HE1      TYR  42  81.470   8.908  16.772
  362    HE2  TYR  42           HE2      TYR  42  78.630   7.818  19.892
  363    HH   TYR  42           HH       TYR  42  81.192   9.855  19.195
  364    H    GLU  43           H        GLU  43  79.543   4.055  16.446
  365    HA   GLU  43           HA       GLU  43  77.368   2.892  18.151
  366   1HB   GLU  43          2HB       GLU  43  79.774   1.500  16.927
  367   2HB   GLU  43          1HB       GLU  43  78.637   0.749  18.046
  368   1HG   GLU  43          2HG       GLU  43  76.790   1.232  16.442
  369   2HG   GLU  43          1HG       GLU  43  77.976   1.876  15.309
  370    H    GLY  44           H        GLY  44  77.824   3.085  20.314
  371   1HA   GLY  44          2HA       GLY  44  78.977   3.629  22.282
  372   2HA   GLY  44          1HA       GLY  44  80.410   2.941  21.516
  373    H    GLU  45           H        GLU  45  82.017   4.421  21.618
  374    HA   GLU  45           HA       GLU  45  81.367   7.301  21.159
  375   1HB   GLU  45          2HB       GLU  45  83.462   7.732  22.341
  376   2HB   GLU  45          1HB       GLU  45  82.474   6.623  23.285
  377   1HG   GLU  45          2HG       GLU  45  83.789   4.712  22.423
  378   2HG   GLU  45          1HG       GLU  45  84.774   5.821  21.471
  379    H    GLU  46           H        GLU  46  82.106   4.870  19.170
  380    HA   GLU  46           HA       GLU  46  84.063   6.492  17.592
  381   1HB   GLU  46          2HB       GLU  46  85.149   4.361  16.991
  382   2HB   GLU  46          1HB       GLU  46  85.121   4.586  18.737
  383   1HG   GLU  46          2HG       GLU  46  82.720   3.259  18.207
  384   2HG   GLU  46          1HG       GLU  46  83.865   2.500  17.107
  385    HA   PRO  47           HA       PRO  47  80.913   5.711  14.433
  386   1HB   PRO  47          2HB       PRO  47  82.522   7.194  12.536
  387   2HB   PRO  47          1HB       PRO  47  81.001   7.682  13.301
  388   1HG   PRO  47          2HG       PRO  47  83.454   8.829  13.786
  389   2HG   PRO  47          1HG       PRO  47  82.051   8.925  14.857
  390   1HD   PRO  47          2HD       PRO  47  84.483   7.239  15.082
  391   2HD   PRO  47          1HD       PRO  47  83.463   7.943  16.357
  392    H    LYS  48           H        LYS  48  80.867   4.064  12.891
  393    HA   LYS  48           HA       LYS  48  83.489   3.061  11.842
  394   1HB   LYS  48          2HB       LYS  48  80.951   1.583  12.588
  395   2HB   LYS  48          1HB       LYS  48  82.307   0.837  11.739
  396   1HG   LYS  48          2HG       LYS  48  83.698   1.880  13.742
  397   2HG   LYS  48          1HG       LYS  48  82.139   1.796  14.565
  398   1HD   LYS  48          2HD       LYS  48  81.962  -0.596  13.968
  399   2HD   LYS  48          1HD       LYS  48  83.541  -0.506  13.185
  400   1HE   LYS  48          2HE       LYS  48  83.996  -1.360  15.373
  401   2HE   LYS  48          1HE       LYS  48  84.400   0.365  15.482
  402   1HZ   LYS  48          1HZ       LYS  48  82.284   0.850  16.393
  403   2HZ   LYS  48          2HZ       LYS  48  82.880  -0.476  17.272
  404   3HZ   LYS  48          3HZ       LYS  48  81.698  -0.708  16.073
  405    H    GLU  49           H        GLU  49  83.475   2.403   9.634
  406    HA   GLU  49           HA       GLU  49  81.043   3.098   8.040
  407   1HB   GLU  49          2HB       GLU  49  82.508   4.423   6.532
  408   2HB   GLU  49          1HB       GLU  49  82.510   5.068   8.172
  409   1HG   GLU  49          2HG       GLU  49  84.613   3.772   8.617
  410   2HG   GLU  49          1HG       GLU  49  84.635   3.307   6.917
  411    H    GLY  50           H        GLY  50  81.333   2.366   5.713
  412   1HA   GLY  50          2HA       GLY  50  83.347   0.309   5.179
  413   2HA   GLY  50          1HA       GLY  50  81.705  -0.315   5.348
  414    H    THR  51           H        THR  51  83.696   0.204   2.977
  415    HA   THR  51           HA       THR  51  81.655   1.504   1.193
  416    HB   THR  51           HB       THR  51  84.625   1.419   0.656
  417    HG1  THR  51           HG1      THR  51  84.979   2.906   2.087
  418   1HG2  THR  51          1HG2      THR  51  82.903   3.750   0.020
  419   2HG2  THR  51          2HG2      THR  51  82.551   2.263  -0.864
  420   3HG2  THR  51          3HG2      THR  51  84.161   2.981  -0.947
  421    H    PHE  52           H        PHE  52  81.080   0.301  -0.623
  422    HA   PHE  52           HA       PHE  52  82.868  -1.795  -1.640
  423   1HB   PHE  52          2HB       PHE  52  81.442  -3.659  -1.135
  424   2HB   PHE  52          1HB       PHE  52  81.593  -2.741   0.356
  425    HD1  PHE  52           HD1      PHE  52  79.320  -4.204  -2.013
  426    HD2  PHE  52           HD2      PHE  52  79.690  -0.961   0.871
  427    HE1  PHE  52           HE1      PHE  52  76.819  -3.993  -1.934
  428    HE2  PHE  52           HE2      PHE  52  77.182  -0.751   0.952
  429    HZ   PHE  52           HZ       PHE  52  75.749  -2.269  -0.459
  430    H    THR  53           H        THR  53  81.727  -2.961  -3.555
  431    HA   THR  53           HA       THR  53  80.015  -1.006  -5.054
  432    HB   THR  53           HB       THR  53  81.750  -3.304  -6.027
  433    HG1  THR  53           HG1      THR  53  83.308  -1.905  -6.119
  434   1HG2  THR  53          1HG2      THR  53  80.105  -1.187  -7.410
  435   2HG2  THR  53          2HG2      THR  53  80.079  -2.932  -7.662
  436   3HG2  THR  53          3HG2      THR  53  81.454  -1.979  -8.222
  437    H    ALA  54           H        ALA  54  78.010  -1.743  -5.798
  438    HA   ALA  54           HA       ALA  54  77.275  -4.593  -5.286
  439   1HB   ALA  54          1HB       ALA  54  75.801  -3.992  -3.651
  440   2HB   ALA  54          2HB       ALA  54  75.269  -2.565  -4.539
  441   3HB   ALA  54          3HB       ALA  54  76.741  -2.502  -3.572
  442    H    ARG  55           H        ARG  55  75.669  -5.393  -6.659
  443    HA   ARG  55           HA       ARG  55  74.922  -3.696  -8.988
  444   1HB   ARG  55          2HB       ARG  55  75.889  -6.062  -9.126
  445   2HB   ARG  55          1HB       ARG  55  74.352  -6.625  -8.468
  446   1HG   ARG  55          2HG       ARG  55  73.184  -5.442 -10.351
  447   2HG   ARG  55          1HG       ARG  55  74.766  -5.085 -11.045
  448   1HD   ARG  55          2HD       ARG  55  75.233  -7.590 -11.004
  449   2HD   ARG  55          1HD       ARG  55  73.518  -7.814 -10.609
  450    HE   ARG  55           HE       ARG  55  73.983  -6.047 -12.900
  451   1HH1  ARG  55          1HH1      ARG  55  73.463  -9.362 -11.867
  452   2HH1  ARG  55          2HH1      ARG  55  72.873  -9.849 -13.416
  453   1HH2  ARG  55          1HH2      ARG  55  73.214  -6.735 -14.877
  454   2HH2  ARG  55          2HH2      ARG  55  72.734  -8.384 -15.099
  455    H    VAL  56           H        VAL  56  72.739  -3.248  -9.450
  456    HA   VAL  56           HA       VAL  56  70.899  -3.221  -7.178
  457    HB   VAL  56           HB       VAL  56  70.645  -2.428 -10.100
  458   1HG1  VAL  56          1HG1      VAL  56  68.900  -1.051  -8.190
  459   2HG1  VAL  56          2HG1      VAL  56  68.568  -2.781  -8.250
  460   3HG1  VAL  56          3HG1      VAL  56  68.498  -1.816  -9.727
  461   1HG2  VAL  56          1HG2      VAL  56  72.356  -1.309  -8.484
  462   2HG2  VAL  56          2HG2      VAL  56  70.932  -0.595  -7.727
  463   3HG2  VAL  56          3HG2      VAL  56  71.287  -0.267  -9.424
  464    H    GLY  57           H        GLY  57  69.506  -4.814  -6.706
  465   1HA   GLY  57          2HA       GLY  57  68.884  -6.870  -8.776
  466   2HA   GLY  57          1HA       GLY  57  68.741  -7.117  -7.036
  467    H    GLU  58           H        GLU  58  66.556  -7.878  -7.770
  468    HA   GLU  58           HA       GLU  58  64.554  -6.140  -8.836
  469   1HB   GLU  58          2HB       GLU  58  64.480  -8.641  -8.610
  470   2HB   GLU  58          1HB       GLU  58  64.254  -8.438  -6.872
  471   1HG   GLU  58          2HG       GLU  58  62.201  -7.108  -7.321
  472   2HG   GLU  58          1HG       GLU  58  62.409  -7.399  -9.044
  473    H    GLN  59           H        GLN  59  62.889  -4.964  -7.742
  474    HA   GLN  59           HA       GLN  59  62.080  -3.443  -6.138
  475   1HB   GLN  59          2HB       GLN  59  63.057  -5.807  -4.536
  476   2HB   GLN  59          1HB       GLN  59  62.252  -4.439  -3.764
  477   1HG   GLN  59          2HG       GLN  59  60.293  -4.744  -5.201
  478   2HG   GLN  59          1HG       GLN  59  61.095  -6.066  -6.046
  479   1HE2  GLN  59          1HE2      GLN  59  61.065  -8.141  -5.066
  480   2HE2  GLN  59          2HE2      GLN  59  60.331  -8.457  -3.570
  481    H    GLY  60           H        GLY  60  65.140  -3.380  -6.888
  482   1HA   GLY  60          2HA       GLY  60  66.753  -1.739  -6.412
  483   2HA   GLY  60          1HA       GLY  60  65.617  -1.065  -5.248
  484    H    SER  61           H        SER  61  66.492  -4.401  -4.838
  485    HA   SER  61           HA       SER  61  67.526  -3.827  -2.181
  486   1HB   SER  61          2HB       SER  61  67.544  -6.411  -3.773
  487   2HB   SER  61          1HB       SER  61  67.606  -6.253  -2.020
  488    HG   SER  61           HG       SER  61  65.480  -6.604  -3.322
  489    H    VAL  62           H        VAL  62  69.656  -4.010  -1.458
  490    HA   VAL  62           HA       VAL  62  71.777  -4.786  -3.402
  491    HB   VAL  62           HB       VAL  62  71.532  -2.331  -3.460
  492   1HG1  VAL  62          1HG1      VAL  62  70.540  -2.039  -1.219
  493   2HG1  VAL  62          2HG1      VAL  62  71.948  -0.999  -1.426
  494   3HG1  VAL  62          3HG1      VAL  62  72.078  -2.482  -0.480
  495   1HG2  VAL  62          1HG2      VAL  62  73.803  -1.860  -3.292
  496   2HG2  VAL  62          2HG2      VAL  62  73.836  -3.622  -3.343
  497   3HG2  VAL  62          3HG2      VAL  62  73.990  -2.781  -1.800
  498    H    ILE  63           H        ILE  63  73.579  -5.788  -2.368
  499    HA   ILE  63           HA       ILE  63  73.096  -6.512   0.497
  500    HB   ILE  63           HB       ILE  63  74.680  -7.896  -1.695
  501   1HG1  ILE  63          2HG1      ILE  63  72.274  -7.841  -2.231
  502   2HG1  ILE  63          1HG1      ILE  63  72.768  -9.473  -1.792
  503   1HG2  ILE  63          1HG2      ILE  63  75.507  -8.586   0.444
  504   2HG2  ILE  63          2HG2      ILE  63  74.430  -9.868  -0.112
  505   3HG2  ILE  63          3HG2      ILE  63  73.877  -8.717   1.104
  506   1HD1  ILE  63          1HD1      ILE  63  71.416  -7.489   0.064
  507   2HD1  ILE  63          2HD1      ILE  63  71.900  -9.128   0.493
  508   3HD1  ILE  63          3HD1      ILE  63  70.633  -8.869  -0.705
  509    H    ILE  64           H        ILE  64  74.493  -5.686   1.968
  510    HA   ILE  64           HA       ILE  64  77.092  -4.501   1.222
  511    HB   ILE  64           HB       ILE  64  75.731  -5.085   3.880
  512   1HG1  ILE  64          2HG1      ILE  64  76.014  -2.414   2.492
  513   2HG1  ILE  64          1HG1      ILE  64  74.628  -3.466   2.203
  514   1HG2  ILE  64          1HG2      ILE  64  78.039  -3.212   3.274
  515   2HG2  ILE  64          2HG2      ILE  64  78.225  -4.809   4.001
  516   3HG2  ILE  64          3HG2      ILE  64  77.338  -3.548   4.858
  517   1HD1  ILE  64          1HD1      ILE  64  73.840  -3.257   4.388
  518   2HD1  ILE  64          2HD1      ILE  64  74.507  -1.649   4.104
  519   3HD1  ILE  64          3HD1      ILE  64  75.429  -2.836   5.027
  520    HA   PRO  65           HA       PRO  65  79.317  -8.335   1.580
  521   1HB   PRO  65          2HB       PRO  65  81.770  -7.420   2.376
  522   2HB   PRO  65          1HB       PRO  65  81.164  -7.220   0.716
  523   1HG   PRO  65          2HG       PRO  65  81.036  -5.285   3.001
  524   2HG   PRO  65          1HG       PRO  65  81.626  -5.012   1.348
  525   1HD   PRO  65          2HD       PRO  65  79.181  -4.251   2.004
  526   2HD   PRO  65          1HD       PRO  65  79.459  -5.066   0.443
  527    H    LYS  66           H        LYS  66  79.392  -9.822   3.225
  528    HA   LYS  66           HA       LYS  66  78.601  -9.304   5.891
  529   1HB   LYS  66          2HB       LYS  66  78.607 -11.495   4.685
  530   2HB   LYS  66          1HB       LYS  66  80.363 -11.545   4.847
  531   1HG   LYS  66          2HG       LYS  66  80.119 -11.435   7.316
  532   2HG   LYS  66          1HG       LYS  66  78.365 -11.460   7.127
  533   1HD   LYS  66          2HD       LYS  66  78.589 -13.641   5.906
  534   2HD   LYS  66          1HD       LYS  66  80.309 -13.632   6.296
  535   1HE   LYS  66          2HE       LYS  66  79.596 -13.385   8.757
  536   2HE   LYS  66          1HE       LYS  66  77.969 -13.831   8.205
  537   1HZ   LYS  66          1HZ       LYS  66  78.811 -15.826   7.242
  538   2HZ   LYS  66          2HZ       LYS  66  79.379 -15.764   8.842
  539   3HZ   LYS  66          3HZ       LYS  66  80.417 -15.380   7.552
  540    H    ALA  67           H        ALA  67  81.832  -9.365   4.463
  541    HA   ALA  67           HA       ALA  67  83.422  -9.439   6.818
  542   1HB   ALA  67          1HB       ALA  67  83.813  -8.095   4.126
  543   2HB   ALA  67          2HB       ALA  67  84.340  -9.713   4.590
  544   3HB   ALA  67          3HB       ALA  67  85.103  -8.296   5.313
  545    H    LEU  68           H        LEU  68  81.881  -6.699   5.166
  546    HA   LEU  68           HA       LEU  68  83.027  -4.691   6.952
  547   1HB   LEU  68          2HB       LEU  68  80.801  -4.693   4.896
  548   2HB   LEU  68          1HB       LEU  68  81.319  -3.243   5.752
  549    HG   LEU  68           HG       LEU  68  83.094  -4.990   4.012
  550   1HD1  LEU  68          1HD1      LEU  68  82.507  -2.120   3.428
  551   2HD1  LEU  68          2HD1      LEU  68  81.241  -3.297   3.078
  552   3HD1  LEU  68          3HD1      LEU  68  82.823  -3.451   2.315
  553   1HD2  LEU  68          1HD2      LEU  68  84.528  -2.770   4.325
  554   2HD2  LEU  68          2HD2      LEU  68  84.607  -4.064   5.520
  555   3HD2  LEU  68          3HD2      LEU  68  83.599  -2.648   5.819
  556    H    ARG  69           H        ARG  69  80.005  -6.561   6.827
  557    HA   ARG  69           HA       ARG  69  78.450  -5.106   8.736
  558   1HB   ARG  69          2HB       ARG  69  78.686  -8.119   8.391
  559   2HB   ARG  69          1HB       ARG  69  77.314  -7.260   9.076
  560   1HG   ARG  69          2HG       ARG  69  77.030  -6.118   6.833
  561   2HG   ARG  69          1HG       ARG  69  78.247  -7.229   6.197
  562   1HD   ARG  69          2HD       ARG  69  76.706  -9.048   7.402
  563   2HD   ARG  69          1HD       ARG  69  75.462  -7.818   7.121
  564    HE   ARG  69           HE       ARG  69  76.683  -7.894   4.688
  565   1HH1  ARG  69          1HH1      ARG  69  75.501 -10.474   6.763
  566   2HH1  ARG  69          2HH1      ARG  69  75.244 -11.546   5.434
  567   1HH2  ARG  69          1HH2      ARG  69  76.314  -9.327   3.020
  568   2HH2  ARG  69          2HH2      ARG  69  75.694 -10.910   3.345
  569    H    ASP  70           H        ASP  70  80.776  -7.761   9.185
  570    HA   ASP  70           HA       ASP  70  80.468  -7.951  12.036
  571   1HB   ASP  70          2HB       ASP  70  82.705  -8.777  10.157
  572   2HB   ASP  70          1HB       ASP  70  82.543  -9.337  11.821
  573    H    VAL  71           H        VAL  71  82.986  -6.391  10.025
  574    HA   VAL  71           HA       VAL  71  84.643  -5.460  12.156
  575    HB   VAL  71           HB       VAL  71  84.054  -4.344   9.387
  576   1HG1  VAL  71          1HG1      VAL  71  86.408  -3.828  11.232
  577   2HG1  VAL  71          2HG1      VAL  71  85.167  -2.656  10.785
  578   3HG1  VAL  71          3HG1      VAL  71  86.280  -3.273   9.563
  579   1HG2  VAL  71          1HG2      VAL  71  84.982  -6.778   9.867
  580   2HG2  VAL  71          2HG2      VAL  71  86.495  -5.913  10.142
  581   3HG2  VAL  71          3HG2      VAL  71  85.682  -5.794   8.582
  582    H    ILE  72           H        ILE  72  81.816  -3.989  10.599
  583    HA   ILE  72           HA       ILE  72  82.045  -1.496  12.101
  584    HB   ILE  72           HB       ILE  72  79.853  -2.644  10.334
  585   1HG1  ILE  72          2HG1      ILE  72  82.067  -0.671   9.679
  586   2HG1  ILE  72          1HG1      ILE  72  82.116  -2.384   9.266
  587   1HG2  ILE  72          1HG2      ILE  72  80.410   0.243  11.095
  588   2HG2  ILE  72          2HG2      ILE  72  79.177  -0.750  11.871
  589   3HG2  ILE  72          3HG2      ILE  72  79.045  -0.364  10.155
  590   1HD1  ILE  72          1HD1      ILE  72  79.814  -1.954   8.139
  591   2HD1  ILE  72          2HD1      ILE  72  81.267  -1.386   7.311
  592   3HD1  ILE  72          3HD1      ILE  72  80.268  -0.250   8.218
  593    H    GLY  73           H        GLY  73  80.557  -4.588  12.725
  594   1HA   GLY  73          2HA       GLY  73  79.475  -5.297  14.692
  595   2HA   GLY  73          1HA       GLY  73  79.681  -3.666  15.332
  596    H    ILE  74           H        ILE  74  78.045  -4.457  12.297
  597    HA   ILE  74           HA       ILE  74  75.711  -2.904  13.207
  598    HB   ILE  74           HB       ILE  74  76.394  -4.230  10.561
  599   1HG1  ILE  74          2HG1      ILE  74  78.076  -2.554  11.229
  600   2HG1  ILE  74          1HG1      ILE  74  77.119  -1.963   9.873
  601   1HG2  ILE  74          1HG2      ILE  74  74.103  -3.791  10.421
  602   2HG2  ILE  74          2HG2      ILE  74  74.798  -2.297   9.790
  603   3HG2  ILE  74          3HG2      ILE  74  74.211  -2.364  11.452
  604   1HD1  ILE  74          1HD1      ILE  74  75.665  -1.078  12.050
  605   2HD1  ILE  74          2HD1      ILE  74  76.815  -0.101  11.138
  606   3HD1  ILE  74          3HD1      ILE  74  77.327  -0.917  12.616
  607    H    LYS  75           H        LYS  75  73.638  -3.716  13.474
  608    HA   LYS  75           HA       LYS  75  73.258  -6.680  13.214
  609   1HB   LYS  75          2HB       LYS  75  72.066  -6.556  15.384
  610   2HB   LYS  75          1HB       LYS  75  73.726  -5.990  15.535
  611   1HG   LYS  75          2HG       LYS  75  72.195  -3.708  14.836
  612   2HG   LYS  75          1HG       LYS  75  71.254  -4.563  16.055
  613   1HD   LYS  75          2HD       LYS  75  74.194  -3.900  16.371
  614   2HD   LYS  75          1HD       LYS  75  72.890  -2.895  17.004
  615   1HE   LYS  75          2HE       LYS  75  72.041  -4.943  18.246
  616   2HE   LYS  75          1HE       LYS  75  73.551  -5.752  17.782
  617   1HZ   LYS  75          1HZ       LYS  75  73.682  -4.563  19.947
  618   2HZ   LYS  75          2HZ       LYS  75  73.430  -3.102  19.118
  619   3HZ   LYS  75          3HZ       LYS  75  74.819  -4.030  18.806
  620    HA   PRO  76           HA       PRO  76  69.475  -5.882  11.105
  621   1HB   PRO  76          2HB       PRO  76  67.642  -7.431  12.549
  622   2HB   PRO  76          1HB       PRO  76  68.659  -8.011  11.218
  623   1HG   PRO  76          2HG       PRO  76  69.026  -8.299  14.143
  624   2HG   PRO  76          1HG       PRO  76  69.468  -9.401  12.830
  625   1HD   PRO  76          2HD       PRO  76  71.285  -7.899  14.143
  626   2HD   PRO  76          1HD       PRO  76  71.464  -8.337  12.429
  627    H    GLY  77           H        GLY  77  68.002  -4.222  11.227
  628   1HA   GLY  77          2HA       GLY  77  66.253  -2.929  12.217
  629   2HA   GLY  77          1HA       GLY  77  66.677  -3.599  13.789
  630    H    GLU  78           H        GLU  78  69.575  -2.627  12.440
  631    HA   GLU  78           HA       GLU  78  69.533  -0.092  13.994
  632   1HB   GLU  78          2HB       GLU  78  71.409  -2.207  13.410
  633   2HB   GLU  78          1HB       GLU  78  72.096  -0.678  12.868
  634   1HG   GLU  78          2HG       GLU  78  71.533   0.292  15.124
  635   2HG   GLU  78          1HG       GLU  78  71.057  -1.323  15.643
  636    H    VAL  79           H        VAL  79  69.471   1.864  12.969
  637    HA   VAL  79           HA       VAL  79  69.299   1.875  10.026
  638    HB   VAL  79           HB       VAL  79  67.618   2.950  11.480
  639   1HG1  VAL  79          1HG1      VAL  79  69.850   3.818  12.944
  640   2HG1  VAL  79          2HG1      VAL  79  68.170   4.264  13.229
  641   3HG1  VAL  79          3HG1      VAL  79  69.195   5.289  12.225
  642   1HG2  VAL  79          1HG2      VAL  79  69.207   4.431   9.457
  643   2HG2  VAL  79          2HG2      VAL  79  68.128   5.413  10.448
  644   3HG2  VAL  79          3HG2      VAL  79  67.479   4.077   9.497
  645    H    ILE  80           H        ILE  80  70.886   2.580   8.718
  646    HA   ILE  80           HA       ILE  80  73.154   4.171   9.860
  647    HB   ILE  80           HB       ILE  80  74.539   3.007   8.152
  648   1HG1  ILE  80          2HG1      ILE  80  72.017   1.434   7.538
  649   2HG1  ILE  80          1HG1      ILE  80  72.679   2.705   6.508
  650   1HG2  ILE  80          1HG2      ILE  80  74.738   1.005   9.329
  651   2HG2  ILE  80          2HG2      ILE  80  72.995   0.825   9.523
  652   3HG2  ILE  80          3HG2      ILE  80  73.872   2.003  10.496
  653   1HD1  ILE  80          1HD1      ILE  80  73.648  -0.065   6.954
  654   2HD1  ILE  80          2HD1      ILE  80  74.896   1.178   6.860
  655   3HD1  ILE  80          3HD1      ILE  80  73.771   0.955   5.520
  656    H    GLU  81           H        GLU  81  74.083   5.720   8.306
  657    HA   GLU  81           HA       GLU  81  72.098   6.788   6.352
  658   1HB   GLU  81          2HB       GLU  81  73.069   8.259   8.128
  659   2HB   GLU  81          1HB       GLU  81  74.675   7.945   7.470
  660   1HG   GLU  81          2HG       GLU  81  73.922   8.874   5.280
  661   2HG   GLU  81          1HG       GLU  81  72.371   9.275   6.016
  662    H    VAL  82           H        VAL  82  72.503   6.535   4.206
  663    HA   VAL  82           HA       VAL  82  75.058   5.193   3.441
  664    HB   VAL  82           HB       VAL  82  72.237   5.091   2.313
  665   1HG1  VAL  82          1HG1      VAL  82  73.183   3.073   1.087
  666   2HG1  VAL  82          2HG1      VAL  82  74.786   3.648   1.550
  667   3HG1  VAL  82          3HG1      VAL  82  73.755   4.642   0.517
  668   1HG2  VAL  82          1HG2      VAL  82  72.602   2.634   3.178
  669   2HG2  VAL  82          2HG2      VAL  82  72.149   3.895   4.323
  670   3HG2  VAL  82          3HG2      VAL  82  73.831   3.378   4.201
  671    H    LEU  83           H        LEU  83  76.330   6.186   1.979
  672    HA   LEU  83           HA       LEU  83  75.252   8.504   0.405
  673   1HB   LEU  83          2HB       LEU  83  78.125   7.891   1.202
  674   2HB   LEU  83          1HB       LEU  83  77.508   9.405   0.554
  675    HG   LEU  83           HG       LEU  83  76.764   8.213   3.244
  676   1HD1  LEU  83          1HD1      LEU  83  78.394  10.690   2.625
  677   2HD1  LEU  83          2HD1      LEU  83  79.111   9.120   2.998
  678   3HD1  LEU  83          3HD1      LEU  83  78.126   9.951   4.205
  679   1HD2  LEU  83          1HD2      LEU  83  74.934   9.505   2.292
  680   2HD2  LEU  83          2HD2      LEU  83  76.030  10.830   1.896
  681   3HD2  LEU  83          3HD2      LEU  83  75.686  10.443   3.582
  682    H    LEU  84           H        LEU  84  75.316   8.204  -1.827
  683    HA   LEU  84           HA       LEU  84  76.657   5.844  -2.997
  684   1HB   LEU  84          2HB       LEU  84  74.889   8.089  -3.926
  685   2HB   LEU  84          1HB       LEU  84  75.807   7.161  -5.119
  686    HG   LEU  84           HG       LEU  84  74.318   5.638  -3.027
  687   1HD1  LEU  84          1HD1      LEU  84  72.577   5.952  -5.275
  688   2HD1  LEU  84          2HD1      LEU  84  73.010   7.563  -4.708
  689   3HD1  LEU  84          3HD1      LEU  84  72.283   6.406  -3.598
  690   1HD2  LEU  84          1HD2      LEU  84  74.147   4.864  -5.859
  691   2HD2  LEU  84          2HD2      LEU  84  74.686   3.923  -4.470
  692   3HD2  LEU  84          3HD2      LEU  84  75.810   5.008  -5.288
  693    H    LEU  85           H        LEU  85  78.587   5.930  -4.141
  694    HA   LEU  85           HA       LEU  85  80.107   8.495  -3.954
  695   1HB   LEU  85          2HB       LEU  85  80.695   5.587  -3.651
  696   2HB   LEU  85          1HB       LEU  85  81.990   6.611  -4.275
  697    HG   LEU  85           HG       LEU  85  80.430   7.404  -1.820
  698   1HD1  LEU  85          1HD1      LEU  85  81.441   5.076  -1.588
  699   2HD1  LEU  85          2HD1      LEU  85  82.009   6.269  -0.419
  700   3HD1  LEU  85          3HD1      LEU  85  83.019   5.835  -1.798
  701   1HD2  LEU  85          1HD2      LEU  85  81.761   9.180  -2.668
  702   2HD2  LEU  85          2HD2      LEU  85  83.096   8.098  -3.065
  703   3HD2  LEU  85          3HD2      LEU  85  82.741   8.478  -1.380
  704    H    GLY  86           H        GLY  86  79.229   5.845  -6.155
  705   1HA   GLY  86          2HA       GLY  86  79.786   7.504  -8.502
  706   2HA   GLY  86          1HA       GLY  86  81.002   6.259  -8.264
  707    H    HIS  87           H        HIS  87  79.928   5.812 -10.529
  708    HA   HIS  87           HA       HIS  87  77.891   3.659 -10.137
  709   1HB   HIS  87          2HB       HIS  87  76.593   4.642 -12.024
  710   2HB   HIS  87          1HB       HIS  87  76.717   5.759 -10.670
  711    HD1  HIS  87           HD1      HIS  87  78.058   5.171 -14.147
  712    HD2  HIS  87           HD2      HIS  87  78.179   8.118 -11.200
  713    HE1  HIS  87           HE1      HIS  87  79.089   7.219 -15.223
  714    H    TYR  88           H        TYR  88  77.889   2.083 -11.883
  715    HA   TYR  88           HA       TYR  88  79.989   2.378 -13.976
  716   1HB   TYR  88          2HB       TYR  88  79.668   0.100 -11.998
  717   2HB   TYR  88          1HB       TYR  88  80.695   0.013 -13.429
  718    HD1  TYR  88           HD1      TYR  88  80.356   1.301 -10.009
  719    HD2  TYR  88           HD2      TYR  88  82.642   1.628 -13.702
  720    HE1  TYR  88           HE1      TYR  88  82.198   2.478  -8.766
  721    HE2  TYR  88           HE2      TYR  88  84.483   2.805 -12.459
  722    HH   TYR  88           HH       TYR  88  85.276   2.835  -9.913
  723    H    LYS  89           H        LYS  89  79.477   1.232 -15.894
  724    HA   LYS  89           HA       LYS  89  76.827  -0.176 -15.929
  725   1HB   LYS  89          2HB       LYS  89  76.563   0.811 -18.204
  726   2HB   LYS  89          1HB       LYS  89  76.719   2.051 -16.962
  727   1HG   LYS  89          2HG       LYS  89  78.918   2.590 -17.595
  728   2HG   LYS  89          1HG       LYS  89  79.156   1.054 -18.429
  729   1HD   LYS  89          2HD       LYS  89  77.975   1.731 -20.308
  730   2HD   LYS  89          1HD       LYS  89  77.006   2.897 -19.406
  731   1HE   LYS  89          2HE       LYS  89  78.609   4.550 -19.559
  732   2HE   LYS  89          1HE       LYS  89  79.952   3.390 -19.528
  733   1HZ   LYS  89          1HZ       LYS  89  78.027   3.617 -21.775
  734   2HZ   LYS  89          2HZ       LYS  89  79.459   2.703 -21.735
  735   3HZ   LYS  89          3HZ       LYS  89  79.531   4.401 -21.755
  736    HA   PRO  90           HA       PRO  90  78.858  -3.714 -17.669
  737   1HB   PRO  90          2HB       PRO  90  76.685  -3.653 -19.740
  738   2HB   PRO  90          1HB       PRO  90  77.225  -5.003 -18.716
  739   1HG   PRO  90          2HG       PRO  90  74.996  -3.796 -18.108
  740   2HG   PRO  90          1HG       PRO  90  76.164  -4.142 -16.816
  741   1HD   PRO  90          2HD       PRO  90  75.646  -1.546 -18.234
  742   2HD   PRO  90          1HD       PRO  90  75.853  -1.857 -16.492
  743    H    ARG  91           H        ARG  91  80.460  -4.013 -19.229
  744    HA   ARG  91           HA       ARG  91  81.097  -1.846 -21.067
  745   1HB   ARG  91          2HB       ARG  91  82.182  -4.655 -20.674
  746   2HB   ARG  91          1HB       ARG  91  82.946  -3.428 -21.686
  747   1HG   ARG  91          2HG       ARG  91  83.088  -1.930 -19.691
  748   2HG   ARG  91          1HG       ARG  91  82.440  -3.239 -18.702
  749   1HD   ARG  91          2HD       ARG  91  84.847  -3.331 -18.489
  750   2HD   ARG  91          1HD       ARG  91  84.386  -4.671 -19.558
  751    HE   ARG  91           HE       ARG  91  84.743  -2.624 -21.340
  752   1HH1  ARG  91          1HH1      ARG  91  86.764  -3.842 -18.741
  753   2HH1  ARG  91          2HH1      ARG  91  88.224  -3.363 -19.530
  754   1HH2  ARG  91          1HH2      ARG  91  86.661  -2.029 -22.309
  755   2HH2  ARG  91          2HH2      ARG  91  88.170  -2.350 -21.523
  756    H    ASN  92           H        ASN  92  80.944  -1.875 -23.346
  757    HA   ASN  92           HA       ASN  92  79.090  -3.933 -24.480
  758   1HB   ASN  92          2HB       ASN  92  78.604  -2.146 -26.137
  759   2HB   ASN  92          1HB       ASN  92  78.340  -1.585 -24.487
  760   1HD2  ASN  92          1HD2      ASN  92  78.812   0.332 -26.487
  761   2HD2  ASN  92          2HD2      ASN  92  80.349   1.017 -26.270
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  83.708  15.346  -0.287
    2   2H    MET   1          2H        MET   1  84.534  15.461  -1.767
    3   3H    MET   1          3H        MET   1  85.252  14.662  -0.450
    4    HA   MET   1           HA       MET   1  84.405  13.047  -2.047
    5   1HB   MET   1          2HB       MET   1  84.469  12.700   0.435
    6   2HB   MET   1          1HB       MET   1  82.798  13.258   0.520
    7   1HG   MET   1          2HG       MET   1  82.156  11.434  -1.067
    8   2HG   MET   1          1HG       MET   1  83.814  10.838  -0.996
    9   1HE   MET   1          1HE       MET   1  80.965  12.131   0.745
   10   2HE   MET   1          2HE       MET   1  81.219  11.787   2.454
   11   3HE   MET   1          3HE       MET   1  80.297  10.659   1.464
   12    H    ASP   2           H        ASP   2  83.133  13.338  -3.846
   13    HA   ASP   2           HA       ASP   2  80.595  14.785  -3.811
   14   1HB   ASP   2          2HB       ASP   2  81.972  13.000  -5.847
   15   2HB   ASP   2          1HB       ASP   2  80.552  13.987  -6.189
   16    H    VAL   3           H        VAL   3  78.508  13.871  -3.860
   17    HA   VAL   3           HA       VAL   3  78.332  10.910  -3.585
   18    HB   VAL   3           HB       VAL   3  78.145  12.397  -1.475
   19   1HG1  VAL   3          1HG1      VAL   3  75.328  12.836  -2.489
   20   2HG1  VAL   3          2HG1      VAL   3  76.587  14.074  -2.567
   21   3HG1  VAL   3          3HG1      VAL   3  76.047  13.464  -1.002
   22   1HG2  VAL   3          1HG2      VAL   3  77.506  10.058  -1.457
   23   2HG2  VAL   3          2HG2      VAL   3  75.960  10.437  -2.216
   24   3HG2  VAL   3          3HG2      VAL   3  76.290  10.980  -0.571
   25    H    LEU   4           H        LEU   4  76.727   9.968  -4.837
   26    HA   LEU   4           HA       LEU   4  75.379  11.694  -6.807
   27   1HB   LEU   4          2HB       LEU   4  75.305   8.682  -6.430
   28   2HB   LEU   4          1HB       LEU   4  74.879   9.566  -7.890
   29    HG   LEU   4           HG       LEU   4  77.639   9.340  -6.639
   30   1HD1  LEU   4          1HD1      LEU   4  77.386   7.407  -7.882
   31   2HD1  LEU   4          2HD1      LEU   4  77.989   8.499  -9.130
   32   3HD1  LEU   4          3HD1      LEU   4  76.262   8.156  -9.016
   33   1HD2  LEU   4          1HD2      LEU   4  78.232  10.580  -8.885
   34   2HD2  LEU   4          2HD2      LEU   4  77.692  11.526  -7.494
   35   3HD2  LEU   4          3HD2      LEU   4  76.564  11.146  -8.799
   36    H    ALA   5           H        ALA   5  74.563  10.144  -3.800
   37    HA   ALA   5           HA       ALA   5  71.983  11.412  -3.708
   38   1HB   ALA   5          1HB       ALA   5  70.560   9.722  -4.338
   39   2HB   ALA   5          2HB       ALA   5  71.611   8.465  -3.687
   40   3HB   ALA   5          3HB       ALA   5  71.959   9.176  -5.262
   41    H    LYS   6           H        LYS   6  70.983  11.075  -1.597
   42    HA   LYS   6           HA       LYS   6  72.679   9.578   0.379
   43   1HB   LYS   6          2HB       LYS   6  73.167  12.036   0.239
   44   2HB   LYS   6          1HB       LYS   6  71.485  12.357   0.664
   45   1HG   LYS   6          2HG       LYS   6  71.772  11.192   2.796
   46   2HG   LYS   6          1HG       LYS   6  73.433  10.785   2.372
   47   1HD   LYS   6          2HD       LYS   6  73.594  13.426   2.009
   48   2HD   LYS   6          1HD       LYS   6  72.276  13.413   3.182
   49   1HE   LYS   6          2HE       LYS   6  73.977  11.649   4.367
   50   2HE   LYS   6          1HE       LYS   6  75.135  12.727   3.563
   51   1HZ   LYS   6          1HZ       LYS   6  74.566  13.682   5.671
   52   2HZ   LYS   6          2HZ       LYS   6  72.903  13.527   5.356
   53   3HZ   LYS   6          3HZ       LYS   6  73.843  14.621   4.458
   54    H    PHE   7           H        PHE   7  71.389   8.180   1.540
   55    HA   PHE   7           HA       PHE   7  68.644   9.012   2.307
   56   1HB   PHE   7          2HB       PHE   7  67.672   7.005   1.259
   57   2HB   PHE   7          1HB       PHE   7  68.501   7.992   0.059
   58    HD1  PHE   7           HD1      PHE   7  68.200   4.701   1.493
   59    HD2  PHE   7           HD2      PHE   7  71.011   7.378  -0.484
   60    HE1  PHE   7           HE1      PHE   7  69.633   2.732   0.861
   61    HE2  PHE   7           HE2      PHE   7  72.444   5.408  -1.111
   62    HZ   PHE   7           HZ       PHE   7  71.754   3.083  -0.433
   63    H    HIS   8           H        HIS   8  67.679   7.454   3.891
   64    HA   HIS   8           HA       HIS   8  69.828   6.158   5.546
   65   1HB   HIS   8          2HB       HIS   8  67.148   7.417   6.234
   66   2HB   HIS   8          1HB       HIS   8  68.236   6.680   7.409
   67    HD1  HIS   8           HD1      HIS   8  67.876   9.674   5.172
   68    HD2  HIS   8           HD2      HIS   8  70.571   8.203   7.993
   69    HE1  HIS   8           HE1      HIS   8  69.476  11.568   5.691
   70    H    THR   9           H        THR   9  69.558   4.024   6.121
   71    HA   THR   9           HA       THR   9  66.918   2.714   5.922
   72    HB   THR   9           HB       THR   9  67.979   2.654   3.635
   73    HG1  THR   9           HG1      THR   9  66.883   0.896   3.544
   74   1HG2  THR   9          1HG2      THR   9  70.336   2.527   4.310
   75   2HG2  THR   9          2HG2      THR   9  69.917   1.144   3.298
   76   3HG2  THR   9          3HG2      THR   9  70.051   0.949   5.047
   77    H    THR  10           H        THR  10  67.026   0.482   6.930
   78    HA   THR  10           HA       THR  10  69.293   0.319   8.874
   79    HB   THR  10           HB       THR  10  66.888   0.692   9.684
   80    HG1  THR  10           HG1      THR  10  68.330  -1.585  10.531
   81   1HG2  THR  10          1HG2      THR  10  65.240  -0.808   9.299
   82   2HG2  THR  10          2HG2      THR  10  66.311  -2.172   9.632
   83   3HG2  THR  10          3HG2      THR  10  66.283  -1.443   8.024
   84    H    VAL  11           H        VAL  11  70.023  -1.884   9.422
   85    HA   VAL  11           HA       VAL  11  70.429  -3.473   7.009
   86    HB   VAL  11           HB       VAL  11  71.193  -3.937   9.915
   87   1HG1  VAL  11          1HG1      VAL  11  71.980  -5.254   7.319
   88   2HG1  VAL  11          2HG1      VAL  11  71.520  -6.008   8.847
   89   3HG1  VAL  11          3HG1      VAL  11  73.095  -5.232   8.685
   90   1HG2  VAL  11          1HG2      VAL  11  72.218  -2.149   7.806
   91   2HG2  VAL  11          2HG2      VAL  11  73.464  -3.155   8.544
   92   3HG2  VAL  11          3HG2      VAL  11  72.476  -2.095   9.549
   93    H    HIS  12           H        HIS  12  69.453  -5.379   6.467
   94    HA   HIS  12           HA       HIS  12  67.530  -6.608   8.411
   95   1HB   HIS  12          2HB       HIS  12  67.435  -6.113   5.453
   96   2HB   HIS  12          1HB       HIS  12  66.587  -7.516   6.111
   97    HD1  HIS  12           HD1      HIS  12  66.902  -3.814   7.040
   98    HD2  HIS  12           HD2      HIS  12  64.031  -6.831   6.862
   99    HE1  HIS  12           HE1      HIS  12  64.715  -2.765   7.768
  100    H    ARG  13           H        ARG  13  67.239  -9.012   7.857
  101    HA   ARG  13           HA       ARG  13  69.483 -10.497   8.458
  102   1HB   ARG  13          2HB       ARG  13  67.064 -11.154   6.765
  103   2HB   ARG  13          1HB       ARG  13  68.179 -12.392   7.356
  104   1HG   ARG  13          2HG       ARG  13  67.765 -11.588   9.686
  105   2HG   ARG  13          1HG       ARG  13  66.569 -10.458   9.051
  106   1HD   ARG  13          2HD       ARG  13  65.366 -12.451   8.030
  107   2HD   ARG  13          1HD       ARG  13  66.459 -13.487   8.970
  108    HE   ARG  13           HE       ARG  13  64.284 -11.884  10.058
  109   1HH1  ARG  13          1HH1      ARG  13  67.442 -13.247  10.757
  110   2HH1  ARG  13          2HH1      ARG  13  67.166 -13.248  12.463
  111   1HH2  ARG  13          1HH2      ARG  13  63.986 -11.908  12.270
  112   2HH2  ARG  13          2HH2      ARG  13  65.237 -12.500  13.311
  113    H    ILE  14           H        ILE  14  70.996 -11.770   7.283
  114    HA   ILE  14           HA       ILE  14  72.560 -12.243   5.594
  115    HB   ILE  14           HB       ILE  14  70.390 -11.232   3.725
  116   1HG1  ILE  14          2HG1      ILE  14  70.925 -14.095   4.556
  117   2HG1  ILE  14          1HG1      ILE  14  69.707 -13.091   5.346
  118   1HG2  ILE  14          1HG2      ILE  14  71.641 -13.140   2.350
  119   2HG2  ILE  14          2HG2      ILE  14  72.979 -12.684   3.404
  120   3HG2  ILE  14          3HG2      ILE  14  72.230 -11.478   2.357
  121   1HD1  ILE  14          1HD1      ILE  14  69.007 -12.635   2.796
  122   2HD1  ILE  14          2HD1      ILE  14  68.375 -14.009   3.708
  123   3HD1  ILE  14          3HD1      ILE  14  69.723 -14.235   2.594
  124    H    GLY  15           H        GLY  15  71.780  -9.164   6.496
  125   1HA   GLY  15          2HA       GLY  15  73.063  -7.201   6.285
  126   2HA   GLY  15          1HA       GLY  15  74.100  -8.051   5.145
  127    H    ARG  16           H        ARG  16  70.728  -8.215   4.392
  128    HA   ARG  16           HA       ARG  16  71.194  -6.673   1.942
  129   1HB   ARG  16          2HB       ARG  16  69.974  -8.830   2.022
  130   2HB   ARG  16          1HB       ARG  16  68.762  -8.100   3.073
  131   1HG   ARG  16          2HG       ARG  16  68.117  -6.533   1.324
  132   2HG   ARG  16          1HG       ARG  16  69.410  -7.118   0.278
  133   1HD   ARG  16          2HD       ARG  16  67.346  -8.196  -0.426
  134   2HD   ARG  16          1HD       ARG  16  68.329  -9.420   0.399
  135    HE   ARG  16           HE       ARG  16  66.871  -8.299   2.459
  136   1HH1  ARG  16          1HH1      ARG  16  65.983  -9.722  -0.625
  137   2HH1  ARG  16          2HH1      ARG  16  64.446 -10.254  -0.040
  138   1HH2  ARG  16          1HH2      ARG  16  64.876  -9.009   3.154
  139   2HH2  ARG  16          2HH2      ARG  16  63.825  -9.857   2.070
  140    H    ILE  17           H        ILE  17  70.194  -4.716   1.416
  141    HA   ILE  17           HA       ILE  17  68.300  -3.524   3.387
  142    HB   ILE  17           HB       ILE  17  69.454  -1.344   3.117
  143   1HG1  ILE  17          2HG1      ILE  17  71.614  -2.866   1.634
  144   2HG1  ILE  17          1HG1      ILE  17  70.363  -1.938   0.808
  145   1HG2  ILE  17          1HG2      ILE  17  71.314  -1.819   4.524
  146   2HG2  ILE  17          2HG2      ILE  17  71.510  -3.435   3.846
  147   3HG2  ILE  17          3HG2      ILE  17  70.127  -3.075   4.879
  148   1HD1  ILE  17          1HD1      ILE  17  72.764  -0.900   1.635
  149   2HD1  ILE  17          2HD1      ILE  17  71.714  -0.474   2.986
  150   3HD1  ILE  17          3HD1      ILE  17  71.310   0.058   1.352
  151    H    ILE  18           H        ILE  18  66.774  -2.037   2.356
  152    HA   ILE  18           HA       ILE  18  66.700  -2.277  -0.639
  153    HB   ILE  18           HB       ILE  18  64.407  -1.931   1.325
  154   1HG1  ILE  18          2HG1      ILE  18  65.421  -4.157   1.581
  155   2HG1  ILE  18          1HG1      ILE  18  63.860  -4.294   0.778
  156   1HG2  ILE  18          1HG2      ILE  18  63.621  -1.070  -0.695
  157   2HG2  ILE  18          2HG2      ILE  18  63.183  -2.774  -0.849
  158   3HG2  ILE  18          3HG2      ILE  18  64.621  -2.157  -1.664
  159   1HD1  ILE  18          1HD1      ILE  18  65.459  -4.020  -1.390
  160   2HD1  ILE  18          2HD1      ILE  18  65.061  -5.587  -0.685
  161   3HD1  ILE  18          3HD1      ILE  18  66.588  -4.802  -0.283
  162    H    ILE  19           H        ILE  19  66.886  -0.360  -1.698
  163    HA   ILE  19           HA       ILE  19  66.864   2.192  -0.221
  164    HB   ILE  19           HB       ILE  19  67.100   1.533  -3.193
  165   1HG1  ILE  19          2HG1      ILE  19  69.187   1.959  -1.009
  166   2HG1  ILE  19          1HG1      ILE  19  68.875   0.460  -1.873
  167   1HG2  ILE  19          1HG2      ILE  19  67.916   4.034  -1.660
  168   2HG2  ILE  19          2HG2      ILE  19  66.434   3.896  -2.607
  169   3HG2  ILE  19          3HG2      ILE  19  68.003   3.788  -3.405
  170   1HD1  ILE  19          1HD1      ILE  19  70.574   2.676  -2.624
  171   2HD1  ILE  19          2HD1      ILE  19  69.356   2.392  -3.870
  172   3HD1  ILE  19          3HD1      ILE  19  70.431   1.084  -3.374
  173    HA   PRO  20           HA       PRO  20  62.525   3.027  -1.007
  174   1HB   PRO  20          2HB       PRO  20  62.630   5.766  -1.068
  175   2HB   PRO  20          1HB       PRO  20  62.673   4.840   0.443
  176   1HG   PRO  20          2HG       PRO  20  64.967   5.915  -1.161
  177   2HG   PRO  20          1HG       PRO  20  64.656   6.087   0.577
  178   1HD   PRO  20          2HD       PRO  20  66.369   4.258  -0.253
  179   2HD   PRO  20          1HD       PRO  20  65.186   3.834   1.013
  180    H    ALA  21           H        ALA  21  61.356   3.400  -2.900
  181    HA   ALA  21           HA       ALA  21  62.651   3.315  -5.414
  182   1HB   ALA  21          1HB       ALA  21  60.171   4.356  -5.962
  183   2HB   ALA  21          2HB       ALA  21  59.930   3.724  -4.334
  184   3HB   ALA  21          3HB       ALA  21  60.476   2.652  -5.623
  185    H    GLY  22           H        GLY  22  61.755   6.072  -3.418
  186   1HA   GLY  22          2HA       GLY  22  61.825   8.099  -5.462
  187   2HA   GLY  22          1HA       GLY  22  62.069   8.386  -3.736
  188    H    THR  23           H        THR  23  64.359   6.837  -3.280
  189    HA   THR  23           HA       THR  23  66.431   8.609  -4.248
  190    HB   THR  23           HB       THR  23  66.598   5.888  -2.908
  191    HG1  THR  23           HG1      THR  23  66.429   8.531  -1.898
  192   1HG2  THR  23          1HG2      THR  23  68.685   6.968  -4.021
  193   2HG2  THR  23          2HG2      THR  23  68.821   6.422  -2.350
  194   3HG2  THR  23          3HG2      THR  23  68.594   8.136  -2.703
  195    H    ARG  24           H        ARG  24  65.397   5.317  -5.156
  196    HA   ARG  24           HA       ARG  24  67.477   4.655  -7.015
  197   1HB   ARG  24          2HB       ARG  24  64.539   4.071  -7.467
  198   2HB   ARG  24          1HB       ARG  24  65.918   3.088  -7.936
  199   1HG   ARG  24          2HG       ARG  24  66.343   3.003  -5.325
  200   2HG   ARG  24          1HG       ARG  24  64.627   3.384  -5.258
  201   1HD   ARG  24          2HD       ARG  24  64.487   1.432  -7.079
  202   2HD   ARG  24          1HD       ARG  24  65.968   0.915  -6.240
  203    HE   ARG  24           HE       ARG  24  64.357   1.497  -4.138
  204   1HH1  ARG  24          1HH1      ARG  24  63.742  -0.401  -7.023
  205   2HH1  ARG  24          2HH1      ARG  24  62.564  -1.384  -6.229
  206   1HH2  ARG  24          1HH2      ARG  24  62.851   0.202  -3.172
  207   2HH2  ARG  24          2HH2      ARG  24  62.058  -1.050  -4.072
  208    H    LYS  25           H        LYS  25  64.509   6.542  -7.393
  209    HA   LYS  25           HA       LYS  25  64.635   6.964 -10.218
  210   1HB   LYS  25          2HB       LYS  25  62.661   7.303  -8.744
  211   2HB   LYS  25          1HB       LYS  25  63.468   8.681  -7.997
  212   1HG   LYS  25          2HG       LYS  25  63.555   9.808 -10.194
  213   2HG   LYS  25          1HG       LYS  25  62.708   8.441 -10.920
  214   1HD   LYS  25          2HD       LYS  25  60.823   8.832  -9.314
  215   2HD   LYS  25          1HD       LYS  25  61.653  10.286  -8.760
  216   1HE   LYS  25          2HE       LYS  25  61.239  11.440 -10.733
  217   2HE   LYS  25          1HE       LYS  25  61.186   9.958 -11.707
  218   1HZ   LYS  25          1HZ       LYS  25  58.957  10.882 -11.317
  219   2HZ   LYS  25          2HZ       LYS  25  59.184  10.710  -9.642
  220   3HZ   LYS  25          3HZ       LYS  25  59.130   9.336 -10.640
  221    H    PHE  26           H        PHE  26  65.669   9.056  -7.517
  222    HA   PHE  26           HA       PHE  26  66.727  11.221  -9.025
  223   1HB   PHE  26          2HB       PHE  26  66.311  11.145  -6.571
  224   2HB   PHE  26          1HB       PHE  26  67.685  10.054  -6.390
  225    HD1  PHE  26           HD1      PHE  26  69.879  10.912  -6.087
  226    HD2  PHE  26           HD2      PHE  26  66.755  13.461  -7.738
  227    HE1  PHE  26           HE1      PHE  26  71.439  12.885  -5.997
  228    HE2  PHE  26           HE2      PHE  26  68.314  15.433  -7.646
  229    HZ   PHE  26           HZ       PHE  26  70.655  15.144  -6.775
  230    H    TYR  27           H        TYR  27  68.249   8.176  -8.030
  231    HA   TYR  27           HA       TYR  27  70.868   8.940  -9.149
  232   1HB   TYR  27          2HB       TYR  27  70.503   7.671  -7.039
  233   2HB   TYR  27          1HB       TYR  27  69.797   6.360  -7.965
  234    HD1  TYR  27           HD1      TYR  27  72.841   7.772  -6.648
  235    HD2  TYR  27           HD2      TYR  27  71.290   5.276  -9.860
  236    HE1  TYR  27           HE1      TYR  27  75.125   6.776  -6.987
  237    HE2  TYR  27           HE2      TYR  27  73.570   4.279 -10.191
  238    HH   TYR  27           HH       TYR  27  76.079   4.625  -7.926
  239    H    GLY  28           H        GLY  28  68.005   7.380 -10.367
  240   1HA   GLY  28          2HA       GLY  28  67.591   6.564 -12.533
  241   2HA   GLY  28          1HA       GLY  28  69.260   6.958 -12.947
  242    H    ILE  29           H        ILE  29  68.059   4.796 -10.371
  243    HA   ILE  29           HA       ILE  29  69.988   2.739 -11.214
  244    HB   ILE  29           HB       ILE  29  67.940   2.840  -8.966
  245   1HG1  ILE  29          2HG1      ILE  29  70.920   3.410  -8.949
  246   2HG1  ILE  29          1HG1      ILE  29  69.662   4.640  -8.917
  247   1HG2  ILE  29          1HG2      ILE  29  68.482   0.590  -9.032
  248   2HG2  ILE  29          2HG2      ILE  29  69.816   1.178  -8.041
  249   3HG2  ILE  29          3HG2      ILE  29  70.058   0.882  -9.762
  250   1HD1  ILE  29          1HD1      ILE  29  68.908   2.953  -6.855
  251   2HD1  ILE  29          2HD1      ILE  29  69.787   4.470  -6.661
  252   3HD1  ILE  29          3HD1      ILE  29  70.671   2.943  -6.744
  253    H    GLU  30           H        GLU  30  69.500   1.036 -12.466
  254    HA   GLU  30           HA       GLU  30  66.695   0.000 -12.505
  255   1HB   GLU  30          2HB       GLU  30  68.635   0.252 -14.832
  256   2HB   GLU  30          1HB       GLU  30  67.050  -0.515 -14.916
  257   1HG   GLU  30          2HG       GLU  30  66.001   1.635 -14.228
  258   2HG   GLU  30          1HG       GLU  30  67.592   2.392 -14.235
  259    H    GLN  31           H        GLN  31  66.658  -2.373 -12.880
  260    HA   GLN  31           HA       GLN  31  68.561  -3.838 -11.370
  261   1HB   GLN  31          2HB       GLN  31  66.630  -4.629 -13.569
  262   2HB   GLN  31          1HB       GLN  31  67.492  -5.805 -12.576
  263   1HG   GLN  31          2HG       GLN  31  66.503  -4.834 -10.543
  264   2HG   GLN  31          1HG       GLN  31  65.651  -3.638 -11.522
  265   1HE2  GLN  31          1HE2      GLN  31  65.685  -7.022 -10.541
  266   2HE2  GLN  31          2HE2      GLN  31  64.210  -7.441 -11.271
  267    H    GLY  32           H        GLY  32  70.484  -4.853 -11.889
  268   1HA   GLY  32          2HA       GLY  32  72.076  -5.881 -13.368
  269   2HA   GLY  32          1HA       GLY  32  71.280  -5.103 -14.732
  270    H    ASP  33           H        ASP  33  71.389  -2.504 -12.891
  271    HA   ASP  33           HA       ASP  33  73.899  -1.494 -14.022
  272   1HB   ASP  33          2HB       ASP  33  71.823  -0.391 -12.105
  273   2HB   ASP  33          1HB       ASP  33  73.173   0.553 -12.732
  274    H    PHE  34           H        PHE  34  75.702  -0.699 -12.708
  275    HA   PHE  34           HA       PHE  34  75.901  -2.011 -10.016
  276   1HB   PHE  34          2HB       PHE  34  77.925  -1.248 -12.135
  277   2HB   PHE  34          1HB       PHE  34  78.399  -1.680 -10.493
  278    HD1  PHE  34           HD1      PHE  34  76.843  -2.918 -13.649
  279    HD2  PHE  34           HD2      PHE  34  78.218  -3.977  -9.654
  280    HE1  PHE  34           HE1      PHE  34  76.668  -5.357 -14.237
  281    HE2  PHE  34           HE2      PHE  34  78.043  -6.417 -10.241
  282    HZ   PHE  34           HZ       PHE  34  77.267  -7.106 -12.532
  283    H    VAL  35           H        VAL  35  76.301  -0.667  -8.275
  284    HA   VAL  35           HA       VAL  35  77.006   2.184  -8.846
  285    HB   VAL  35           HB       VAL  35  75.403   2.830  -7.055
  286   1HG1  VAL  35          1HG1      VAL  35  73.365   2.444  -8.339
  287   2HG1  VAL  35          2HG1      VAL  35  74.114   1.088  -9.180
  288   3HG1  VAL  35          3HG1      VAL  35  74.700   2.728  -9.455
  289   1HG2  VAL  35          1HG2      VAL  35  74.802  -0.144  -7.061
  290   2HG2  VAL  35          2HG2      VAL  35  73.742   1.065  -6.331
  291   3HG2  VAL  35          3HG2      VAL  35  75.374   0.824  -5.701
  292    H    GLU  36           H        GLU  36  78.259   3.170  -7.119
  293    HA   GLU  36           HA       GLU  36  79.553   1.169  -5.291
  294   1HB   GLU  36          2HB       GLU  36  80.935   2.159  -7.146
  295   2HB   GLU  36          1HB       GLU  36  80.636   3.757  -6.462
  296   1HG   GLU  36          2HG       GLU  36  81.659   2.992  -4.319
  297   2HG   GLU  36          1HG       GLU  36  82.037   1.449  -5.079
  298    H    ILE  37           H        ILE  37  79.078   1.538  -3.192
  299    HA   ILE  37           HA       ILE  37  78.185   4.279  -2.395
  300    HB   ILE  37           HB       ILE  37  76.343   2.804  -3.118
  301   1HG1  ILE  37          2HG1      ILE  37  76.159   2.888  -0.119
  302   2HG1  ILE  37          1HG1      ILE  37  76.238   4.390  -1.039
  303   1HG2  ILE  37          1HG2      ILE  37  77.355   0.632  -2.671
  304   2HG2  ILE  37          2HG2      ILE  37  75.832   0.757  -1.789
  305   3HG2  ILE  37          3HG2      ILE  37  77.363   0.961  -0.937
  306   1HD1  ILE  37          1HD1      ILE  37  73.997   2.571  -0.699
  307   2HD1  ILE  37          2HD1      ILE  37  74.349   2.818  -2.409
  308   3HD1  ILE  37          3HD1      ILE  37  74.015   4.200  -1.368
  309    H    LYS  38           H        LYS  38  78.183   4.622  -0.052
  310    HA   LYS  38           HA       LYS  38  79.821   2.678   1.530
  311   1HB   LYS  38          2HB       LYS  38  81.116   4.657   0.633
  312   2HB   LYS  38          1HB       LYS  38  80.062   5.701   1.595
  313   1HG   LYS  38          2HG       LYS  38  80.747   4.566   3.645
  314   2HG   LYS  38          1HG       LYS  38  81.723   3.430   2.716
  315   1HD   LYS  38          2HD       LYS  38  83.149   5.184   3.673
  316   2HD   LYS  38          1HD       LYS  38  83.127   5.315   1.914
  317   1HE   LYS  38          2HE       LYS  38  81.959   7.306   1.946
  318   2HE   LYS  38          1HE       LYS  38  81.070   6.878   3.422
  319   1HZ   LYS  38          1HZ       LYS  38  82.863   8.583   3.737
  320   2HZ   LYS  38          2HZ       LYS  38  83.996   7.372   3.369
  321   3HZ   LYS  38          3HZ       LYS  38  82.996   7.219   4.735
  322    H    ILE  39           H        ILE  39  79.214   2.522   3.725
  323    HA   ILE  39           HA       ILE  39  76.790   4.101   4.540
  324    HB   ILE  39           HB       ILE  39  76.332   2.130   6.015
  325   1HG1  ILE  39          2HG1      ILE  39  78.510   0.712   4.463
  326   2HG1  ILE  39          1HG1      ILE  39  78.815   1.450   6.036
  327   1HG2  ILE  39          1HG2      ILE  39  75.482   2.393   3.617
  328   2HG2  ILE  39          2HG2      ILE  39  75.447   0.766   4.293
  329   3HG2  ILE  39          3HG2      ILE  39  76.722   1.224   3.162
  330   1HD1  ILE  39          1HD1      ILE  39  77.985  -1.104   5.754
  331   2HD1  ILE  39          2HD1      ILE  39  76.420  -0.296   5.856
  332   3HD1  ILE  39          3HD1      ILE  39  77.591  -0.120   7.162
  333    H    VAL  40           H        VAL  40  76.756   4.905   6.688
  334    HA   VAL  40           HA       VAL  40  79.234   4.594   8.323
  335    HB   VAL  40           HB       VAL  40  77.848   7.205   7.613
  336   1HG1  VAL  40          1HG1      VAL  40  79.908   6.430   9.616
  337   2HG1  VAL  40          2HG1      VAL  40  78.744   7.754   9.654
  338   3HG1  VAL  40          3HG1      VAL  40  80.226   7.910   8.713
  339   1HG2  VAL  40          1HG2      VAL  40  79.106   6.883   5.711
  340   2HG2  VAL  40          2HG2      VAL  40  80.200   5.747   6.501
  341   3HG2  VAL  40          3HG2      VAL  40  80.404   7.481   6.743
  342    H    LYS  41           H        LYS  41  78.618   4.011  10.343
  343    HA   LYS  41           HA       LYS  41  76.080   5.099  11.480
  344   1HB   LYS  41          2HB       LYS  41  75.704   2.817  10.628
  345   2HB   LYS  41          1HB       LYS  41  77.073   2.232  11.567
  346   1HG   LYS  41          2HG       LYS  41  74.988   1.746  12.759
  347   2HG   LYS  41          1HG       LYS  41  75.921   2.946  13.653
  348   1HD   LYS  41          2HD       LYS  41  74.523   4.730  12.914
  349   2HD   LYS  41          1HD       LYS  41  73.766   3.724  11.683
  350   1HE   LYS  41          2HE       LYS  41  72.454   2.568  13.246
  351   2HE   LYS  41          1HE       LYS  41  73.564   2.930  14.584
  352   1HZ   LYS  41          1HZ       LYS  41  71.922   4.923  13.109
  353   2HZ   LYS  41          2HZ       LYS  41  72.998   5.271  14.377
  354   3HZ   LYS  41          3HZ       LYS  41  71.600   4.352  14.673
  355    H    TYR  42           H        TYR  42  76.198   5.472  13.720
  356    HA   TYR  42           HA       TYR  42  78.973   5.423  14.845
  357   1HB   TYR  42          2HB       TYR  42  77.590   7.549  14.497
  358   2HB   TYR  42          1HB       TYR  42  76.554   6.970  15.802
  359    HD1  TYR  42           HD1      TYR  42  80.079   7.919  14.929
  360    HD2  TYR  42           HD2      TYR  42  77.215   7.147  18.120
  361    HE1  TYR  42           HE1      TYR  42  81.720   8.805  16.613
  362    HE2  TYR  42           HE2      TYR  42  78.858   8.034  19.806
  363    HH   TYR  42           HH       TYR  42  81.197   8.473  20.068
  364    H    GLU  43           H        GLU  43  79.409   4.086  16.567
  365    HA   GLU  43           HA       GLU  43  77.148   3.227  18.319
  366   1HB   GLU  43          2HB       GLU  43  78.026   0.903  18.207
  367   2HB   GLU  43          1HB       GLU  43  77.522   1.484  16.621
  368   1HG   GLU  43          2HG       GLU  43  79.878   2.062  16.099
  369   2HG   GLU  43          1HG       GLU  43  80.368   1.424  17.669
  370    H    GLY  44           H        GLY  44  77.716   3.181  20.473
  371   1HA   GLY  44          2HA       GLY  44  79.002   3.531  22.402
  372   2HA   GLY  44          1HA       GLY  44  80.331   2.760  21.535
  373    H    GLU  45           H        GLU  45  82.064   4.091  21.621
  374    HA   GLU  45           HA       GLU  45  81.644   7.036  21.382
  375   1HB   GLU  45          2HB       GLU  45  83.816   7.203  22.485
  376   2HB   GLU  45          1HB       GLU  45  82.783   6.105  23.392
  377   1HG   GLU  45          2HG       GLU  45  83.899   4.170  22.332
  378   2HG   GLU  45          1HG       GLU  45  84.921   5.266  21.404
  379    H    GLU  46           H        GLU  46  82.225   4.608  19.238
  380    HA   GLU  46           HA       GLU  46  84.113   6.293  17.640
  381   1HB   GLU  46          2HB       GLU  46  85.148   4.159  16.898
  382   2HB   GLU  46          1HB       GLU  46  85.255   4.373  18.643
  383   1HG   GLU  46          2HG       GLU  46  83.231   2.938  18.911
  384   2HG   GLU  46          1HG       GLU  46  83.227   2.667  17.169
  385    HA   PRO  47           HA       PRO  47  80.988   5.580  14.468
  386   1HB   PRO  47          2HB       PRO  47  82.736   6.684  12.453
  387   2HB   PRO  47          1HB       PRO  47  81.320   7.438  13.200
  388   1HG   PRO  47          2HG       PRO  47  83.943   8.234  13.554
  389   2HG   PRO  47          1HG       PRO  47  82.579   8.668  14.591
  390   1HD   PRO  47          2HD       PRO  47  84.732   6.688  15.042
  391   2HD   PRO  47          1HD       PRO  47  83.790   7.635  16.214
  392    H    LYS  48           H        LYS  48  80.732   3.903  12.985
  393    HA   LYS  48           HA       LYS  48  83.183   2.443  12.065
  394   1HB   LYS  48          2HB       LYS  48  80.396   1.417  12.699
  395   2HB   LYS  48          1HB       LYS  48  81.709   0.434  12.050
  396   1HG   LYS  48          2HG       LYS  48  81.891   1.974  14.651
  397   2HG   LYS  48          1HG       LYS  48  81.464   0.265  14.544
  398   1HD   LYS  48          2HD       LYS  48  83.608  -0.135  13.309
  399   2HD   LYS  48          1HD       LYS  48  84.050   1.543  13.626
  400   1HE   LYS  48          2HE       LYS  48  84.586   1.109  15.801
  401   2HE   LYS  48          1HE       LYS  48  83.177   0.054  16.029
  402   1HZ   LYS  48          1HZ       LYS  48  84.278  -1.658  14.741
  403   2HZ   LYS  48          2HZ       LYS  48  85.258  -1.211  16.054
  404   3HZ   LYS  48          3HZ       LYS  48  85.622  -0.655  14.490
  405    H    GLU  49           H        GLU  49  83.325   2.191   9.841
  406    HA   GLU  49           HA       GLU  49  80.957   2.979   8.180
  407   1HB   GLU  49          2HB       GLU  49  83.849   3.870   7.948
  408   2HB   GLU  49          1HB       GLU  49  82.572   4.293   6.809
  409   1HG   GLU  49          2HG       GLU  49  81.300   5.351   8.670
  410   2HG   GLU  49          1HG       GLU  49  82.638   4.992   9.760
  411    H    GLY  50           H        GLY  50  81.251   2.311   5.864
  412   1HA   GLY  50          2HA       GLY  50  83.277   0.293   5.248
  413   2HA   GLY  50          1HA       GLY  50  81.639  -0.352   5.371
  414    H    THR  51           H        THR  51  83.650   0.309   3.055
  415    HA   THR  51           HA       THR  51  81.577   1.587   1.294
  416    HB   THR  51           HB       THR  51  84.558   1.663   0.812
  417    HG1  THR  51           HG1      THR  51  84.778   3.043   2.352
  418   1HG2  THR  51          1HG2      THR  51  82.348   2.517  -0.659
  419   2HG2  THR  51          2HG2      THR  51  84.015   3.046  -0.889
  420   3HG2  THR  51          3HG2      THR  51  82.925   3.988   0.127
  421    H    PHE  52           H        PHE  52  81.051   0.383  -0.523
  422    HA   PHE  52           HA       PHE  52  82.916  -1.654  -1.552
  423   1HB   PHE  52          2HB       PHE  52  81.522  -3.545  -1.052
  424   2HB   PHE  52          1HB       PHE  52  81.656  -2.624   0.438
  425    HD1  PHE  52           HD1      PHE  52  79.409  -4.161  -1.895
  426    HD2  PHE  52           HD2      PHE  52  79.720  -0.843   0.911
  427    HE1  PHE  52           HE1      PHE  52  76.904  -3.992  -1.820
  428    HE2  PHE  52           HE2      PHE  52  77.210  -0.676   0.987
  429    HZ   PHE  52           HZ       PHE  52  75.804  -2.252  -0.386
  430    H    THR  53           H        THR  53  81.811  -2.855  -3.466
  431    HA   THR  53           HA       THR  53  80.067  -0.944  -4.987
  432    HB   THR  53           HB       THR  53  81.855  -3.211  -5.934
  433    HG1  THR  53           HG1      THR  53  83.371  -1.797  -5.755
  434   1HG2  THR  53          1HG2      THR  53  80.255  -1.086  -7.372
  435   2HG2  THR  53          2HG2      THR  53  80.114  -2.836  -7.538
  436   3HG2  THR  53          3HG2      THR  53  81.544  -2.004  -8.149
  437    H    ALA  54           H        ALA  54  78.078  -1.716  -5.715
  438    HA   ALA  54           HA       ALA  54  77.390  -4.580  -5.211
  439   1HB   ALA  54          1HB       ALA  54  76.833  -2.498  -3.487
  440   2HB   ALA  54          2HB       ALA  54  75.921  -4.004  -3.560
  441   3HB   ALA  54          3HB       ALA  54  75.356  -2.587  -4.444
  442    H    ARG  55           H        ARG  55  75.759  -5.389  -6.569
  443    HA   ARG  55           HA       ARG  55  75.004  -3.692  -8.895
  444   1HB   ARG  55          2HB       ARG  55  75.960  -6.065  -9.029
  445   2HB   ARG  55          1HB       ARG  55  74.415  -6.616  -8.380
  446   1HG   ARG  55          2HG       ARG  55  73.265  -5.420 -10.265
  447   2HG   ARG  55          1HG       ARG  55  74.853  -5.070 -10.949
  448   1HD   ARG  55          2HD       ARG  55  75.301  -7.582 -10.910
  449   2HD   ARG  55          1HD       ARG  55  73.577  -7.789 -10.539
  450    HE   ARG  55           HE       ARG  55  74.055  -6.011 -12.808
  451   1HH1  ARG  55          1HH1      ARG  55  73.616  -9.353 -11.826
  452   2HH1  ARG  55          2HH1      ARG  55  73.087  -9.840 -13.397
  453   1HH2  ARG  55          1HH2      ARG  55  73.366  -6.701 -14.813
  454   2HH2  ARG  55          2HH2      ARG  55  72.946  -8.362 -15.068
  455    H    VAL  56           H        VAL  56  72.835  -3.215  -9.338
  456    HA   VAL  56           HA       VAL  56  70.977  -3.231  -7.074
  457    HB   VAL  56           HB       VAL  56  70.773  -2.348  -9.974
  458   1HG1  VAL  56          1HG1      VAL  56  68.997  -1.049  -8.027
  459   2HG1  VAL  56          2HG1      VAL  56  68.650  -2.766  -8.217
  460   3HG1  VAL  56          3HG1      VAL  56  68.632  -1.702  -9.625
  461   1HG2  VAL  56          1HG2      VAL  56  72.387  -1.313  -8.083
  462   2HG2  VAL  56          2HG2      VAL  56  70.902  -0.459  -7.673
  463   3HG2  VAL  56          3HG2      VAL  56  71.588  -0.306  -9.290
  464    H    GLY  57           H        GLY  57  69.561  -4.818  -6.665
  465   1HA   GLY  57          2HA       GLY  57  68.976  -6.837  -8.780
  466   2HA   GLY  57          1HA       GLY  57  68.792  -7.109  -7.048
  467    H    GLU  58           H        GLU  58  66.621  -7.851  -7.850
  468    HA   GLU  58           HA       GLU  58  64.644  -6.080  -8.913
  469   1HB   GLU  58          2HB       GLU  58  64.552  -8.583  -8.755
  470   2HB   GLU  58          1HB       GLU  58  64.305  -8.427  -7.016
  471   1HG   GLU  58          2HG       GLU  58  62.264  -7.075  -7.453
  472   2HG   GLU  58          1HG       GLU  58  62.492  -7.321  -9.180
  473    H    GLN  59           H        GLN  59  62.951  -4.941  -7.813
  474    HA   GLN  59           HA       GLN  59  62.117  -3.458  -6.188
  475   1HB   GLN  59          2HB       GLN  59  63.105  -5.837  -4.613
  476   2HB   GLN  59          1HB       GLN  59  62.283  -4.488  -3.828
  477   1HG   GLN  59          2HG       GLN  59  60.332  -4.791  -5.268
  478   2HG   GLN  59          1HG       GLN  59  61.152  -6.080  -6.146
  479   1HE2  GLN  59          1HE2      GLN  59  61.123  -8.181  -5.233
  480   2HE2  GLN  59          2HE2      GLN  59  60.402  -8.546  -3.742
  481    H    GLY  60           H        GLY  60  65.184  -3.370  -6.919
  482   1HA   GLY  60          2HA       GLY  60  66.793  -1.737  -6.413
  483   2HA   GLY  60          1HA       GLY  60  65.635  -1.063  -5.271
  484    H    SER  61           H        SER  61  66.507  -4.398  -4.835
  485    HA   SER  61           HA       SER  61  67.534  -3.803  -2.174
  486   1HB   SER  61          2HB       SER  61  66.127  -5.784  -2.902
  487   2HB   SER  61          1HB       SER  61  67.554  -6.411  -3.722
  488    HG   SER  61           HG       SER  61  68.550  -6.673  -1.801
  489    H    VAL  62           H        VAL  62  69.654  -4.007  -1.454
  490    HA   VAL  62           HA       VAL  62  71.770  -4.811  -3.391
  491    HB   VAL  62           HB       VAL  62  71.547  -2.354  -3.457
  492   1HG1  VAL  62          1HG1      VAL  62  70.551  -2.049  -1.219
  493   2HG1  VAL  62          2HG1      VAL  62  71.968  -1.019  -1.426
  494   3HG1  VAL  62          3HG1      VAL  62  72.086  -2.499  -0.474
  495   1HG2  VAL  62          1HG2      VAL  62  73.846  -3.690  -3.283
  496   2HG2  VAL  62          2HG2      VAL  62  73.994  -2.767  -1.788
  497   3HG2  VAL  62          3HG2      VAL  62  73.817  -1.927  -3.328
  498    H    ILE  63           H        ILE  63  73.547  -5.844  -2.359
  499    HA   ILE  63           HA       ILE  63  73.074  -6.524   0.521
  500    HB   ILE  63           HB       ILE  63  74.594  -7.983  -1.669
  501   1HG1  ILE  63          2HG1      ILE  63  72.186  -7.868  -2.187
  502   2HG1  ILE  63          1HG1      ILE  63  72.637  -9.508  -1.727
  503   1HG2  ILE  63          1HG2      ILE  63  75.373  -8.583   0.561
  504   2HG2  ILE  63          2HG2      ILE  63  74.423  -9.912  -0.101
  505   3HG2  ILE  63          3HG2      ILE  63  73.714  -8.837   1.104
  506   1HD1  ILE  63          1HD1      ILE  63  71.795  -9.109   0.556
  507   2HD1  ILE  63          2HD1      ILE  63  70.526  -8.817  -0.634
  508   3HD1  ILE  63          3HD1      ILE  63  71.364  -7.458   0.113
  509    H    ILE  64           H        ILE  64  74.524  -5.733   1.964
  510    HA   ILE  64           HA       ILE  64  77.133  -4.612   1.158
  511    HB   ILE  64           HB       ILE  64  75.819  -5.160   3.847
  512   1HG1  ILE  64          2HG1      ILE  64  76.119  -2.515   2.405
  513   2HG1  ILE  64          1HG1      ILE  64  74.689  -3.532   2.225
  514   1HG2  ILE  64          1HG2      ILE  64  78.322  -4.938   3.909
  515   2HG2  ILE  64          2HG2      ILE  64  77.480  -3.660   4.787
  516   3HG2  ILE  64          3HG2      ILE  64  78.152  -3.337   3.188
  517   1HD1  ILE  64          1HD1      ILE  64  74.287  -1.885   3.982
  518   2HD1  ILE  64          2HD1      ILE  64  75.758  -2.380   4.818
  519   3HD1  ILE  64          3HD1      ILE  64  74.393  -3.491   4.702
  520    HA   PRO  65           HA       PRO  65  79.297  -8.490   1.513
  521   1HB   PRO  65          2HB       PRO  65  81.776  -7.611   2.269
  522   2HB   PRO  65          1HB       PRO  65  81.154  -7.418   0.614
  523   1HG   PRO  65          2HG       PRO  65  81.086  -5.456   2.879
  524   2HG   PRO  65          1HG       PRO  65  81.662  -5.211   1.217
  525   1HD   PRO  65          2HD       PRO  65  79.238  -4.400   1.889
  526   2HD   PRO  65          1HD       PRO  65  79.483  -5.240   0.336
  527    H    LYS  66           H        LYS  66  79.386  -9.962   3.175
  528    HA   LYS  66           HA       LYS  66  78.617  -9.404   5.839
  529   1HB   LYS  66          2HB       LYS  66  78.591 -11.610   4.668
  530   2HB   LYS  66          1HB       LYS  66  80.348 -11.673   4.805
  531   1HG   LYS  66          2HG       LYS  66  80.204 -11.638   7.238
  532   2HG   LYS  66          1HG       LYS  66  78.453 -11.439   7.160
  533   1HD   LYS  66          2HD       LYS  66  78.846 -13.767   7.571
  534   2HD   LYS  66          1HD       LYS  66  78.383 -13.636   5.875
  535   1HE   LYS  66          2HE       LYS  66  81.068 -13.340   5.628
  536   2HE   LYS  66          1HE       LYS  66  81.002 -14.390   7.056
  537   1HZ   LYS  66          1HZ       LYS  66  80.922 -15.751   5.092
  538   2HZ   LYS  66          2HZ       LYS  66  79.632 -14.844   4.459
  539   3HZ   LYS  66          3HZ       LYS  66  79.403 -15.798   5.846
  540    H    ALA  67           H        ALA  67  81.837  -9.509   4.392
  541    HA   ALA  67           HA       ALA  67  83.442  -9.557   6.741
  542   1HB   ALA  67          1HB       ALA  67  85.181  -8.772   5.263
  543   2HB   ALA  67          2HB       ALA  67  84.001  -8.031   4.180
  544   3HB   ALA  67          3HB       ALA  67  84.111  -9.788   4.298
  545    H    LEU  68           H        LEU  68  81.902  -6.837   5.056
  546    HA   LEU  68           HA       LEU  68  83.072  -4.806   6.802
  547   1HB   LEU  68          2HB       LEU  68  80.835  -4.832   4.759
  548   2HB   LEU  68          1HB       LEU  68  81.352  -3.370   5.597
  549    HG   LEU  68           HG       LEU  68  83.124  -5.131   3.867
  550   1HD1  LEU  68          1HD1      LEU  68  82.521  -2.269   3.264
  551   2HD1  LEU  68          2HD1      LEU  68  81.264  -3.457   2.921
  552   3HD1  LEU  68          3HD1      LEU  68  82.848  -3.603   2.158
  553   1HD2  LEU  68          1HD2      LEU  68  83.632  -2.727   5.606
  554   2HD2  LEU  68          2HD2      LEU  68  84.590  -2.958   4.143
  555   3HD2  LEU  68          3HD2      LEU  68  84.609  -4.183   5.412
  556    H    ARG  69           H        ARG  69  80.040  -6.664   6.729
  557    HA   ARG  69           HA       ARG  69  78.503  -5.167   8.615
  558   1HB   ARG  69          2HB       ARG  69  78.723  -8.186   8.310
  559   2HB   ARG  69          1HB       ARG  69  77.361  -7.314   9.000
  560   1HG   ARG  69          2HG       ARG  69  77.089  -6.175   6.745
  561   2HG   ARG  69          1HG       ARG  69  78.270  -7.327   6.115
  562   1HD   ARG  69          2HD       ARG  69  76.688  -9.086   7.356
  563   2HD   ARG  69          1HD       ARG  69  75.477  -7.824   7.068
  564    HE   ARG  69           HE       ARG  69  76.699  -7.976   4.630
  565   1HH1  ARG  69          1HH1      ARG  69  75.399 -10.464   6.746
  566   2HH1  ARG  69          2HH1      ARG  69  75.060 -11.531   5.430
  567   1HH2  ARG  69          1HH2      ARG  69  76.227  -9.399   2.981
  568   2HH2  ARG  69          2HH2      ARG  69  75.519 -10.940   3.328
  569    H    ASP  70           H        ASP  70  80.822  -7.820   9.111
  570    HA   ASP  70           HA       ASP  70  80.534  -7.938  11.972
  571   1HB   ASP  70          2HB       ASP  70  82.745  -8.828  10.090
  572   2HB   ASP  70          1HB       ASP  70  82.603  -9.338  11.772
  573    H    VAL  71           H        VAL  71  83.054  -6.459   9.900
  574    HA   VAL  71           HA       VAL  71  84.731  -5.485  11.991
  575    HB   VAL  71           HB       VAL  71  84.141  -4.449   9.193
  576   1HG1  VAL  71          1HG1      VAL  71  86.512  -3.893  11.004
  577   2HG1  VAL  71          2HG1      VAL  71  85.275  -2.727  10.536
  578   3HG1  VAL  71          3HG1      VAL  71  86.370  -3.386   9.321
  579   1HG2  VAL  71          1HG2      VAL  71  86.515  -6.083  10.082
  580   2HG2  VAL  71          2HG2      VAL  71  85.867  -5.876   8.455
  581   3HG2  VAL  71          3HG2      VAL  71  84.998  -6.862   9.631
  582    H    ILE  72           H        ILE  72  81.907  -4.032  10.420
  583    HA   ILE  72           HA       ILE  72  82.175  -1.491  11.830
  584    HB   ILE  72           HB       ILE  72  79.949  -2.695  10.141
  585   1HG1  ILE  72          2HG1      ILE  72  82.158  -0.752   9.383
  586   2HG1  ILE  72          1HG1      ILE  72  82.198  -2.479   9.030
  587   1HG2  ILE  72          1HG2      ILE  72  79.505  -0.624  11.709
  588   2HG2  ILE  72          2HG2      ILE  72  78.978  -0.564  10.029
  589   3HG2  ILE  72          3HG2      ILE  72  80.464   0.247  10.516
  590   1HD1  ILE  72          1HD1      ILE  72  79.841  -2.027   7.955
  591   2HD1  ILE  72          2HD1      ILE  72  81.303  -1.623   7.054
  592   3HD1  ILE  72          3HD1      ILE  72  80.406  -0.356   7.892
  593    H    GLY  73           H        GLY  73  80.649  -4.549  12.557
  594   1HA   GLY  73          2HA       GLY  73  79.614  -5.199  14.568
  595   2HA   GLY  73          1HA       GLY  73  79.863  -3.559  15.167
  596    H    ILE  74           H        ILE  74  78.145  -4.386  12.191
  597    HA   ILE  74           HA       ILE  74  75.846  -2.789  13.134
  598    HB   ILE  74           HB       ILE  74  76.444  -4.142  10.481
  599   1HG1  ILE  74          2HG1      ILE  74  78.195  -2.512  11.077
  600   2HG1  ILE  74          1HG1      ILE  74  77.207  -1.893   9.757
  601   1HG2  ILE  74          1HG2      ILE  74  74.350  -2.198  11.416
  602   2HG2  ILE  74          2HG2      ILE  74  74.163  -3.636  10.412
  603   3HG2  ILE  74          3HG2      ILE  74  74.885  -2.176   9.735
  604   1HD1  ILE  74          1HD1      ILE  74  77.544  -0.856  12.489
  605   2HD1  ILE  74          2HD1      ILE  74  75.859  -0.965  11.981
  606   3HD1  ILE  74          3HD1      ILE  74  77.007  -0.024  11.029
  607    H    LYS  75           H        LYS  75  73.768  -3.590  13.452
  608    HA   LYS  75           HA       LYS  75  73.358  -6.544  13.151
  609   1HB   LYS  75          2HB       LYS  75  72.244  -6.490  15.352
  610   2HB   LYS  75          1HB       LYS  75  73.895  -5.893  15.479
  611   1HG   LYS  75          2HG       LYS  75  72.412  -3.599  14.905
  612   2HG   LYS  75          1HG       LYS  75  71.367  -4.504  15.993
  613   1HD   LYS  75          2HD       LYS  75  74.281  -3.871  16.546
  614   2HD   LYS  75          1HD       LYS  75  72.915  -2.973  17.212
  615   1HE   LYS  75          2HE       LYS  75  72.417  -4.617  18.728
  616   2HE   LYS  75          1HE       LYS  75  72.800  -5.920  17.584
  617   1HZ   LYS  75          1HZ       LYS  75  74.504  -5.858  19.249
  618   2HZ   LYS  75          2HZ       LYS  75  74.737  -4.190  19.027
  619   3HZ   LYS  75          3HZ       LYS  75  75.164  -5.281  17.797
  620    HA   PRO  76           HA       PRO  76  69.565  -5.685  11.121
  621   1HB   PRO  76          2HB       PRO  76  67.742  -7.268  12.538
  622   2HB   PRO  76          1HB       PRO  76  68.749  -7.814  11.186
  623   1HG   PRO  76          2HG       PRO  76  69.138  -8.175  14.100
  624   2HG   PRO  76          1HG       PRO  76  69.570  -9.245  12.758
  625   1HD   PRO  76          2HD       PRO  76  71.399  -7.776  14.091
  626   2HD   PRO  76          1HD       PRO  76  71.562  -8.171  12.366
  627    H    GLY  77           H        GLY  77  68.041  -4.069  11.286
  628   1HA   GLY  77          2HA       GLY  77  66.301  -2.810  12.335
  629   2HA   GLY  77          1HA       GLY  77  66.785  -3.476  13.890
  630    H    GLU  78           H        GLU  78  69.639  -2.479  12.506
  631    HA   GLU  78           HA       GLU  78  69.593   0.072  14.030
  632   1HB   GLU  78          2HB       GLU  78  71.581  -1.931  13.119
  633   2HB   GLU  78          1HB       GLU  78  72.144  -0.259  13.121
  634   1HG   GLU  78          2HG       GLU  78  71.263  -0.065  15.487
  635   2HG   GLU  78          1HG       GLU  78  70.990  -1.806  15.457
  636    H    VAL  79           H        VAL  79  69.488   2.010  12.996
  637    HA   VAL  79           HA       VAL  79  69.290   2.008  10.053
  638    HB   VAL  79           HB       VAL  79  67.610   3.079  11.512
  639   1HG1  VAL  79          1HG1      VAL  79  69.173   5.430  12.245
  640   2HG1  VAL  79          2HG1      VAL  79  69.848   3.968  12.961
  641   3HG1  VAL  79          3HG1      VAL  79  68.165   4.397  13.257
  642   1HG2  VAL  79          1HG2      VAL  79  67.366   5.069  10.239
  643   2HG2  VAL  79          2HG2      VAL  79  68.265   3.974   9.190
  644   3HG2  VAL  79          3HG2      VAL  79  69.109   5.260  10.053
  645    H    ILE  80           H        ILE  80  70.880   2.695   8.738
  646    HA   ILE  80           HA       ILE  80  73.152   4.290   9.867
  647    HB   ILE  80           HB       ILE  80  74.527   3.106   8.165
  648   1HG1  ILE  80          2HG1      ILE  80  72.000   1.539   7.561
  649   2HG1  ILE  80          1HG1      ILE  80  72.654   2.811   6.528
  650   1HG2  ILE  80          1HG2      ILE  80  73.836   2.121  10.515
  651   2HG2  ILE  80          2HG2      ILE  80  74.714   1.119   9.362
  652   3HG2  ILE  80          3HG2      ILE  80  72.969   0.939   9.538
  653   1HD1  ILE  80          1HD1      ILE  80  74.532   0.654   7.367
  654   2HD1  ILE  80          2HD1      ILE  80  74.433   1.528   5.837
  655   3HD1  ILE  80          3HD1      ILE  80  73.297   0.224   6.183
  656    H    GLU  81           H        GLU  81  74.096   5.821   8.306
  657    HA   GLU  81           HA       GLU  81  72.113   6.913   6.360
  658   1HB   GLU  81          2HB       GLU  81  73.124   8.352   8.152
  659   2HB   GLU  81          1HB       GLU  81  74.716   8.039   7.460
  660   1HG   GLU  81          2HG       GLU  81  73.932   9.008   5.302
  661   2HG   GLU  81          1HG       GLU  81  72.391   9.400   6.067
  662    H    VAL  82           H        VAL  82  72.486   6.597   4.226
  663    HA   VAL  82           HA       VAL  82  75.029   5.247   3.450
  664    HB   VAL  82           HB       VAL  82  72.197   5.153   2.351
  665   1HG1  VAL  82          1HG1      VAL  82  73.698   4.673   0.545
  666   2HG1  VAL  82          2HG1      VAL  82  73.112   3.117   1.134
  667   3HG1  VAL  82          3HG1      VAL  82  74.725   3.677   1.578
  668   1HG2  VAL  82          1HG2      VAL  82  73.792   3.466   4.257
  669   2HG2  VAL  82          2HG2      VAL  82  72.575   2.696   3.238
  670   3HG2  VAL  82          3HG2      VAL  82  72.105   3.971   4.362
  671    H    LEU  83           H        LEU  83  76.299   6.218   1.980
  672    HA   LEU  83           HA       LEU  83  75.222   8.513   0.369
  673   1HB   LEU  83          2HB       LEU  83  78.101   7.905   1.151
  674   2HB   LEU  83          1HB       LEU  83  77.479   9.411   0.492
  675    HG   LEU  83           HG       LEU  83  76.771   8.253   3.206
  676   1HD1  LEU  83          1HD1      LEU  83  79.110   9.162   2.924
  677   2HD1  LEU  83          2HD1      LEU  83  78.136  10.014   4.125
  678   3HD1  LEU  83          3HD1      LEU  83  78.387  10.724   2.530
  679   1HD2  LEU  83          1HD2      LEU  83  74.973   9.577   2.078
  680   2HD2  LEU  83          2HD2      LEU  83  76.085  10.944   1.987
  681   3HD2  LEU  83          3HD2      LEU  83  75.563  10.332   3.559
  682    H    LEU  84           H        LEU  84  75.234   8.130  -1.847
  683    HA   LEU  84           HA       LEU  84  76.614   5.774  -2.979
  684   1HB   LEU  84          2HB       LEU  84  74.758   7.937  -3.911
  685   2HB   LEU  84          1HB       LEU  84  75.715   7.066  -5.115
  686    HG   LEU  84           HG       LEU  84  74.297   5.466  -3.027
  687   1HD1  LEU  84          1HD1      LEU  84  72.225   6.090  -3.650
  688   2HD1  LEU  84          2HD1      LEU  84  72.591   5.695  -5.328
  689   3HD1  LEU  84          3HD1      LEU  84  72.908   7.315  -4.713
  690   1HD2  LEU  84          1HD2      LEU  84  75.408   5.155  -5.774
  691   2HD2  LEU  84          2HD2      LEU  84  73.989   4.184  -5.380
  692   3HD2  LEU  84          3HD2      LEU  84  75.453   4.040  -4.409
  693    H    LEU  85           H        LEU  85  78.559   5.877  -4.079
  694    HA   LEU  85           HA       LEU  85  80.009   8.480  -3.939
  695   1HB   LEU  85          2HB       LEU  85  80.653   5.587  -3.597
  696   2HB   LEU  85          1HB       LEU  85  81.935   6.631  -4.218
  697    HG   LEU  85           HG       LEU  85  80.328   7.413  -1.789
  698   1HD1  LEU  85          1HD1      LEU  85  82.156   6.435  -0.416
  699   2HD1  LEU  85          2HD1      LEU  85  82.851   5.731  -1.876
  700   3HD1  LEU  85          3HD1      LEU  85  81.268   5.201  -1.309
  701   1HD2  LEU  85          1HD2      LEU  85  83.109   8.087  -2.805
  702   2HD2  LEU  85          2HD2      LEU  85  82.400   8.707  -1.313
  703   3HD2  LEU  85          3HD2      LEU  85  81.698   9.143  -2.871
  704    H    GLY  86           H        GLY  86  79.160   5.825  -6.130
  705   1HA   GLY  86          2HA       GLY  86  79.743   7.474  -8.477
  706   2HA   GLY  86          1HA       GLY  86  80.951   6.220  -8.233
  707    H    HIS  87           H        HIS  87  79.846   5.817 -10.511
  708    HA   HIS  87           HA       HIS  87  77.817   3.656 -10.122
  709   1HB   HIS  87          2HB       HIS  87  76.502   4.656 -11.986
  710   2HB   HIS  87          1HB       HIS  87  76.645   5.768 -10.629
  711    HD1  HIS  87           HD1      HIS  87  77.361   5.460 -14.214
  712    HD2  HIS  87           HD2      HIS  87  78.693   7.852 -11.072
  713    HE1  HIS  87           HE1      HIS  87  78.542   7.436 -15.269
  714    H    TYR  88           H        TYR  88  77.840   2.063 -11.835
  715    HA   TYR  88           HA       TYR  88  79.983   2.364 -13.899
  716   1HB   TYR  88          2HB       TYR  88  79.437   0.054 -12.014
  717   2HB   TYR  88          1HB       TYR  88  80.466  -0.092 -13.441
  718    HD1  TYR  88           HD1      TYR  88  80.118   1.420 -10.063
  719    HD2  TYR  88           HD2      TYR  88  82.642   1.078 -13.598
  720    HE1  TYR  88           HE1      TYR  88  82.046   2.407  -8.784
  721    HE2  TYR  88           HE2      TYR  88  84.569   2.064 -12.318
  722    HH   TYR  88           HH       TYR  88  84.604   3.760 -10.037
  723    H    LYS  89           H        LYS  89  79.359   1.634 -15.914
  724    HA   LYS  89           HA       LYS  89  76.659   0.346 -16.146
  725   1HB   LYS  89          2HB       LYS  89  78.157   2.460 -17.647
  726   2HB   LYS  89          1HB       LYS  89  77.024   1.450 -18.546
  727   1HG   LYS  89          2HG       LYS  89  75.370   1.990 -16.602
  728   2HG   LYS  89          1HG       LYS  89  76.469   3.328 -16.261
  729   1HD   LYS  89          2HD       LYS  89  75.972   4.424 -18.233
  730   2HD   LYS  89          1HD       LYS  89  75.596   2.929 -19.091
  731   1HE   LYS  89          2HE       LYS  89  73.631   2.912 -17.198
  732   2HE   LYS  89          1HE       LYS  89  73.820   4.656 -17.468
  733   1HZ   LYS  89          1HZ       LYS  89  73.534   2.612 -19.609
  734   2HZ   LYS  89          2HZ       LYS  89  73.682   4.289 -19.840
  735   3HZ   LYS  89          3HZ       LYS  89  72.299   3.651 -19.087
  736    HA   PRO  90           HA       PRO  90  79.352  -3.099 -17.510
  737   1HB   PRO  90          2HB       PRO  90  76.607  -4.139 -18.152
  738   2HB   PRO  90          1HB       PRO  90  77.963  -4.964 -17.350
  739   1HG   PRO  90          2HG       PRO  90  75.984  -4.114 -15.883
  740   2HG   PRO  90          1HG       PRO  90  77.647  -3.794 -15.350
  741   1HD   PRO  90          2HD       PRO  90  75.708  -1.929 -16.678
  742   2HD   PRO  90          1HD       PRO  90  76.787  -1.635 -15.291
  743    H    ARG  91           H        ARG  91  80.021  -3.740 -19.596
  744    HA   ARG  91           HA       ARG  91  78.519  -2.555 -21.912
  745   1HB   ARG  91          2HB       ARG  91  80.636  -1.396 -21.269
  746   2HB   ARG  91          1HB       ARG  91  81.510  -2.908 -21.519
  747   1HG   ARG  91          2HG       ARG  91  80.723  -2.942 -23.879
  748   2HG   ARG  91          1HG       ARG  91  79.937  -1.385 -23.618
  749   1HD   ARG  91          2HD       ARG  91  82.161  -0.406 -23.001
  750   2HD   ARG  91          1HD       ARG  91  82.915  -1.958 -23.416
  751    HE   ARG  91           HE       ARG  91  81.159  -0.896 -25.510
  752   1HH1  ARG  91          1HH1      ARG  91  84.434  -0.962 -24.245
  753   2HH1  ARG  91          2HH1      ARG  91  85.128  -0.540 -25.771
  754   1HH2  ARG  91          1HH2      ARG  91  82.114  -0.353 -27.450
  755   2HH2  ARG  91          2HH2      ARG  91  83.835  -0.198 -27.561
  756    H    ASN  92           H        ASN  92  78.256  -3.904 -23.701
  757    HA   ASN  92           HA       ASN  92  79.707  -6.485 -23.853
  758   1HB   ASN  92          2HB       ASN  92  77.639  -6.639 -22.336
  759   2HB   ASN  92          1HB       ASN  92  76.683  -6.380 -23.795
  760   1HD2  ASN  92          1HD2      ASN  92  75.922  -8.373 -24.515
  761   2HD2  ASN  92          2HD2      ASN  92  76.832  -9.805 -24.559
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1  82.675  14.438   1.145
    2   2H    MET   1          2H        MET   1  84.094  13.514   1.289
    3   3H    MET   1          3H        MET   1  82.594  12.745   1.070
    4    HA   MET   1           HA       MET   1  84.083  14.384  -0.912
    5   1HB   MET   1          2HB       MET   1  83.282  11.493  -0.543
    6   2HB   MET   1          1HB       MET   1  83.781  12.122  -2.114
    7   1HG   MET   1          2HG       MET   1  85.897  12.934  -1.063
    8   2HG   MET   1          1HG       MET   1  85.410  12.152   0.441
    9   1HE   MET   1          1HE       MET   1  85.133  10.723  -3.473
   10   2HE   MET   1          2HE       MET   1  86.875  10.461  -3.468
   11   3HE   MET   1          3HE       MET   1  86.230  12.056  -3.087
   12    H    ASP   2           H        ASP   2  82.843  13.630  -3.138
   13    HA   ASP   2           HA       ASP   2  80.260  14.984  -3.086
   14   1HB   ASP   2          2HB       ASP   2  81.743  13.372  -5.192
   15   2HB   ASP   2          1HB       ASP   2  80.306  14.342  -5.511
   16    H    VAL   3           H        VAL   3  78.197  14.018  -3.357
   17    HA   VAL   3           HA       VAL   3  78.094  11.043  -3.209
   18    HB   VAL   3           HB       VAL   3  77.731  12.433  -1.055
   19   1HG1  VAL   3          1HG1      VAL   3  76.194  14.113  -2.177
   20   2HG1  VAL   3          2HG1      VAL   3  75.578  13.422  -0.674
   21   3HG1  VAL   3          3HG1      VAL   3  74.971  12.838  -2.228
   22   1HG2  VAL   3          1HG2      VAL   3  75.546  10.527  -1.934
   23   2HG2  VAL   3          2HG2      VAL   3  76.003  10.891  -0.269
   24   3HG2  VAL   3          3HG2      VAL   3  77.129  10.041  -1.328
   25    H    LEU   4           H        LEU   4  76.658  10.131  -4.648
   26    HA   LEU   4           HA       LEU   4  75.333  11.880  -6.601
   27   1HB   LEU   4          2HB       LEU   4  75.269   8.860  -6.310
   28   2HB   LEU   4          1HB       LEU   4  74.929   9.783  -7.767
   29    HG   LEU   4           HG       LEU   4  77.609   9.484  -6.368
   30   1HD1  LEU   4          1HD1      LEU   4  76.399   8.500  -8.932
   31   2HD1  LEU   4          2HD1      LEU   4  77.339   7.614  -7.731
   32   3HD1  LEU   4          3HD1      LEU   4  78.142   8.741  -8.826
   33   1HD2  LEU   4          1HD2      LEU   4  76.705  11.404  -8.515
   34   2HD2  LEU   4          2HD2      LEU   4  78.377  10.843  -8.470
   35   3HD2  LEU   4          3HD2      LEU   4  77.705  11.725  -7.093
   36    H    ALA   5           H        ALA   5  74.439  10.166  -3.699
   37    HA   ALA   5           HA       ALA   5  71.845  11.417  -3.629
   38   1HB   ALA   5          1HB       ALA   5  71.899   9.244  -5.263
   39   2HB   ALA   5          2HB       ALA   5  70.468   9.716  -4.346
   40   3HB   ALA   5          3HB       ALA   5  71.539   8.459  -3.725
   41    H    LYS   6           H        LYS   6  70.866  11.085  -1.533
   42    HA   LYS   6           HA       LYS   6  72.554   9.554   0.428
   43   1HB   LYS   6          2HB       LYS   6  73.038  12.006   0.300
   44   2HB   LYS   6          1HB       LYS   6  71.352  12.331   0.704
   45   1HG   LYS   6          2HG       LYS   6  71.619  11.150   2.841
   46   2HG   LYS   6          1HG       LYS   6  73.294  10.781   2.437
   47   1HD   LYS   6          2HD       LYS   6  73.518  13.370   2.124
   48   2HD   LYS   6          1HD       LYS   6  72.060  13.435   3.113
   49   1HE   LYS   6          2HE       LYS   6  73.387  11.801   4.694
   50   2HE   LYS   6          1HE       LYS   6  74.806  12.467   3.861
   51   1HZ   LYS   6          1HZ       LYS   6  74.052  13.776   5.842
   52   2HZ   LYS   6          2HZ       LYS   6  72.633  14.150   4.985
   53   3HZ   LYS   6          3HZ       LYS   6  74.144  14.665   4.400
   54    H    PHE   7           H        PHE   7  71.284   8.156   1.609
   55    HA   PHE   7           HA       PHE   7  68.544   8.979   2.400
   56   1HB   PHE   7          2HB       PHE   7  67.566   6.965   1.373
   57   2HB   PHE   7          1HB       PHE   7  68.372   7.955   0.161
   58    HD1  PHE   7           HD1      PHE   7  68.109   4.662   1.603
   59    HD2  PHE   7           HD2      PHE   7  70.872   7.352  -0.424
   60    HE1  PHE   7           HE1      PHE   7  69.539   2.700   0.942
   61    HE2  PHE   7           HE2      PHE   7  72.303   5.389  -1.077
   62    HZ   PHE   7           HZ       PHE   7  71.635   3.061  -0.389
   63    H    HIS   8           H        HIS   8  67.609   7.460   4.016
   64    HA   HIS   8           HA       HIS   8  69.775   6.194   5.669
   65   1HB   HIS   8          2HB       HIS   8  67.058   7.382   6.346
   66   2HB   HIS   8          1HB       HIS   8  68.176   6.698   7.525
   67    HD1  HIS   8           HD1      HIS   8  70.418   8.000   7.945
   68    HD2  HIS   8           HD2      HIS   8  67.749   9.955   5.408
   69    HE1  HIS   8           HE1      HIS   8  71.240  10.387   7.741
   70    H    THR   9           H        THR   9  69.544   4.058   6.274
   71    HA   THR   9           HA       THR   9  66.932   2.696   6.067
   72    HB   THR   9           HB       THR   9  68.009   2.635   3.790
   73    HG1  THR   9           HG1      THR   9  67.595   0.475   3.522
   74   1HG2  THR   9          1HG2      THR   9  70.365   2.561   4.496
   75   2HG2  THR   9          2HG2      THR   9  69.981   1.175   3.474
   76   3HG2  THR   9          3HG2      THR   9  70.101   0.975   5.223
   77    H    THR  10           H        THR  10  67.067   0.481   7.086
   78    HA   THR  10           HA       THR  10  69.359   0.309   9.008
   79    HB   THR  10           HB       THR  10  66.982   0.703   9.879
   80    HG1  THR  10           HG1      THR  10  68.289  -1.669  10.684
   81   1HG2  THR  10          1HG2      THR  10  65.297  -0.758   9.504
   82   2HG2  THR  10          2HG2      THR  10  66.349  -2.150   9.780
   83   3HG2  THR  10          3HG2      THR  10  66.297  -1.383   8.190
   84    H    VAL  11           H        VAL  11  70.087  -1.912   9.506
   85    HA   VAL  11           HA       VAL  11  70.420  -3.467   7.064
   86    HB   VAL  11           HB       VAL  11  71.208  -4.015   9.949
   87   1HG1  VAL  11          1HG1      VAL  11  71.252  -5.984   8.362
   88   2HG1  VAL  11          2HG1      VAL  11  72.822  -5.567   9.046
   89   3HG1  VAL  11          3HG1      VAL  11  72.428  -5.096   7.393
   90   1HG2  VAL  11          1HG2      VAL  11  72.244  -2.193   7.874
   91   2HG2  VAL  11          2HG2      VAL  11  73.478  -3.237   8.579
   92   3HG2  VAL  11          3HG2      VAL  11  72.517  -2.184   9.617
   93    H    HIS  12           H        HIS  12  69.399  -5.344   6.496
   94    HA   HIS  12           HA       HIS  12  67.465  -6.558   8.438
   95   1HB   HIS  12          2HB       HIS  12  67.366  -6.013   5.492
   96   2HB   HIS  12          1HB       HIS  12  66.503  -7.420   6.121
   97    HD1  HIS  12           HD1      HIS  12  66.878  -3.756   7.178
   98    HD2  HIS  12           HD2      HIS  12  63.950  -6.706   6.854
   99    HE1  HIS  12           HE1      HIS  12  64.706  -2.694   7.931
  100    H    ARG  13           H        ARG  13  67.120  -8.948   7.858
  101    HA   ARG  13           HA       ARG  13  69.316 -10.479   8.476
  102   1HB   ARG  13          2HB       ARG  13  66.912 -11.073   6.741
  103   2HB   ARG  13          1HB       ARG  13  67.994 -12.342   7.327
  104   1HG   ARG  13          2HG       ARG  13  67.568 -11.573   9.663
  105   2HG   ARG  13          1HG       ARG  13  66.417 -10.392   9.038
  106   1HD   ARG  13          2HD       ARG  13  65.154 -12.318   7.969
  107   2HD   ARG  13          1HD       ARG  13  66.209 -13.415   8.881
  108    HE   ARG  13           HE       ARG  13  65.013 -11.313  10.531
  109   1HH1  ARG  13          1HH1      ARG  13  64.582 -14.547   9.234
  110   2HH1  ARG  13          2HH1      ARG  13  63.469 -14.996  10.477
  111   1HH2  ARG  13          1HH2      ARG  13  63.572 -11.952  12.108
  112   2HH2  ARG  13          2HH2      ARG  13  62.903 -13.549  12.083
  113    H    ILE  14           H        ILE  14  70.848 -11.751   7.339
  114    HA   ILE  14           HA       ILE  14  72.434 -12.254   5.681
  115    HB   ILE  14           HB       ILE  14  70.296 -11.257   3.769
  116   1HG1  ILE  14          2HG1      ILE  14  70.799 -14.109   4.658
  117   2HG1  ILE  14          1HG1      ILE  14  69.575 -13.082   5.408
  118   1HG2  ILE  14          1HG2      ILE  14  71.546 -13.194   2.438
  119   2HG2  ILE  14          2HG2      ILE  14  72.875 -12.738   3.502
  120   3HG2  ILE  14          3HG2      ILE  14  72.153 -11.539   2.430
  121   1HD1  ILE  14          1HD1      ILE  14  68.262 -14.020   3.767
  122   2HD1  ILE  14          2HD1      ILE  14  69.627 -14.284   2.682
  123   3HD1  ILE  14          3HD1      ILE  14  68.922 -12.673   2.836
  124    H    GLY  15           H        GLY  15  71.671  -9.159   6.528
  125   1HA   GLY  15          2HA       GLY  15  72.966  -7.207   6.301
  126   2HA   GLY  15          1HA       GLY  15  74.009  -8.077   5.180
  127    H    ARG  16           H        ARG  16  70.642  -8.238   4.406
  128    HA   ARG  16           HA       ARG  16  71.122  -6.720   1.941
  129   1HB   ARG  16          2HB       ARG  16  69.909  -8.878   2.031
  130   2HB   ARG  16          1HB       ARG  16  68.693  -8.150   3.078
  131   1HG   ARG  16          2HG       ARG  16  68.043  -6.594   1.317
  132   2HG   ARG  16          1HG       ARG  16  69.334  -7.188   0.273
  133   1HD   ARG  16          2HD       ARG  16  67.289  -8.291  -0.425
  134   2HD   ARG  16          1HD       ARG  16  68.249  -9.497   0.449
  135    HE   ARG  16           HE       ARG  16  66.616  -8.096   2.335
  136   1HH1  ARG  16          1HH1      ARG  16  66.308 -10.416  -0.282
  137   2HH1  ARG  16          2HH1      ARG  16  64.879 -11.120   0.389
  138   1HH2  ARG  16          1HH2      ARG  16  64.771  -9.044   3.151
  139   2HH2  ARG  16          2HH2      ARG  16  64.019 -10.356   2.306
  140    H    ILE  17           H        ILE  17  70.099  -4.771   1.390
  141    HA   ILE  17           HA       ILE  17  68.217  -3.562   3.362
  142    HB   ILE  17           HB       ILE  17  69.386  -1.390   3.093
  143   1HG1  ILE  17          2HG1      ILE  17  71.531  -2.929   1.603
  144   2HG1  ILE  17          1HG1      ILE  17  70.287  -1.986   0.784
  145   1HG2  ILE  17          1HG2      ILE  17  70.095  -3.328   4.754
  146   2HG2  ILE  17          2HG2      ILE  17  71.059  -1.857   4.627
  147   3HG2  ILE  17          3HG2      ILE  17  71.569  -3.320   3.786
  148   1HD1  ILE  17          1HD1      ILE  17  71.249   0.002   1.343
  149   2HD1  ILE  17          2HD1      ILE  17  72.697  -0.971   1.598
  150   3HD1  ILE  17          3HD1      ILE  17  71.668  -0.549   2.966
  151    H    ILE  18           H        ILE  18  66.699  -2.068   2.333
  152    HA   ILE  18           HA       ILE  18  66.623  -2.300  -0.663
  153    HB   ILE  18           HB       ILE  18  64.333  -1.962   1.304
  154   1HG1  ILE  18          2HG1      ILE  18  65.343  -4.190   1.550
  155   2HG1  ILE  18          1HG1      ILE  18  63.783  -4.323   0.744
  156   1HG2  ILE  18          1HG2      ILE  18  63.105  -2.797  -0.871
  157   2HG2  ILE  18          2HG2      ILE  18  64.541  -2.173  -1.686
  158   3HG2  ILE  18          3HG2      ILE  18  63.541  -1.094  -0.708
  159   1HD1  ILE  18          1HD1      ILE  18  65.287  -4.095  -1.443
  160   2HD1  ILE  18          2HD1      ILE  18  65.066  -5.656  -0.652
  161   3HD1  ILE  18          3HD1      ILE  18  66.534  -4.720  -0.364
  162    H    ILE  19           H        ILE  19  66.804  -0.376  -1.715
  163    HA   ILE  19           HA       ILE  19  66.761   2.172  -0.228
  164    HB   ILE  19           HB       ILE  19  67.036   1.508  -3.196
  165   1HG1  ILE  19          2HG1      ILE  19  69.076   1.972  -0.976
  166   2HG1  ILE  19          1HG1      ILE  19  68.814   0.475  -1.859
  167   1HG2  ILE  19          1HG2      ILE  19  67.798   3.766  -3.474
  168   2HG2  ILE  19          2HG2      ILE  19  67.890   4.030  -1.733
  169   3HG2  ILE  19          3HG2      ILE  19  66.319   3.881  -2.520
  170   1HD1  ILE  19          1HD1      ILE  19  69.308   2.495  -3.797
  171   2HD1  ILE  19          2HD1      ILE  19  70.344   1.133  -3.367
  172   3HD1  ILE  19          3HD1      ILE  19  70.525   2.677  -2.533
  173    HA   PRO  20           HA       PRO  20  62.426   2.998  -1.055
  174   1HB   PRO  20          2HB       PRO  20  62.528   5.735  -1.133
  175   2HB   PRO  20          1HB       PRO  20  62.561   4.821   0.385
  176   1HG   PRO  20          2HG       PRO  20  64.866   5.888  -1.209
  177   2HG   PRO  20          1HG       PRO  20  64.541   6.072   0.527
  178   1HD   PRO  20          2HD       PRO  20  66.263   4.239  -0.279
  179   2HD   PRO  20          1HD       PRO  20  65.070   3.823   0.981
  180    H    ALA  21           H        ALA  21  61.275   3.355  -2.963
  181    HA   ALA  21           HA       ALA  21  62.596   3.260  -5.464
  182   1HB   ALA  21          1HB       ALA  21  60.180   4.152  -6.173
  183   2HB   ALA  21          2HB       ALA  21  59.832   3.854  -4.470
  184   3HB   ALA  21          3HB       ALA  21  60.390   2.535  -5.500
  185    H    GLY  22           H        GLY  22  61.675   6.023  -3.490
  186   1HA   GLY  22          2HA       GLY  22  61.753   8.042  -5.541
  187   2HA   GLY  22          1HA       GLY  22  61.984   8.338  -3.815
  188    H    THR  23           H        THR  23  64.277   6.795  -3.339
  189    HA   THR  23           HA       THR  23  66.348   8.572  -4.300
  190    HB   THR  23           HB       THR  23  66.520   5.859  -2.946
  191    HG1  THR  23           HG1      THR  23  66.334   8.503  -1.942
  192   1HG2  THR  23          1HG2      THR  23  68.492   8.140  -2.794
  193   2HG2  THR  23          2HG2      THR  23  68.618   6.887  -4.030
  194   3HG2  THR  23          3HG2      THR  23  68.730   6.457  -2.322
  195    H    ARG  24           H        ARG  24  65.334   5.275  -5.200
  196    HA   ARG  24           HA       ARG  24  67.434   4.606  -7.038
  197   1HB   ARG  24          2HB       ARG  24  64.501   4.015  -7.515
  198   2HB   ARG  24          1HB       ARG  24  65.886   3.030  -7.962
  199   1HG   ARG  24          2HG       ARG  24  66.284   2.956  -5.348
  200   2HG   ARG  24          1HG       ARG  24  64.569   3.346  -5.298
  201   1HD   ARG  24          2HD       ARG  24  64.436   1.388  -7.108
  202   2HD   ARG  24          1HD       ARG  24  65.907   0.867  -6.253
  203    HE   ARG  24           HE       ARG  24  64.296   1.457  -4.164
  204   1HH1  ARG  24          1HH1      ARG  24  63.633  -0.407  -7.061
  205   2HH1  ARG  24          2HH1      ARG  24  62.434  -1.368  -6.274
  206   1HH2  ARG  24          1HH2      ARG  24  62.765   0.182  -3.204
  207   2HH2  ARG  24          2HH2      ARG  24  61.944  -1.043  -4.114
  208    H    LYS  25           H        LYS  25  64.454   6.467  -7.457
  209    HA   LYS  25           HA       LYS  25  64.632   6.904 -10.283
  210   1HB   LYS  25          2HB       LYS  25  62.619   7.194  -8.855
  211   2HB   LYS  25          1HB       LYS  25  63.381   8.580  -8.075
  212   1HG   LYS  25          2HG       LYS  25  63.495   9.734 -10.254
  213   2HG   LYS  25          1HG       LYS  25  62.705   8.357 -11.020
  214   1HD   LYS  25          2HD       LYS  25  60.766   8.678  -9.460
  215   2HD   LYS  25          1HD       LYS  25  61.543  10.149  -8.871
  216   1HE   LYS  25          2HE       LYS  25  61.640  10.608 -11.553
  217   2HE   LYS  25          1HE       LYS  25  60.140   9.666 -11.438
  218   1HZ   LYS  25          1HZ       LYS  25  59.607  11.941 -11.003
  219   2HZ   LYS  25          2HZ       LYS  25  60.862  12.082  -9.867
  220   3HZ   LYS  25          3HZ       LYS  25  59.514  11.104  -9.531
  221    H    PHE  26           H        PHE  26  65.580   8.989  -7.543
  222    HA   PHE  26           HA       PHE  26  66.597  11.196  -9.008
  223   1HB   PHE  26          2HB       PHE  26  66.161  11.075  -6.560
  224   2HB   PHE  26          1HB       PHE  26  67.562  10.021  -6.379
  225    HD1  PHE  26           HD1      PHE  26  69.748  10.925  -6.098
  226    HD2  PHE  26           HD2      PHE  26  66.531  13.429  -7.633
  227    HE1  PHE  26           HE1      PHE  26  71.250  12.939  -5.966
  228    HE2  PHE  26           HE2      PHE  26  68.032  15.442  -7.500
  229    HZ   PHE  26           HZ       PHE  26  70.393  15.196  -6.666
  230    H    TYR  27           H        TYR  27  68.196   8.184  -8.036
  231    HA   TYR  27           HA       TYR  27  70.803   9.035  -9.114
  232   1HB   TYR  27          2HB       TYR  27  70.449   7.706  -7.036
  233   2HB   TYR  27          1HB       TYR  27  69.797   6.397  -8.005
  234    HD1  TYR  27           HD1      TYR  27  72.784   7.900  -6.638
  235    HD2  TYR  27           HD2      TYR  27  71.340   5.387  -9.889
  236    HE1  TYR  27           HE1      TYR  27  75.107   7.000  -6.986
  237    HE2  TYR  27           HE2      TYR  27  73.659   4.489 -10.227
  238    HH   TYR  27           HH       TYR  27  75.946   4.468  -8.183
  239    H    GLY  28           H        GLY  28  67.995   7.430 -10.399
  240   1HA   GLY  28          2HA       GLY  28  67.627   6.660 -12.590
  241   2HA   GLY  28          1HA       GLY  28  69.295   7.090 -12.972
  242    H    ILE  29           H        ILE  29  68.095   4.860 -10.456
  243    HA   ILE  29           HA       ILE  29  70.061   2.845 -11.318
  244    HB   ILE  29           HB       ILE  29  67.998   2.893  -9.081
  245   1HG1  ILE  29          2HG1      ILE  29  70.975   3.478  -9.040
  246   2HG1  ILE  29          1HG1      ILE  29  69.709   4.699  -8.994
  247   1HG2  ILE  29          1HG2      ILE  29  69.954   1.240  -8.210
  248   2HG2  ILE  29          2HG2      ILE  29  70.068   0.929  -9.942
  249   3HG2  ILE  29          3HG2      ILE  29  68.544   0.660  -9.096
  250   1HD1  ILE  29          1HD1      ILE  29  70.706   2.959  -6.846
  251   2HD1  ILE  29          2HD1      ILE  29  68.944   2.991  -6.965
  252   3HD1  ILE  29          3HD1      ILE  29  69.839   4.494  -6.741
  253    H    GLU  30           H        GLU  30  69.604   1.126 -12.570
  254    HA   GLU  30           HA       GLU  30  66.788   0.120 -12.711
  255   1HB   GLU  30          2HB       GLU  30  67.485   1.386 -14.769
  256   2HB   GLU  30          1HB       GLU  30  68.809   0.237 -14.978
  257   1HG   GLU  30          2HG       GLU  30  67.140  -1.616 -15.065
  258   2HG   GLU  30          1HG       GLU  30  65.849  -0.423 -14.967
  259    H    GLN  31           H        GLN  31  66.709  -2.235 -12.984
  260    HA   GLN  31           HA       GLN  31  68.533  -3.713 -11.420
  261   1HB   GLN  31          2HB       GLN  31  66.670  -4.513 -13.674
  262   2HB   GLN  31          1HB       GLN  31  67.465  -5.682 -12.618
  263   1HG   GLN  31          2HG       GLN  31  66.405  -4.700 -10.656
  264   2HG   GLN  31          1HG       GLN  31  65.686  -3.428 -11.646
  265   1HE2  GLN  31          1HE2      GLN  31  63.743  -4.678 -10.383
  266   2HE2  GLN  31          2HE2      GLN  31  62.974  -5.871 -11.313
  267    H    GLY  32           H        GLY  32  70.459  -4.748 -11.832
  268   1HA   GLY  32          2HA       GLY  32  72.087  -5.863 -13.194
  269   2HA   GLY  32          1HA       GLY  32  71.349  -5.146 -14.624
  270    H    ASP  33           H        ASP  33  71.452  -2.464 -12.875
  271    HA   ASP  33           HA       ASP  33  73.991  -1.532 -14.007
  272   1HB   ASP  33          2HB       ASP  33  71.920  -0.339 -12.138
  273   2HB   ASP  33          1HB       ASP  33  73.292   0.564 -12.778
  274    H    PHE  34           H        PHE  34  75.802  -0.732 -12.702
  275    HA   PHE  34           HA       PHE  34  75.968  -1.997  -9.986
  276   1HB   PHE  34          2HB       PHE  34  78.038  -1.216 -12.060
  277   2HB   PHE  34          1HB       PHE  34  78.457  -1.726 -10.424
  278    HD1  PHE  34           HD1      PHE  34  76.964  -2.802 -13.671
  279    HD2  PHE  34           HD2      PHE  34  78.218  -4.050  -9.689
  280    HE1  PHE  34           HE1      PHE  34  76.767  -5.211 -14.364
  281    HE2  PHE  34           HE2      PHE  34  78.019  -6.460 -10.383
  282    HZ   PHE  34           HZ       PHE  34  77.294  -7.040 -12.720
  283    H    VAL  35           H        VAL  35  76.335  -0.629  -8.261
  284    HA   VAL  35           HA       VAL  35  77.042   2.216  -8.856
  285    HB   VAL  35           HB       VAL  35  75.431   2.870  -7.073
  286   1HG1  VAL  35          1HG1      VAL  35  74.097   1.101  -9.144
  287   2HG1  VAL  35          2HG1      VAL  35  74.774   2.686  -9.514
  288   3HG1  VAL  35          3HG1      VAL  35  73.430   2.545  -8.381
  289   1HG2  VAL  35          1HG2      VAL  35  73.777   1.114  -6.333
  290   2HG2  VAL  35          2HG2      VAL  35  75.412   0.862  -5.715
  291   3HG2  VAL  35          3HG2      VAL  35  74.822  -0.103  -7.068
  292    H    GLU  36           H        GLU  36  78.265   3.229  -7.114
  293    HA   GLU  36           HA       GLU  36  79.588   1.243  -5.291
  294   1HB   GLU  36          2HB       GLU  36  80.947   2.255  -7.156
  295   2HB   GLU  36          1HB       GLU  36  80.639   3.846  -6.458
  296   1HG   GLU  36          2HG       GLU  36  81.682   3.074  -4.326
  297   2HG   GLU  36          1HG       GLU  36  82.070   1.541  -5.101
  298    H    ILE  37           H        ILE  37  79.104   1.600  -3.193
  299    HA   ILE  37           HA       ILE  37  78.185   4.333  -2.391
  300    HB   ILE  37           HB       ILE  37  76.357   2.839  -3.105
  301   1HG1  ILE  37          2HG1      ILE  37  76.220   2.936  -0.099
  302   2HG1  ILE  37          1HG1      ILE  37  76.215   4.422  -1.047
  303   1HG2  ILE  37          1HG2      ILE  37  77.411   0.680  -2.662
  304   2HG2  ILE  37          2HG2      ILE  37  75.879   0.780  -1.793
  305   3HG2  ILE  37          3HG2      ILE  37  77.399   1.003  -0.928
  306   1HD1  ILE  37          1HD1      ILE  37  74.361   2.745  -2.341
  307   2HD1  ILE  37          2HD1      ILE  37  73.995   4.137  -1.323
  308   3HD1  ILE  37          3HD1      ILE  37  74.058   2.523  -0.618
  309    H    LYS  38           H        LYS  38  78.204   4.690  -0.054
  310    HA   LYS  38           HA       LYS  38  79.861   2.763   1.524
  311   1HB   LYS  38          2HB       LYS  38  81.100   4.787   0.583
  312   2HB   LYS  38          1HB       LYS  38  80.089   5.782   1.639
  313   1HG   LYS  38          2HG       LYS  38  80.878   4.534   3.599
  314   2HG   LYS  38          1HG       LYS  38  81.858   3.500   2.560
  315   1HD   LYS  38          2HD       LYS  38  83.105   5.522   1.790
  316   2HD   LYS  38          1HD       LYS  38  82.176   6.496   2.930
  317   1HE   LYS  38          2HE       LYS  38  83.075   4.497   4.575
  318   2HE   LYS  38          1HE       LYS  38  84.435   4.663   3.447
  319   1HZ   LYS  38          1HZ       LYS  38  84.499   6.259   5.339
  320   2HZ   LYS  38          2HZ       LYS  38  83.072   6.961   4.742
  321   3HZ   LYS  38          3HZ       LYS  38  84.495   7.001   3.814
  322    H    ILE  39           H        ILE  39  79.273   2.608   3.717
  323    HA   ILE  39           HA       ILE  39  76.823   4.142   4.537
  324    HB   ILE  39           HB       ILE  39  76.401   2.157   6.002
  325   1HG1  ILE  39          2HG1      ILE  39  78.637   0.813   4.464
  326   2HG1  ILE  39          1HG1      ILE  39  78.884   1.523   6.058
  327   1HG2  ILE  39          1HG2      ILE  39  75.143   1.841   4.135
  328   2HG2  ILE  39          2HG2      ILE  39  76.284   0.528   3.841
  329   3HG2  ILE  39          3HG2      ILE  39  76.506   2.086   3.043
  330   1HD1  ILE  39          1HD1      ILE  39  78.329  -0.963   6.037
  331   2HD1  ILE  39          2HD1      ILE  39  76.712  -0.506   5.499
  332   3HD1  ILE  39          3HD1      ILE  39  77.307   0.038   7.068
  333    H    VAL  40           H        VAL  40  76.766   4.942   6.687
  334    HA   VAL  40           HA       VAL  40  79.242   4.675   8.332
  335    HB   VAL  40           HB       VAL  40  77.817   7.264   7.616
  336   1HG1  VAL  40          1HG1      VAL  40  80.027   6.556   9.528
  337   2HG1  VAL  40          2HG1      VAL  40  78.678   7.670   9.749
  338   3HG1  VAL  40          3HG1      VAL  40  80.047   8.132   8.736
  339   1HG2  VAL  40          1HG2      VAL  40  79.925   7.812   6.434
  340   2HG2  VAL  40          2HG2      VAL  40  79.172   6.370   5.754
  341   3HG2  VAL  40          3HG2      VAL  40  80.559   6.214   6.832
  342    H    LYS  41           H        LYS  41  78.647   4.123  10.367
  343    HA   LYS  41           HA       LYS  41  76.082   5.179  11.486
  344   1HB   LYS  41          2HB       LYS  41  75.894   2.788  10.721
  345   2HB   LYS  41          1HB       LYS  41  77.179   2.374  11.856
  346   1HG   LYS  41          2HG       LYS  41  75.777   3.379  13.691
  347   2HG   LYS  41          1HG       LYS  41  74.466   3.541  12.524
  348   1HD   LYS  41          2HD       LYS  41  74.604   1.076  12.103
  349   2HD   LYS  41          1HD       LYS  41  75.804   0.964  13.389
  350   1HE   LYS  41          2HE       LYS  41  73.709   0.446  14.428
  351   2HE   LYS  41          1HE       LYS  41  74.049   2.123  14.891
  352   1HZ   LYS  41          1HZ       LYS  41  71.773   1.725  13.944
  353   2HZ   LYS  41          2HZ       LYS  41  72.521   1.393  12.456
  354   3HZ   LYS  41          3HZ       LYS  41  72.675   2.929  13.163
  355    H    TYR  42           H        TYR  42  76.244   5.707  13.702
  356    HA   TYR  42           HA       TYR  42  79.019   5.652  14.830
  357   1HB   TYR  42          2HB       TYR  42  77.684   7.803  14.419
  358   2HB   TYR  42          1HB       TYR  42  76.638   7.283  15.741
  359    HD1  TYR  42           HD1      TYR  42  80.194   8.087  14.840
  360    HD2  TYR  42           HD2      TYR  42  77.298   7.536  18.047
  361    HE1  TYR  42           HE1      TYR  42  81.864   8.971  16.497
  362    HE2  TYR  42           HE2      TYR  42  78.968   8.421  19.707
  363    HH   TYR  42           HH       TYR  42  81.553  10.187  18.976
  364    H    GLU  43           H        GLU  43  79.398   4.257  16.514
  365    HA   GLU  43           HA       GLU  43  77.129   3.544  18.321
  366   1HB   GLU  43          2HB       GLU  43  77.825   1.161  18.150
  367   2HB   GLU  43          1HB       GLU  43  77.309   1.805  16.592
  368   1HG   GLU  43          2HG       GLU  43  79.698   2.228  16.013
  369   2HG   GLU  43          1HG       GLU  43  80.173   1.478  17.538
  370    H    GLY  44           H        GLY  44  77.758   3.308  20.457
  371   1HA   GLY  44          2HA       GLY  44  79.118   3.510  22.356
  372   2HA   GLY  44          1HA       GLY  44  80.391   2.743  21.406
  373    H    GLU  45           H        GLU  45  82.171   4.012  21.500
  374    HA   GLU  45           HA       GLU  45  81.839   6.978  21.402
  375   1HB   GLU  45          2HB       GLU  45  84.048   7.032  22.439
  376   2HB   GLU  45          1HB       GLU  45  83.013   5.924  23.332
  377   1HG   GLU  45          2HG       GLU  45  84.033   4.009  22.136
  378   2HG   GLU  45          1HG       GLU  45  85.069   5.121  21.246
  379    H    GLU  46           H        GLU  46  82.316   4.589  19.163
  380    HA   GLU  46           HA       GLU  46  84.187   6.294  17.561
  381   1HB   GLU  46          2HB       GLU  46  85.189   4.177  16.761
  382   2HB   GLU  46          1HB       GLU  46  85.302   4.324  18.512
  383   1HG   GLU  46          2HG       GLU  46  82.823   3.051  18.021
  384   2HG   GLU  46          1HG       GLU  46  83.969   2.286  16.926
  385    HA   PRO  47           HA       PRO  47  81.029   5.671  14.392
  386   1HB   PRO  47          2HB       PRO  47  82.813   6.748  12.390
  387   2HB   PRO  47          1HB       PRO  47  81.399   7.521  13.123
  388   1HG   PRO  47          2HG       PRO  47  84.018   8.295  13.505
  389   2HG   PRO  47          1HG       PRO  47  82.655   8.720  14.548
  390   1HD   PRO  47          2HD       PRO  47  84.792   6.708  14.964
  391   2HD   PRO  47          1HD       PRO  47  83.874   7.660  16.152
  392    H    LYS  48           H        LYS  48  80.737   3.921  13.022
  393    HA   LYS  48           HA       LYS  48  83.160   2.415  12.094
  394   1HB   LYS  48          2HB       LYS  48  80.315   1.492  12.634
  395   2HB   LYS  48          1HB       LYS  48  81.625   0.462  12.057
  396   1HG   LYS  48          2HG       LYS  48  81.726   2.020  14.651
  397   2HG   LYS  48          1HG       LYS  48  81.266   0.321  14.537
  398   1HD   LYS  48          2HD       LYS  48  83.468  -0.109  13.381
  399   2HD   LYS  48          1HD       LYS  48  83.926   1.548  13.775
  400   1HE   LYS  48          2HE       LYS  48  84.755   0.581  15.690
  401   2HE   LYS  48          1HE       LYS  48  83.062   0.649  16.221
  402   1HZ   LYS  48          1HZ       LYS  48  84.415  -1.603  14.838
  403   2HZ   LYS  48          2HZ       LYS  48  82.737  -1.519  15.080
  404   3HZ   LYS  48          3HZ       LYS  48  83.788  -1.602  16.412
  405    H    GLU  49           H        GLU  49  83.342   2.143   9.871
  406    HA   GLU  49           HA       GLU  49  81.067   3.069   8.153
  407   1HB   GLU  49          2HB       GLU  49  84.011   3.795   8.005
  408   2HB   GLU  49          1HB       GLU  49  82.789   4.304   6.840
  409   1HG   GLU  49          2HG       GLU  49  81.535   5.418   8.679
  410   2HG   GLU  49          1HG       GLU  49  82.818   4.966   9.800
  411    H    GLY  50           H        GLY  50  81.345   2.380   5.855
  412   1HA   GLY  50          2HA       GLY  50  83.269   0.258   5.252
  413   2HA   GLY  50          1HA       GLY  50  81.600  -0.301   5.380
  414    H    THR  51           H        THR  51  83.640   0.225   3.057
  415    HA   THR  51           HA       THR  51  81.626   1.572   1.279
  416    HB   THR  51           HB       THR  51  84.608   1.497   0.788
  417    HG1  THR  51           HG1      THR  51  84.569   2.526   2.684
  418   1HG2  THR  51          1HG2      THR  51  84.169   3.027  -0.855
  419   2HG2  THR  51          2HG2      THR  51  82.870   3.791   0.059
  420   3HG2  THR  51          3HG2      THR  51  82.570   2.283  -0.806
  421    H    PHE  52           H        PHE  52  81.060   0.368  -0.541
  422    HA   PHE  52           HA       PHE  52  82.863  -1.720  -1.552
  423   1HB   PHE  52          2HB       PHE  52  81.449  -3.591  -1.048
  424   2HB   PHE  52          1HB       PHE  52  81.587  -2.669   0.442
  425    HD1  PHE  52           HD1      PHE  52  79.336  -4.162  -1.926
  426    HD2  PHE  52           HD2      PHE  52  79.668  -0.893   0.934
  427    HE1  PHE  52           HE1      PHE  52  76.833  -3.969  -1.859
  428    HE2  PHE  52           HE2      PHE  52  77.158  -0.701   1.001
  429    HZ   PHE  52           HZ       PHE  52  75.743  -2.241  -0.405
  430    H    THR  53           H        THR  53  81.739  -2.900  -3.464
  431    HA   THR  53           HA       THR  53  80.018  -0.963  -4.979
  432    HB   THR  53           HB       THR  53  81.790  -3.238  -5.936
  433    HG1  THR  53           HG1      THR  53  83.220  -1.632  -6.470
  434   1HG2  THR  53          1HG2      THR  53  80.104  -2.889  -7.571
  435   2HG2  THR  53          2HG2      THR  53  81.486  -1.951  -8.140
  436   3HG2  THR  53          3HG2      THR  53  80.138  -1.139  -7.343
  437    H    ALA  54           H        ALA  54  78.027  -1.718  -5.725
  438    HA   ALA  54           HA       ALA  54  77.316  -4.580  -5.237
  439   1HB   ALA  54          1HB       ALA  54  76.756  -2.498  -3.510
  440   2HB   ALA  54          2HB       ALA  54  75.841  -4.002  -3.593
  441   3HB   ALA  54          3HB       ALA  54  75.285  -2.582  -4.477
  442    H    ARG  55           H        ARG  55  75.704  -5.372  -6.628
  443    HA   ARG  55           HA       ARG  55  74.958  -3.633  -8.929
  444   1HB   ARG  55          2HB       ARG  55  75.924  -6.036  -9.048
  445   2HB   ARG  55          1HB       ARG  55  74.322  -6.560  -8.525
  446   1HG   ARG  55          2HG       ARG  55  73.335  -5.281 -10.441
  447   2HG   ARG  55          1HG       ARG  55  74.972  -4.930 -10.998
  448   1HD   ARG  55          2HD       ARG  55  74.346  -6.858 -12.242
  449   2HD   ARG  55          1HD       ARG  55  75.314  -7.517 -10.908
  450    HE   ARG  55           HE       ARG  55  72.455  -7.241 -10.303
  451   1HH1  ARG  55          1HH1      ARG  55  74.958  -9.364 -11.550
  452   2HH1  ARG  55          2HH1      ARG  55  74.055 -10.792 -11.186
  453   1HH2  ARG  55          1HH2      ARG  55  71.337  -9.120  -9.861
  454   2HH2  ARG  55          2HH2      ARG  55  72.033 -10.658 -10.245
  455    H    VAL  56           H        VAL  56  72.801  -3.135  -9.357
  456    HA   VAL  56           HA       VAL  56  70.939  -3.191  -7.103
  457    HB   VAL  56           HB       VAL  56  70.757  -2.257  -9.988
  458   1HG1  VAL  56          1HG1      VAL  56  68.615  -1.620  -9.659
  459   2HG1  VAL  56          2HG1      VAL  56  68.960  -0.981  -8.050
  460   3HG1  VAL  56          3HG1      VAL  56  68.611  -2.695  -8.261
  461   1HG2  VAL  56          1HG2      VAL  56  71.545  -0.218  -9.248
  462   2HG2  VAL  56          2HG2      VAL  56  72.364  -1.266  -8.089
  463   3HG2  VAL  56          3HG2      VAL  56  70.880  -0.434  -7.628
  464    H    GLY  57           H        GLY  57  69.508  -4.780  -6.717
  465   1HA   GLY  57          2HA       GLY  57  68.881  -6.731  -8.887
  466   2HA   GLY  57          1HA       GLY  57  68.709  -7.059  -7.161
  467    H    GLU  58           H        GLU  58  66.508  -7.733  -8.051
  468    HA   GLU  58           HA       GLU  58  64.582  -5.846  -8.996
  469   1HB   GLU  58          2HB       GLU  58  64.519  -8.408  -8.923
  470   2HB   GLU  58          1HB       GLU  58  64.048  -8.250  -7.231
  471   1HG   GLU  58          2HG       GLU  58  62.135  -6.803  -7.952
  472   2HG   GLU  58          1HG       GLU  58  62.570  -7.122  -9.626
  473    H    GLN  59           H        GLN  59  62.858  -4.812  -7.803
  474    HA   GLN  59           HA       GLN  59  62.038  -3.433  -6.085
  475   1HB   GLN  59          2HB       GLN  59  63.242  -5.695  -4.461
  476   2HB   GLN  59          1HB       GLN  59  62.134  -4.483  -3.819
  477   1HG   GLN  59          2HG       GLN  59  61.504  -6.349  -6.125
  478   2HG   GLN  59          1HG       GLN  59  60.965  -6.586  -4.465
  479   1HE2  GLN  59          1HE2      GLN  59  59.671  -5.665  -7.267
  480   2HE2  GLN  59          2HE2      GLN  59  58.626  -4.426  -6.762
  481    H    GLY  60           H        GLY  60  65.095  -3.285  -6.927
  482   1HA   GLY  60          2HA       GLY  60  66.710  -1.656  -6.434
  483   2HA   GLY  60          1HA       GLY  60  65.577  -1.000  -5.255
  484    H    SER  61           H        SER  61  66.460  -4.342  -4.897
  485    HA   SER  61           HA       SER  61  67.490  -3.798  -2.232
  486   1HB   SER  61          2HB       SER  61  66.110  -5.765  -2.891
  487   2HB   SER  61          1HB       SER  61  67.440  -6.340  -3.891
  488    HG   SER  61           HG       SER  61  67.083  -6.458  -1.183
  489    H    VAL  62           H        VAL  62  69.595  -4.002  -1.500
  490    HA   VAL  62           HA       VAL  62  71.735  -4.784  -3.420
  491    HB   VAL  62           HB       VAL  62  71.518  -2.326  -3.468
  492   1HG1  VAL  62          1HG1      VAL  62  71.900  -1.001  -1.435
  493   2HG1  VAL  62          2HG1      VAL  62  72.050  -2.480  -0.486
  494   3HG1  VAL  62          3HG1      VAL  62  70.504  -2.058  -1.223
  495   1HG2  VAL  62          1HG2      VAL  62  73.948  -2.975  -1.798
  496   2HG2  VAL  62          2HG2      VAL  62  73.807  -1.819  -3.123
  497   3HG2  VAL  62          3HG2      VAL  62  73.791  -3.550  -3.457
  498    H    ILE  63           H        ILE  63  73.505  -5.816  -2.373
  499    HA   ILE  63           HA       ILE  63  73.000  -6.520   0.497
  500    HB   ILE  63           HB       ILE  63  74.536  -7.966  -1.690
  501   1HG1  ILE  63          2HG1      ILE  63  72.131  -7.847  -2.220
  502   2HG1  ILE  63          1HG1      ILE  63  72.581  -9.490  -1.771
  503   1HG2  ILE  63          1HG2      ILE  63  73.681  -8.783   1.098
  504   2HG2  ILE  63          2HG2      ILE  63  75.330  -8.623   0.493
  505   3HG2  ILE  63          3HG2      ILE  63  74.290  -9.913  -0.111
  506   1HD1  ILE  63          1HD1      ILE  63  71.295  -7.454   0.079
  507   2HD1  ILE  63          2HD1      ILE  63  71.725  -9.109   0.511
  508   3HD1  ILE  63          3HD1      ILE  63  70.464  -8.809  -0.685
  509    H    ILE  64           H        ILE  64  74.441  -5.742   1.960
  510    HA   ILE  64           HA       ILE  64  77.057  -4.619   1.173
  511    HB   ILE  64           HB       ILE  64  75.737  -5.171   3.859
  512   1HG1  ILE  64          2HG1      ILE  64  76.037  -2.506   2.461
  513   2HG1  ILE  64          1HG1      ILE  64  74.627  -3.534   2.201
  514   1HG2  ILE  64          1HG2      ILE  64  78.233  -4.942   3.934
  515   2HG2  ILE  64          2HG2      ILE  64  77.393  -3.648   4.788
  516   3HG2  ILE  64          3HG2      ILE  64  78.072  -3.354   3.185
  517   1HD1  ILE  64          1HD1      ILE  64  75.479  -2.074   4.669
  518   2HD1  ILE  64          2HD1      ILE  64  74.619  -3.602   4.860
  519   3HD1  ILE  64          3HD1      ILE  64  73.866  -2.269   3.983
  520    HA   PRO  65           HA       PRO  65  79.181  -8.513   1.496
  521   1HB   PRO  65          2HB       PRO  65  81.683  -7.661   2.191
  522   2HB   PRO  65          1HB       PRO  65  81.022  -7.451   0.553
  523   1HG   PRO  65          2HG       PRO  65  81.035  -5.503   2.832
  524   2HG   PRO  65          1HG       PRO  65  81.570  -5.254   1.157
  525   1HD   PRO  65          2HD       PRO  65  79.171  -4.424   1.902
  526   2HD   PRO  65          1HD       PRO  65  79.372  -5.243   0.332
  527    H    LYS  66           H        LYS  66  79.376  -9.996   3.147
  528    HA   LYS  66           HA       LYS  66  78.643  -9.474   5.830
  529   1HB   LYS  66          2HB       LYS  66  78.661 -11.675   4.661
  530   2HB   LYS  66          1HB       LYS  66  80.424 -11.676   4.732
  531   1HG   LYS  66          2HG       LYS  66  79.725 -12.974   6.603
  532   2HG   LYS  66          1HG       LYS  66  80.168 -11.401   7.269
  533   1HD   LYS  66          2HD       LYS  66  77.823 -10.713   7.294
  534   2HD   LYS  66          1HD       LYS  66  77.345 -12.233   6.538
  535   1HE   LYS  66          2HE       LYS  66  77.712 -13.470   8.477
  536   2HE   LYS  66          1HE       LYS  66  78.916 -12.324   9.100
  537   1HZ   LYS  66          1HZ       LYS  66  77.190 -10.690   9.413
  538   2HZ   LYS  66          2HZ       LYS  66  76.764 -12.111  10.241
  539   3HZ   LYS  66          3HZ       LYS  66  76.023 -11.733   8.760
  540    H    ALA  67           H        ALA  67  81.834  -9.470   4.313
  541    HA   ALA  67           HA       ALA  67  83.489  -9.465   6.626
  542   1HB   ALA  67          1HB       ALA  67  85.171  -8.637   5.113
  543   2HB   ALA  67          2HB       ALA  67  83.953  -7.918   4.061
  544   3HB   ALA  67          3HB       ALA  67  84.105  -9.672   4.163
  545    H    LEU  68           H        LEU  68  81.846  -6.788   4.961
  546    HA   LEU  68           HA       LEU  68  82.999  -4.727   6.679
  547   1HB   LEU  68          2HB       LEU  68  80.722  -4.810   4.680
  548   2HB   LEU  68          1HB       LEU  68  81.233  -3.333   5.495
  549    HG   LEU  68           HG       LEU  68  83.000  -5.082   3.747
  550   1HD1  LEU  68          1HD1      LEU  68  81.093  -3.464   2.809
  551   2HD1  LEU  68          2HD1      LEU  68  82.671  -3.571   2.029
  552   3HD1  LEU  68          3HD1      LEU  68  82.320  -2.237   3.127
  553   1HD2  LEU  68          1HD2      LEU  68  84.508  -2.997   3.962
  554   2HD2  LEU  68          2HD2      LEU  68  84.419  -4.060   5.366
  555   3HD2  LEU  68          3HD2      LEU  68  83.498  -2.555   5.339
  556    H    ARG  69           H        ARG  69  79.998  -6.640   6.672
  557    HA   ARG  69           HA       ARG  69  78.488  -5.162   8.600
  558   1HB   ARG  69          2HB       ARG  69  78.732  -8.176   8.275
  559   2HB   ARG  69          1HB       ARG  69  77.379  -7.324   9.004
  560   1HG   ARG  69          2HG       ARG  69  77.044  -6.172   6.760
  561   2HG   ARG  69          1HG       ARG  69  78.212  -7.319   6.097
  562   1HD   ARG  69          2HD       ARG  69  76.667  -9.085   7.376
  563   2HD   ARG  69          1HD       ARG  69  75.445  -7.827   7.122
  564    HE   ARG  69           HE       ARG  69  76.594  -7.969   4.652
  565   1HH1  ARG  69          1HH1      ARG  69  75.379 -10.473   6.796
  566   2HH1  ARG  69          2HH1      ARG  69  75.023 -11.545   5.489
  567   1HH2  ARG  69          1HH2      ARG  69  76.103  -9.398   3.014
  568   2HH2  ARG  69          2HH2      ARG  69  75.423 -10.946   3.377
  569    H    ASP  70           H        ASP  70  80.873  -7.770   9.016
  570    HA   ASP  70           HA       ASP  70  80.646  -7.941  11.876
  571   1HB   ASP  70          2HB       ASP  70  81.525  -9.671  10.260
  572   2HB   ASP  70          1HB       ASP  70  82.984  -8.694  10.093
  573    H    VAL  71           H        VAL  71  83.096  -6.369   9.787
  574    HA   VAL  71           HA       VAL  71  84.778  -5.383  11.872
  575    HB   VAL  71           HB       VAL  71  84.128  -4.331   9.093
  576   1HG1  VAL  71          1HG1      VAL  71  85.223  -2.589  10.445
  577   2HG1  VAL  71          2HG1      VAL  71  86.322  -3.199   9.206
  578   3HG1  VAL  71          3HG1      VAL  71  86.503  -3.723  10.881
  579   1HG2  VAL  71          1HG2      VAL  71  86.377  -6.093  10.116
  580   2HG2  VAL  71          2HG2      VAL  71  86.153  -5.570   8.447
  581   3HG2  VAL  71          3HG2      VAL  71  84.983  -6.655   9.195
  582    H    ILE  72           H        ILE  72  81.894  -3.982  10.362
  583    HA   ILE  72           HA       ILE  72  82.120  -1.455  11.809
  584    HB   ILE  72           HB       ILE  72  79.900  -2.679  10.127
  585   1HG1  ILE  72          2HG1      ILE  72  82.075  -0.698   9.368
  586   2HG1  ILE  72          1HG1      ILE  72  82.124  -2.419   8.985
  587   1HG2  ILE  72          1HG2      ILE  72  79.442  -0.639  11.726
  588   2HG2  ILE  72          2HG2      ILE  72  78.895  -0.563  10.054
  589   3HG2  ILE  72          3HG2      ILE  72  80.372   0.265  10.535
  590   1HD1  ILE  72          1HD1      ILE  72  79.752  -1.972   7.948
  591   2HD1  ILE  72          2HD1      ILE  72  81.198  -1.532   7.036
  592   3HD1  ILE  72          3HD1      ILE  72  80.297  -0.292   7.911
  593    H    GLY  73           H        GLY  73  80.684  -4.561  12.505
  594   1HA   GLY  73          2HA       GLY  73  79.687  -5.270  14.515
  595   2HA   GLY  73          1HA       GLY  73  79.896  -3.632  15.137
  596    H    ILE  74           H        ILE  74  78.169  -4.462  12.166
  597    HA   ILE  74           HA       ILE  74  75.834  -2.955  13.176
  598    HB   ILE  74           HB       ILE  74  76.459  -4.170  10.463
  599   1HG1  ILE  74          2HG1      ILE  74  78.175  -2.529  11.125
  600   2HG1  ILE  74          1HG1      ILE  74  77.165  -1.872   9.841
  601   1HG2  ILE  74          1HG2      ILE  74  74.850  -2.233   9.796
  602   2HG2  ILE  74          2HG2      ILE  74  74.340  -2.292  11.483
  603   3HG2  ILE  74          3HG2      ILE  74  74.158  -3.714  10.456
  604   1HD1  ILE  74          1HD1      ILE  74  76.927  -0.070  11.200
  605   2HD1  ILE  74          2HD1      ILE  74  77.499  -0.954  12.614
  606   3HD1  ILE  74          3HD1      ILE  74  75.812  -1.082  12.117
  607    H    LYS  75           H        LYS  75  73.789  -3.827  13.479
  608    HA   LYS  75           HA       LYS  75  73.411  -6.755  12.953
  609   1HB   LYS  75          2HB       LYS  75  72.322  -6.902  15.161
  610   2HB   LYS  75          1HB       LYS  75  73.979  -6.326  15.318
  611   1HG   LYS  75          2HG       LYS  75  72.468  -3.991  14.970
  612   2HG   LYS  75          1HG       LYS  75  71.476  -4.993  16.025
  613   1HD   LYS  75          2HD       LYS  75  73.934  -5.358  17.153
  614   2HD   LYS  75          1HD       LYS  75  74.091  -3.706  16.557
  615   1HE   LYS  75          2HE       LYS  75  72.275  -2.932  17.872
  616   2HE   LYS  75          1HE       LYS  75  71.664  -4.577  18.143
  617   1HZ   LYS  75          1HZ       LYS  75  73.786  -5.080  19.273
  618   2HZ   LYS  75          2HZ       LYS  75  72.882  -3.887  20.077
  619   3HZ   LYS  75          3HZ       LYS  75  74.228  -3.448  19.136
  620    HA   PRO  76           HA       PRO  76  69.501  -5.870  11.093
  621   1HB   PRO  76          2HB       PRO  76  68.127  -7.546  13.124
  622   2HB   PRO  76          1HB       PRO  76  68.120  -7.683  11.356
  623   1HG   PRO  76          2HG       PRO  76  69.500  -9.359  12.956
  624   2HG   PRO  76          1HG       PRO  76  70.004  -8.949  11.312
  625   1HD   PRO  76          2HD       PRO  76  71.178  -8.127  13.887
  626   2HD   PRO  76          1HD       PRO  76  71.916  -8.215  12.276
  627    H    GLY  77           H        GLY  77  68.070  -4.185  11.341
  628   1HA   GLY  77          2HA       GLY  77  66.386  -2.915  12.449
  629   2HA   GLY  77          1HA       GLY  77  66.895  -3.616  13.981
  630    H    GLU  78           H        GLU  78  69.726  -2.603  12.557
  631    HA   GLU  78           HA       GLU  78  69.703  -0.089  14.145
  632   1HB   GLU  78          2HB       GLU  78  71.699  -2.074  13.178
  633   2HB   GLU  78          1HB       GLU  78  72.261  -0.410  13.349
  634   1HG   GLU  78          2HG       GLU  78  71.301  -0.394  15.672
  635   2HG   GLU  78          1HG       GLU  78  70.953  -2.112  15.490
  636    H    VAL  79           H        VAL  79  69.700   1.875  13.184
  637    HA   VAL  79           HA       VAL  79  69.420   1.965  10.256
  638    HB   VAL  79           HB       VAL  79  67.823   3.028  11.809
  639   1HG1  VAL  79          1HG1      VAL  79  68.466   4.310  13.553
  640   2HG1  VAL  79          2HG1      VAL  79  69.485   5.321  12.530
  641   3HG1  VAL  79          3HG1      VAL  79  70.122   3.821  13.199
  642   1HG2  VAL  79          1HG2      VAL  79  69.426   4.911  10.056
  643   2HG2  VAL  79          2HG2      VAL  79  67.864   5.327  10.762
  644   3HG2  VAL  79          3HG2      VAL  79  67.985   4.001   9.605
  645    H    ILE  80           H        ILE  80  70.897   2.772   8.872
  646    HA   ILE  80           HA       ILE  80  73.220   4.331   9.934
  647    HB   ILE  80           HB       ILE  80  74.572   3.150   8.212
  648   1HG1  ILE  80          2HG1      ILE  80  72.053   1.527   7.729
  649   2HG1  ILE  80          1HG1      ILE  80  72.668   2.772   6.638
  650   1HG2  ILE  80          1HG2      ILE  80  73.107   0.989   9.695
  651   2HG2  ILE  80          2HG2      ILE  80  73.978   2.224  10.607
  652   3HG2  ILE  80          3HG2      ILE  80  74.842   1.202   9.458
  653   1HD1  ILE  80          1HD1      ILE  80  74.525   0.588   7.509
  654   2HD1  ILE  80          2HD1      ILE  80  74.506   1.505   6.002
  655   3HD1  ILE  80          3HD1      ILE  80  73.320   0.227   6.274
  656    H    GLU  81           H        GLU  81  74.108   5.838   8.337
  657    HA   GLU  81           HA       GLU  81  72.084   6.888   6.415
  658   1HB   GLU  81          2HB       GLU  81  73.090   8.384   8.132
  659   2HB   GLU  81          1HB       GLU  81  74.693   8.019   7.494
  660   1HG   GLU  81          2HG       GLU  81  73.988   8.928   5.284
  661   2HG   GLU  81          1HG       GLU  81  72.435   9.373   5.991
  662    H    VAL  82           H        VAL  82  72.424   6.566   4.269
  663    HA   VAL  82           HA       VAL  82  74.957   5.212   3.458
  664    HB   VAL  82           HB       VAL  82  72.113   5.133   2.384
  665   1HG1  VAL  82          1HG1      VAL  82  73.589   4.659   0.560
  666   2HG1  VAL  82          2HG1      VAL  82  73.021   3.097   1.152
  667   3HG1  VAL  82          3HG1      VAL  82  74.636   3.666   1.576
  668   1HG2  VAL  82          1HG2      VAL  82  72.396   2.703   3.261
  669   2HG2  VAL  82          2HG2      VAL  82  72.111   3.979   4.445
  670   3HG2  VAL  82          3HG2      VAL  82  73.741   3.355   4.196
  671    H    LEU  83           H        LEU  83  76.213   6.191   1.976
  672    HA   LEU  83           HA       LEU  83  75.115   8.505   0.400
  673   1HB   LEU  83          2HB       LEU  83  77.999   7.942   1.201
  674   2HB   LEU  83          1HB       LEU  83  77.349   9.449   0.570
  675    HG   LEU  83           HG       LEU  83  76.650   8.217   3.253
  676   1HD1  LEU  83          1HD1      LEU  83  77.966  10.000   4.213
  677   2HD1  LEU  83          2HD1      LEU  83  78.223  10.729   2.628
  678   3HD1  LEU  83          3HD1      LEU  83  78.968   9.176   3.015
  679   1HD2  LEU  83          1HD2      LEU  83  74.780   9.467   2.334
  680   2HD2  LEU  83          2HD2      LEU  83  75.835  10.822   1.929
  681   3HD2  LEU  83          3HD2      LEU  83  75.521  10.420   3.618
  682    H    LEU  84           H        LEU  84  75.172   8.161  -1.827
  683    HA   LEU  84           HA       LEU  84  76.597   5.838  -2.967
  684   1HB   LEU  84          2HB       LEU  84  74.742   7.997  -3.913
  685   2HB   LEU  84          1HB       LEU  84  75.718   7.129  -5.104
  686    HG   LEU  84           HG       LEU  84  74.275   5.522  -3.039
  687   1HD1  LEU  84          1HD1      LEU  84  72.207   6.132  -3.689
  688   2HD1  LEU  84          2HD1      LEU  84  72.602   5.772  -5.368
  689   3HD1  LEU  84          3HD1      LEU  84  72.899   7.382  -4.718
  690   1HD2  LEU  84          1HD2      LEU  84  75.490   4.134  -4.427
  691   2HD2  LEU  84          2HD2      LEU  84  75.378   5.236  -5.800
  692   3HD2  LEU  84          3HD2      LEU  84  74.000   4.223  -5.367
  693    H    LEU  85           H        LEU  85  78.529   5.973  -4.103
  694    HA   LEU  85           HA       LEU  85  79.966   8.586  -3.926
  695   1HB   LEU  85          2HB       LEU  85  80.639   5.699  -3.600
  696   2HB   LEU  85          1HB       LEU  85  81.908   6.758  -4.218
  697    HG   LEU  85           HG       LEU  85  80.300   7.499  -1.775
  698   1HD1  LEU  85          1HD1      LEU  85  82.982   6.117  -1.676
  699   2HD1  LEU  85          2HD1      LEU  85  81.474   5.204  -1.604
  700   3HD1  LEU  85          3HD1      LEU  85  81.844   6.396  -0.358
  701   1HD2  LEU  85          1HD2      LEU  85  81.879   9.065  -3.177
  702   2HD2  LEU  85          2HD2      LEU  85  83.170   8.182  -2.363
  703   3HD2  LEU  85          3HD2      LEU  85  81.985   9.084  -1.417
  704    H    GLY  86           H        GLY  86  79.200   5.887  -6.107
  705   1HA   GLY  86          2HA       GLY  86  79.699   7.541  -8.469
  706   2HA   GLY  86          1HA       GLY  86  80.971   6.353  -8.211
  707    H    HIS  87           H        HIS  87  79.992   5.758 -10.452
  708    HA   HIS  87           HA       HIS  87  77.972   3.590 -10.040
  709   1HB   HIS  87          2HB       HIS  87  76.763   4.447 -12.043
  710   2HB   HIS  87          1HB       HIS  87  76.801   5.637 -10.749
  711    HD1  HIS  87           HD1      HIS  87  77.950   5.030 -14.226
  712    HD2  HIS  87           HD2      HIS  87  78.641   7.837 -11.222
  713    HE1  HIS  87           HE1      HIS  87  79.110   6.992 -15.331
  714    H    TYR  88           H        TYR  88  77.992   1.991 -11.811
  715    HA   TYR  88           HA       TYR  88  80.298   2.143 -13.693
  716   1HB   TYR  88          2HB       TYR  88  79.708   0.013 -11.626
  717   2HB   TYR  88          1HB       TYR  88  80.759  -0.288 -13.010
  718    HD1  TYR  88           HD1      TYR  88  80.390   1.485  -9.782
  719    HD2  TYR  88           HD2      TYR  88  82.914   0.945 -13.293
  720    HE1  TYR  88           HE1      TYR  88  82.301   2.598  -8.582
  721    HE2  TYR  88           HE2      TYR  88  84.823   2.056 -12.092
  722    HH   TYR  88           HH       TYR  88  85.305   2.327  -9.228
  723    H    LYS  89           H        LYS  89  79.930   0.986 -15.624
  724    HA   LYS  89           HA       LYS  89  77.222  -0.276 -15.919
  725   1HB   LYS  89          2HB       LYS  89  77.343   0.569 -18.262
  726   2HB   LYS  89          1HB       LYS  89  77.439   1.877 -17.086
  727   1HG   LYS  89          2HG       LYS  89  79.749   2.187 -17.434
  728   2HG   LYS  89          1HG       LYS  89  79.947   0.594 -18.164
  729   1HD   LYS  89          2HD       LYS  89  78.221   2.723 -19.434
  730   2HD   LYS  89          1HD       LYS  89  79.949   2.603 -19.768
  731   1HE   LYS  89          2HE       LYS  89  79.701   0.701 -21.025
  732   2HE   LYS  89          1HE       LYS  89  78.426   0.057 -19.972
  733   1HZ   LYS  89          1HZ       LYS  89  78.123   2.333 -21.860
  734   2HZ   LYS  89          2HZ       LYS  89  76.910   1.728 -20.836
  735   3HZ   LYS  89          3HZ       LYS  89  77.513   0.769 -22.103
  736    HA   PRO  90           HA       PRO  90  79.066  -4.082 -17.221
  737   1HB   PRO  90          2HB       PRO  90  77.464  -3.802 -19.748
  738   2HB   PRO  90          1HB       PRO  90  77.579  -5.185 -18.636
  739   1HG   PRO  90          2HG       PRO  90  75.441  -3.698 -18.549
  740   2HG   PRO  90          1HG       PRO  90  76.229  -4.157 -17.025
  741   1HD   PRO  90          2HD       PRO  90  76.366  -1.547 -18.500
  742   2HD   PRO  90          1HD       PRO  90  76.152  -1.848 -16.756
  743    H    ARG  91           H        ARG  91  80.904  -4.686 -18.396
  744    HA   ARG  91           HA       ARG  91  81.768  -2.881 -20.636
  745   1HB   ARG  91          2HB       ARG  91  82.893  -2.480 -18.433
  746   2HB   ARG  91          1HB       ARG  91  83.458  -4.151 -18.456
  747   1HG   ARG  91          2HG       ARG  91  85.257  -2.829 -19.323
  748   2HG   ARG  91          1HG       ARG  91  84.521  -3.630 -20.712
  749   1HD   ARG  91          2HD       ARG  91  83.188  -1.578 -21.174
  750   2HD   ARG  91          1HD       ARG  91  84.001  -0.771 -19.817
  751    HE   ARG  91           HE       ARG  91  85.209  -1.402 -22.409
  752   1HH1  ARG  91          1HH1      ARG  91  85.830  -0.784 -19.010
  753   2HH1  ARG  91          2HH1      ARG  91  87.462  -0.295 -19.303
  754   1HH2  ARG  91          1HH2      ARG  91  87.324  -0.760 -22.724
  755   2HH2  ARG  91          2HH2      ARG  91  88.298  -0.281 -21.375
  756    H    ASN  92           H        ASN  92  82.672  -3.937 -22.413
  757    HA   ASN  92           HA       ASN  92  83.124  -5.724 -23.890
  758   1HB   ASN  92          2HB       ASN  92  84.972  -5.781 -22.118
  759   2HB   ASN  92          1HB       ASN  92  84.076  -7.104 -21.368
  760   1HD2  ASN  92          1HD2      ASN  92  84.758  -9.128 -22.065
  761   2HD2  ASN  92          2HD2      ASN  92  85.427  -9.465 -23.587
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1  84.313  13.485   1.045
    2   2H    MET   1          2H        MET   1  82.801  12.740   0.823
    3   3H    MET   1          3H        MET   1  82.915  14.433   0.894
    4    HA   MET   1           HA       MET   1  84.302  14.370  -1.162
    5   1HB   MET   1          2HB       MET   1  83.531  11.470  -0.783
    6   2HB   MET   1          1HB       MET   1  84.046  12.098  -2.349
    7   1HG   MET   1          2HG       MET   1  86.138  12.934  -1.278
    8   2HG   MET   1          1HG       MET   1  85.638  12.163   0.228
    9   1HE   MET   1          1HE       MET   1  84.137   9.504  -1.023
   10   2HE   MET   1          2HE       MET   1  85.018   9.785   0.476
   11   3HE   MET   1          3HE       MET   1  85.481   8.446  -0.571
   12    H    ASP   2           H        ASP   2  83.061  13.498  -3.379
   13    HA   ASP   2           HA       ASP   2  80.487  14.872  -3.369
   14   1HB   ASP   2          2HB       ASP   2  81.957  13.187  -5.425
   15   2HB   ASP   2          1HB       ASP   2  80.529  14.159  -5.773
   16    H    VAL   3           H        VAL   3  78.424  13.923  -3.503
   17    HA   VAL   3           HA       VAL   3  78.293  10.949  -3.355
   18    HB   VAL   3           HB       VAL   3  78.036  12.335  -1.187
   19   1HG1  VAL   3          1HG1      VAL   3  76.493  14.049  -2.242
   20   2HG1  VAL   3          2HG1      VAL   3  75.919  13.367  -0.720
   21   3HG1  VAL   3          3HG1      VAL   3  75.242  12.802  -2.251
   22   1HG2  VAL   3          1HG2      VAL   3  77.404   9.980  -1.338
   23   2HG2  VAL   3          2HG2      VAL   3  75.849  10.421  -2.047
   24   3HG2  VAL   3          3HG2      VAL   3  76.211  10.855  -0.375
   25    H    LEU   4           H        LEU   4  76.750  10.046  -4.700
   26    HA   LEU   4           HA       LEU   4  75.415  11.818  -6.628
   27   1HB   LEU   4          2HB       LEU   4  75.293   8.800  -6.332
   28   2HB   LEU   4          1HB       LEU   4  74.937   9.731  -7.780
   29    HG   LEU   4           HG       LEU   4  77.645   9.382  -6.450
   30   1HD1  LEU   4          1HD1      LEU   4  77.189   8.833  -9.330
   31   2HD1  LEU   4          2HD1      LEU   4  76.407   7.730  -8.198
   32   3HD1  LEU   4          3HD1      LEU   4  78.155   7.949  -8.149
   33   1HD2  LEU   4          1HD2      LEU   4  78.370  10.707  -8.597
   34   2HD2  LEU   4          2HD2      LEU   4  77.784  11.608  -7.195
   35   3HD2  LEU   4          3HD2      LEU   4  76.713  11.315  -8.569
   36    H    ALA   5           H        ALA   5  74.555  10.154  -3.688
   37    HA   ALA   5           HA       ALA   5  71.966  11.422  -3.593
   38   1HB   ALA   5          1HB       ALA   5  71.656   8.462  -3.662
   39   2HB   ALA   5          2HB       ALA   5  71.979   9.244  -5.210
   40   3HB   ALA   5          3HB       ALA   5  70.570   9.716  -4.259
   41    H    LYS   6           H        LYS   6  70.979  11.077  -1.493
   42    HA   LYS   6           HA       LYS   6  72.658   9.536   0.465
   43   1HB   LYS   6          2HB       LYS   6  73.136  12.001   0.366
   44   2HB   LYS   6          1HB       LYS   6  71.453  12.307   0.790
   45   1HG   LYS   6          2HG       LYS   6  71.737  11.101   2.903
   46   2HG   LYS   6          1HG       LYS   6  73.403  10.718   2.476
   47   1HD   LYS   6          2HD       LYS   6  73.558  13.359   2.171
   48   2HD   LYS   6          1HD       LYS   6  72.218  13.327   3.318
   49   1HE   LYS   6          2HE       LYS   6  73.921  11.541   4.494
   50   2HE   LYS   6          1HE       LYS   6  75.071  12.671   3.751
   51   1HZ   LYS   6          1HZ       LYS   6  72.752  13.407   5.460
   52   2HZ   LYS   6          2HZ       LYS   6  73.788  14.512   4.690
   53   3HZ   LYS   6          3HZ       LYS   6  74.385  13.492   5.912
   54    H    PHE   7           H        PHE   7  71.372   8.124   1.612
   55    HA   PHE   7           HA       PHE   7  68.612   8.929   2.358
   56   1HB   PHE   7          2HB       PHE   7  67.668   6.922   1.284
   57   2HB   PHE   7          1HB       PHE   7  68.499   7.929   0.102
   58    HD1  PHE   7           HD1      PHE   7  68.219   4.621   1.503
   59    HD2  PHE   7           HD2      PHE   7  71.016   7.345  -0.428
   60    HE1  PHE   7           HE1      PHE   7  69.674   2.673   0.860
   61    HE2  PHE   7           HE2      PHE   7  72.474   5.396  -1.065
   62    HZ   PHE   7           HZ       PHE   7  71.801   3.057  -0.417
   63    H    HIS   8           H        HIS   8  67.645   7.365   3.926
   64    HA   HIS   8           HA       HIS   8  69.788   6.094   5.605
   65   1HB   HIS   8          2HB       HIS   8  67.075   7.300   6.254
   66   2HB   HIS   8          1HB       HIS   8  68.164   6.589   7.445
   67    HD1  HIS   8           HD1      HIS   8  67.744   9.582   5.227
   68    HD2  HIS   8           HD2      HIS   8  70.484   8.149   8.023
   69    HE1  HIS   8           HE1      HIS   8  69.303  11.507   5.752
   70    H    THR   9           H        THR   9  69.538   3.960   6.210
   71    HA   THR   9           HA       THR   9  66.931   2.596   5.926
   72    HB   THR   9           HB       THR   9  68.083   2.547   3.682
   73    HG1  THR   9           HG1      THR   9  66.705   0.889   4.117
   74   1HG2  THR   9          1HG2      THR   9  70.067   1.093   3.425
   75   2HG2  THR   9          2HG2      THR   9  70.132   0.886   5.177
   76   3HG2  THR   9          3HG2      THR   9  70.414   2.476   4.466
   77    H    THR  10           H        THR  10  67.043   0.377   6.943
   78    HA   THR  10           HA       THR  10  69.283   0.197   8.925
   79    HB   THR  10           HB       THR  10  66.888   0.603   9.742
   80    HG1  THR  10           HG1      THR  10  67.623  -0.279  11.461
   81   1HG2  THR  10          1HG2      THR  10  66.244  -2.246   9.633
   82   2HG2  THR  10          2HG2      THR  10  66.234  -1.482   8.039
   83   3HG2  THR  10          3HG2      THR  10  65.205  -0.850   9.327
   84    H    VAL  11           H        VAL  11  69.999  -2.015   9.434
   85    HA   VAL  11           HA       VAL  11  70.390  -3.566   7.001
   86    HB   VAL  11           HB       VAL  11  71.111  -4.128   9.901
   87   1HG1  VAL  11          1HG1      VAL  11  72.382  -5.891   9.182
   88   2HG1  VAL  11          2HG1      VAL  11  72.787  -5.110   7.654
   89   3HG1  VAL  11          3HG1      VAL  11  71.227  -5.907   7.849
   90   1HG2  VAL  11          1HG2      VAL  11  73.408  -3.312   8.607
   91   2HG2  VAL  11          2HG2      VAL  11  72.403  -2.275   9.617
   92   3HG2  VAL  11          3HG2      VAL  11  72.187  -2.278   7.866
   93    H    HIS  12           H        HIS  12  69.425  -5.469   6.417
   94    HA   HIS  12           HA       HIS  12  67.454  -6.710   8.305
   95   1HB   HIS  12          2HB       HIS  12  67.397  -6.152   5.355
   96   2HB   HIS  12          1HB       HIS  12  66.512  -7.546   5.982
   97    HD1  HIS  12           HD1      HIS  12  66.893  -3.855   6.934
   98    HD2  HIS  12           HD2      HIS  12  63.974  -6.828   6.764
   99    HE1  HIS  12           HE1      HIS  12  64.725  -2.775   7.674
  100    H    ARG  13           H        ARG  13  67.141  -9.099   7.688
  101    HA   ARG  13           HA       ARG  13  69.360 -10.625   8.269
  102   1HB   ARG  13          2HB       ARG  13  66.951 -11.205   6.538
  103   2HB   ARG  13          1HB       ARG  13  68.047 -12.473   7.097
  104   1HG   ARG  13          2HG       ARG  13  67.628 -11.735   9.449
  105   2HG   ARG  13          1HG       ARG  13  66.446 -10.575   8.840
  106   1HD   ARG  13          2HD       ARG  13  65.211 -12.504   7.770
  107   2HD   ARG  13          1HD       ARG  13  66.311 -13.600   8.628
  108    HE   ARG  13           HE       ARG  13  65.474 -11.955  10.647
  109   1HH1  ARG  13          1HH1      ARG  13  63.696 -13.732   8.194
  110   2HH1  ARG  13          2HH1      ARG  13  62.300 -13.898   9.198
  111   1HH2  ARG  13          1HH2      ARG  13  63.642 -12.204  11.894
  112   2HH2  ARG  13          2HH2      ARG  13  62.266 -13.046  11.264
  113    H    ILE  14           H        ILE  14  70.872 -11.884   7.076
  114    HA   ILE  14           HA       ILE  14  72.446 -12.334   5.390
  115    HB   ILE  14           HB       ILE  14  70.309 -11.245   3.527
  116   1HG1  ILE  14          2HG1      ILE  14  70.793 -14.136   4.289
  117   2HG1  ILE  14          1HG1      ILE  14  69.585 -13.136   5.097
  118   1HG2  ILE  14          1HG2      ILE  14  71.546 -13.137   2.119
  119   2HG2  ILE  14          2HG2      ILE  14  72.880 -12.721   3.194
  120   3HG2  ILE  14          3HG2      ILE  14  72.155 -11.483   2.169
  121   1HD1  ILE  14          1HD1      ILE  14  68.921 -12.606   2.544
  122   2HD1  ILE  14          2HD1      ILE  14  68.245 -13.974   3.429
  123   3HD1  ILE  14          3HD1      ILE  14  69.596 -14.221   2.324
  124    H    GLY  15           H        GLY  15  71.696  -9.270   6.365
  125   1HA   GLY  15          2HA       GLY  15  73.000  -7.317   6.219
  126   2HA   GLY  15          1HA       GLY  15  74.043  -8.148   5.069
  127    H    ARG  16           H        ARG  16  70.677  -8.260   4.272
  128    HA   ARG  16           HA       ARG  16  71.182  -6.653   1.873
  129   1HB   ARG  16          2HB       ARG  16  69.930  -8.795   1.882
  130   2HB   ARG  16          1HB       ARG  16  68.715  -8.074   2.938
  131   1HG   ARG  16          2HG       ARG  16  68.168  -6.413   1.213
  132   2HG   ARG  16          1HG       ARG  16  69.415  -7.077   0.158
  133   1HD   ARG  16          2HD       ARG  16  67.298  -8.029  -0.544
  134   2HD   ARG  16          1HD       ARG  16  68.182  -9.310   0.306
  135    HE   ARG  16           HE       ARG  16  66.506  -7.664   2.060
  136   1HH1  ARG  16          1HH1      ARG  16  66.626 -10.528   0.032
  137   2HH1  ARG  16          2HH1      ARG  16  65.305 -11.278   0.856
  138   1HH2  ARG  16          1HH2      ARG  16  64.806  -8.683   3.082
  139   2HH2  ARG  16          2HH2      ARG  16  64.287 -10.250   2.560
  140    H    ILE  17           H        ILE  17  70.179  -4.686   1.383
  141    HA   ILE  17           HA       ILE  17  68.298  -3.524   3.383
  142    HB   ILE  17           HB       ILE  17  69.456  -1.341   3.141
  143   1HG1  ILE  17          2HG1      ILE  17  71.596  -2.859   1.619
  144   2HG1  ILE  17          1HG1      ILE  17  70.355  -1.889   0.826
  145   1HG2  ILE  17          1HG2      ILE  17  71.660  -3.253   3.803
  146   2HG2  ILE  17          2HG2      ILE  17  70.182  -3.318   4.763
  147   3HG2  ILE  17          3HG2      ILE  17  71.115  -1.823   4.680
  148   1HD1  ILE  17          1HD1      ILE  17  71.338   0.077   1.413
  149   2HD1  ILE  17          2HD1      ILE  17  72.777  -0.912   1.661
  150   3HD1  ILE  17          3HD1      ILE  17  71.745  -0.503   3.029
  151    H    ILE  18           H        ILE  18  66.770  -2.017   2.373
  152    HA   ILE  18           HA       ILE  18  66.672  -2.248  -0.621
  153    HB   ILE  18           HB       ILE  18  64.409  -1.833   1.363
  154   1HG1  ILE  18          2HG1      ILE  18  65.372  -4.082   1.626
  155   2HG1  ILE  18          1HG1      ILE  18  63.797  -4.186   0.843
  156   1HG2  ILE  18          1HG2      ILE  18  63.152  -2.672  -0.801
  157   2HG2  ILE  18          2HG2      ILE  18  64.592  -2.071  -1.625
  158   3HG2  ILE  18          3HG2      ILE  18  63.611  -0.974  -0.647
  159   1HD1  ILE  18          1HD1      ILE  18  64.914  -5.495  -0.656
  160   2HD1  ILE  18          2HD1      ILE  18  66.484  -4.815  -0.228
  161   3HD1  ILE  18          3HD1      ILE  18  65.419  -3.946  -1.334
  162    H    ILE  19           H        ILE  19  66.878  -0.342  -1.694
  163    HA   ILE  19           HA       ILE  19  66.928   2.220  -0.233
  164    HB   ILE  19           HB       ILE  19  67.118   1.528  -3.200
  165   1HG1  ILE  19          2HG1      ILE  19  69.221   1.938  -1.030
  166   2HG1  ILE  19          1HG1      ILE  19  68.895   0.448  -1.904
  167   1HG2  ILE  19          1HG2      ILE  19  68.052   4.035  -1.756
  168   2HG2  ILE  19          2HG2      ILE  19  66.483   3.918  -2.554
  169   3HG2  ILE  19          3HG2      ILE  19  67.966   3.764  -3.496
  170   1HD1  ILE  19          1HD1      ILE  19  70.638   2.622  -2.626
  171   2HD1  ILE  19          2HD1      ILE  19  69.401   2.425  -3.869
  172   3HD1  ILE  19          3HD1      ILE  19  70.431   1.063  -3.427
  173    HA   PRO  20           HA       PRO  20  62.596   3.145  -0.952
  174   1HB   PRO  20          2HB       PRO  20  62.767   5.878  -1.082
  175   2HB   PRO  20          1HB       PRO  20  62.811   4.987   0.450
  176   1HG   PRO  20          2HG       PRO  20  65.109   5.965  -1.213
  177   2HG   PRO  20          1HG       PRO  20  64.829   6.183   0.527
  178   1HD   PRO  20          2HD       PRO  20  66.480   4.294  -0.286
  179   2HD   PRO  20          1HD       PRO  20  65.301   3.925   1.001
  180    H    ALA  21           H        ALA  21  61.405   3.475  -2.830
  181    HA   ALA  21           HA       ALA  21  62.652   3.333  -5.367
  182   1HB   ALA  21          1HB       ALA  21  60.217   4.247  -6.006
  183   2HB   ALA  21          2HB       ALA  21  59.926   3.941  -4.294
  184   3HB   ALA  21          3HB       ALA  21  60.445   2.627  -5.349
  185    H    GLY  22           H        GLY  22  61.776   6.131  -3.416
  186   1HA   GLY  22          2HA       GLY  22  61.834   8.115  -5.504
  187   2HA   GLY  22          1HA       GLY  22  62.086   8.440  -3.786
  188    H    THR  23           H        THR  23  64.377   6.886  -3.319
  189    HA   THR  23           HA       THR  23  66.442   8.642  -4.325
  190    HB   THR  23           HB       THR  23  66.572   5.962  -2.894
  191    HG1  THR  23           HG1      THR  23  65.448   7.805  -1.880
  192   1HG2  THR  23          1HG2      THR  23  68.662   8.149  -2.985
  193   2HG2  THR  23          2HG2      THR  23  68.695   6.744  -4.049
  194   3HG2  THR  23          3HG2      THR  23  68.829   6.531  -2.303
  195    H    ARG  24           H        ARG  24  65.397   5.338  -5.181
  196    HA   ARG  24           HA       ARG  24  67.470   4.640  -7.035
  197   1HB   ARG  24          2HB       ARG  24  64.525   4.072  -7.465
  198   2HB   ARG  24          1HB       ARG  24  65.893   3.076  -7.939
  199   1HG   ARG  24          2HG       ARG  24  66.343   3.006  -5.334
  200   2HG   ARG  24          1HG       ARG  24  64.632   3.404  -5.252
  201   1HD   ARG  24          2HD       ARG  24  64.452   1.443  -7.054
  202   2HD   ARG  24          1HD       ARG  24  65.938   0.915  -6.231
  203    HE   ARG  24           HE       ARG  24  64.369   1.521  -4.109
  204   1HH1  ARG  24          1HH1      ARG  24  63.656  -0.358  -6.985
  205   2HH1  ARG  24          2HH1      ARG  24  62.480  -1.323  -6.169
  206   1HH2  ARG  24          1HH2      ARG  24  62.866   0.242  -3.112
  207   2HH2  ARG  24          2HH2      ARG  24  62.033  -0.992  -3.999
  208    H    LYS  25           H        LYS  25  64.506   6.529  -7.435
  209    HA   LYS  25           HA       LYS  25  64.646   6.929 -10.266
  210   1HB   LYS  25          2HB       LYS  25  62.659   7.266  -8.808
  211   2HB   LYS  25          1HB       LYS  25  63.453   8.652  -8.062
  212   1HG   LYS  25          2HG       LYS  25  63.545   9.777 -10.254
  213   2HG   LYS  25          1HG       LYS  25  62.732   8.397 -10.993
  214   1HD   LYS  25          2HD       LYS  25  60.816   8.756  -9.414
  215   2HD   LYS  25          1HD       LYS  25  61.613  10.229  -8.857
  216   1HE   LYS  25          2HE       LYS  25  61.681  10.807 -11.443
  217   2HE   LYS  25          1HE       LYS  25  60.322   9.668 -11.507
  218   1HZ   LYS  25          1HZ       LYS  25  59.214  10.873  -9.776
  219   2HZ   LYS  25          2HZ       LYS  25  59.625  11.973 -11.005
  220   3HZ   LYS  25          3HZ       LYS  25  60.538  11.914  -9.574
  221    H    PHE  26           H        PHE  26  65.646   9.050  -7.572
  222    HA   PHE  26           HA       PHE  26  66.698  11.207  -9.095
  223   1HB   PHE  26          2HB       PHE  26  66.261  11.154  -6.644
  224   2HB   PHE  26          1HB       PHE  26  67.643  10.079  -6.437
  225    HD1  PHE  26           HD1      PHE  26  69.839  10.954  -6.160
  226    HD2  PHE  26           HD2      PHE  26  66.680  13.469  -7.797
  227    HE1  PHE  26           HE1      PHE  26  71.378  12.943  -6.080
  228    HE2  PHE  26           HE2      PHE  26  68.220  15.456  -7.716
  229    HZ   PHE  26           HZ       PHE  26  70.568  15.193  -6.856
  230    H    TYR  27           H        TYR  27  68.239   8.187  -8.052
  231    HA   TYR  27           HA       TYR  27  70.866   8.968  -9.133
  232   1HB   TYR  27          2HB       TYR  27  70.468   7.686  -7.033
  233   2HB   TYR  27          1HB       TYR  27  69.806   6.368  -7.984
  234    HD1  TYR  27           HD1      TYR  27  72.801   7.854  -6.617
  235    HD2  TYR  27           HD2      TYR  27  71.352   5.296  -9.827
  236    HE1  TYR  27           HE1      TYR  27  75.110   6.904  -6.913
  237    HE2  TYR  27           HE2      TYR  27  73.656   4.345 -10.115
  238    HH   TYR  27           HH       TYR  27  76.170   4.874  -7.806
  239    H    GLY  28           H        GLY  28  68.040   7.390 -10.410
  240   1HA   GLY  28          2HA       GLY  28  67.677   6.579 -12.586
  241   2HA   GLY  28          1HA       GLY  28  69.352   6.978 -12.965
  242    H    ILE  29           H        ILE  29  68.102   4.811 -10.417
  243    HA   ILE  29           HA       ILE  29  70.040   2.749 -11.236
  244    HB   ILE  29           HB       ILE  29  67.967   2.859  -9.011
  245   1HG1  ILE  29          2HG1      ILE  29  70.950   3.416  -8.958
  246   2HG1  ILE  29          1HG1      ILE  29  69.695   4.650  -8.939
  247   1HG2  ILE  29          1HG2      ILE  29  68.491   0.618  -9.014
  248   2HG2  ILE  29          2HG2      ILE  29  69.875   1.197  -8.088
  249   3HG2  ILE  29          3HG2      ILE  29  70.041   0.872  -9.813
  250   1HD1  ILE  29          1HD1      ILE  29  68.924   2.943  -6.888
  251   2HD1  ILE  29          2HD1      ILE  29  69.768   4.479  -6.685
  252   3HD1  ILE  29          3HD1      ILE  29  70.685   2.970  -6.753
  253    H    GLU  30           H        GLU  30  69.554   1.047 -12.494
  254    HA   GLU  30           HA       GLU  30  66.739   0.033 -12.563
  255   1HB   GLU  30          2HB       GLU  30  68.705   0.274 -14.871
  256   2HB   GLU  30          1HB       GLU  30  67.116  -0.483 -14.971
  257   1HG   GLU  30          2HG       GLU  30  66.073   1.672 -14.289
  258   2HG   GLU  30          1HG       GLU  30  67.668   2.419 -14.282
  259    H    GLN  31           H        GLN  31  66.688  -2.339 -12.921
  260    HA   GLN  31           HA       GLN  31  68.569  -3.804 -11.386
  261   1HB   GLN  31          2HB       GLN  31  66.239  -4.464 -12.074
  262   2HB   GLN  31          1HB       GLN  31  66.871  -4.819 -13.681
  263   1HG   GLN  31          2HG       GLN  31  68.420  -6.472 -12.727
  264   2HG   GLN  31          1HG       GLN  31  67.827  -6.106 -11.109
  265   1HE2  GLN  31          1HE2      GLN  31  67.585  -8.740 -11.966
  266   2HE2  GLN  31          2HE2      GLN  31  65.963  -9.104 -12.307
  267    H    GLY  32           H        GLY  32  70.450  -4.880 -11.889
  268   1HA   GLY  32          2HA       GLY  32  72.059  -5.923 -13.332
  269   2HA   GLY  32          1HA       GLY  32  71.295  -5.142 -14.712
  270    H    ASP  33           H        ASP  33  71.412  -2.535 -12.883
  271    HA   ASP  33           HA       ASP  33  73.933  -1.557 -14.013
  272   1HB   ASP  33          2HB       ASP  33  71.867  -0.424 -12.102
  273   2HB   ASP  33          1HB       ASP  33  73.226   0.505 -12.732
  274    H    PHE  34           H        PHE  34  75.715  -0.700 -12.683
  275    HA   PHE  34           HA       PHE  34  75.936  -2.022  -9.997
  276   1HB   PHE  34          2HB       PHE  34  77.961  -1.224 -12.105
  277   2HB   PHE  34          1HB       PHE  34  78.425  -1.692 -10.470
  278    HD1  PHE  34           HD1      PHE  34  76.913  -2.859 -13.672
  279    HD2  PHE  34           HD2      PHE  34  78.222  -4.010  -9.678
  280    HE1  PHE  34           HE1      PHE  34  76.748  -5.285 -14.317
  281    HE2  PHE  34           HE2      PHE  34  78.055  -6.435 -10.323
  282    HZ   PHE  34           HZ       PHE  34  77.318  -7.073 -12.642
  283    H    VAL  35           H        VAL  35  76.325  -0.665  -8.260
  284    HA   VAL  35           HA       VAL  35  77.036   2.181  -8.843
  285    HB   VAL  35           HB       VAL  35  75.435   2.845  -7.057
  286   1HG1  VAL  35          1HG1      VAL  35  74.145   1.110  -9.189
  287   2HG1  VAL  35          2HG1      VAL  35  74.740   2.748  -9.459
  288   3HG1  VAL  35          3HG1      VAL  35  73.398   2.469  -8.350
  289   1HG2  VAL  35          1HG2      VAL  35  73.750   1.084  -6.351
  290   2HG2  VAL  35          2HG2      VAL  35  75.372   0.856  -5.692
  291   3HG2  VAL  35          3HG2      VAL  35  74.828  -0.126  -7.052
  292    H    GLU  36           H        GLU  36  78.272   3.174  -7.104
  293    HA   GLU  36           HA       GLU  36  79.578   1.173  -5.286
  294   1HB   GLU  36          2HB       GLU  36  80.950   2.178  -7.140
  295   2HB   GLU  36          1HB       GLU  36  80.644   3.773  -6.450
  296   1HG   GLU  36          2HG       GLU  36  81.678   3.007  -4.311
  297   2HG   GLU  36          1HG       GLU  36  82.060   1.468  -5.075
  298    H    ILE  37           H        ILE  37  79.119   1.531  -3.180
  299    HA   ILE  37           HA       ILE  37  78.208   4.264  -2.368
  300    HB   ILE  37           HB       ILE  37  76.372   2.783  -3.084
  301   1HG1  ILE  37          2HG1      ILE  37  76.219   2.857  -0.080
  302   2HG1  ILE  37          1HG1      ILE  37  76.263   4.358  -1.004
  303   1HG2  ILE  37          1HG2      ILE  37  77.406   0.616  -2.653
  304   2HG2  ILE  37          2HG2      ILE  37  75.884   0.725  -1.766
  305   3HG2  ILE  37          3HG2      ILE  37  77.416   0.935  -0.917
  306   1HD1  ILE  37          1HD1      ILE  37  74.039   4.134  -1.305
  307   2HD1  ILE  37          2HD1      ILE  37  74.055   2.506  -0.631
  308   3HD1  ILE  37          3HD1      ILE  37  74.381   2.752  -2.345
  309    H    LYS  38           H        LYS  38  78.208   4.595  -0.023
  310    HA   LYS  38           HA       LYS  38  79.870   2.669   1.546
  311   1HB   LYS  38          2HB       LYS  38  81.123   4.686   0.627
  312   2HB   LYS  38          1HB       LYS  38  80.093   5.690   1.656
  313   1HG   LYS  38          2HG       LYS  38  80.849   4.462   3.642
  314   2HG   LYS  38          1HG       LYS  38  81.848   3.420   2.631
  315   1HD   LYS  38          2HD       LYS  38  83.100   5.445   1.859
  316   2HD   LYS  38          1HD       LYS  38  82.157   6.416   2.990
  317   1HE   LYS  38          2HE       LYS  38  83.045   4.417   4.644
  318   2HE   LYS  38          1HE       LYS  38  84.415   4.588   3.529
  319   1HZ   LYS  38          1HZ       LYS  38  84.634   6.201   5.282
  320   2HZ   LYS  38          2HZ       LYS  38  83.058   6.774   5.016
  321   3HZ   LYS  38          3HZ       LYS  38  84.262   7.013   3.840
  322    H    ILE  39           H        ILE  39  79.274   2.510   3.740
  323    HA   ILE  39           HA       ILE  39  76.807   4.027   4.544
  324    HB   ILE  39           HB       ILE  39  76.412   2.042   6.030
  325   1HG1  ILE  39          2HG1      ILE  39  78.595   0.667   4.456
  326   2HG1  ILE  39          1HG1      ILE  39  78.924   1.439   6.007
  327   1HG2  ILE  39          1HG2      ILE  39  76.464   1.981   3.072
  328   2HG2  ILE  39          2HG2      ILE  39  75.125   1.714   4.190
  329   3HG2  ILE  39          3HG2      ILE  39  76.275   0.417   3.865
  330   1HD1  ILE  39          1HD1      ILE  39  77.358  -1.018   5.408
  331   2HD1  ILE  39          2HD1      ILE  39  76.743   0.019   6.695
  332   3HD1  ILE  39          3HD1      ILE  39  78.376  -0.641   6.799
  333    H    VAL  40           H        VAL  40  76.730   4.827   6.686
  334    HA   VAL  40           HA       VAL  40  79.214   4.624   8.330
  335    HB   VAL  40           HB       VAL  40  77.723   7.170   7.588
  336   1HG1  VAL  40          1HG1      VAL  40  80.089   6.606   9.389
  337   2HG1  VAL  40          2HG1      VAL  40  78.597   7.454   9.790
  338   3HG1  VAL  40          3HG1      VAL  40  79.779   8.208   8.722
  339   1HG2  VAL  40          1HG2      VAL  40  80.185   5.827   6.549
  340   2HG2  VAL  40          2HG2      VAL  40  80.216   7.585   6.693
  341   3HG2  VAL  40          3HG2      VAL  40  78.993   6.805   5.691
  342    H    LYS  41           H        LYS  41  78.610   4.005  10.337
  343    HA   LYS  41           HA       LYS  41  76.055   5.047  11.491
  344   1HB   LYS  41          2HB       LYS  41  75.854   2.670  10.691
  345   2HB   LYS  41          1HB       LYS  41  77.157   2.236  11.801
  346   1HG   LYS  41          2HG       LYS  41  75.786   3.188  13.679
  347   2HG   LYS  41          1HG       LYS  41  74.460   3.402  12.537
  348   1HD   LYS  41          2HD       LYS  41  74.599   0.938  12.028
  349   2HD   LYS  41          1HD       LYS  41  75.770   0.791  13.337
  350   1HE   LYS  41          2HE       LYS  41  73.638   0.257  14.307
  351   2HE   LYS  41          1HE       LYS  41  73.995   1.912  14.834
  352   1HZ   LYS  41          1HZ       LYS  41  72.515   1.314  12.334
  353   2HZ   LYS  41          2HZ       LYS  41  72.655   2.807  13.133
  354   3HZ   LYS  41          3HZ       LYS  41  71.728   1.558  13.816
  355    H    TYR  42           H        TYR  42  76.231   5.524  13.726
  356    HA   TYR  42           HA       TYR  42  79.035   5.588  14.760
  357   1HB   TYR  42          2HB       TYR  42  77.528   7.640  14.494
  358   2HB   TYR  42          1HB       TYR  42  76.580   6.994  15.835
  359    HD1  TYR  42           HD1      TYR  42  80.070   8.000  14.838
  360    HD2  TYR  42           HD2      TYR  42  77.279   7.304  18.109
  361    HE1  TYR  42           HE1      TYR  42  81.744   8.937  16.462
  362    HE2  TYR  42           HE2      TYR  42  78.952   8.244  19.735
  363    HH   TYR  42           HH       TYR  42  82.255   8.862  18.848
  364    H    GLU  43           H        GLU  43  79.616   4.269  16.440
  365    HA   GLU  43           HA       GLU  43  77.470   3.162  18.212
  366   1HB   GLU  43          2HB       GLU  43  79.772   1.690  16.887
  367   2HB   GLU  43          1HB       GLU  43  78.660   0.976  18.056
  368   1HG   GLU  43          2HG       GLU  43  76.761   1.514  16.538
  369   2HG   GLU  43          1HG       GLU  43  77.910   2.136  15.356
  370    H    GLY  44           H        GLY  44  78.027   3.280  20.361
  371   1HA   GLY  44          2HA       GLY  44  79.279   3.747  22.287
  372   2HA   GLY  44          1HA       GLY  44  80.652   3.034  21.441
  373    H    GLU  45           H        GLU  45  82.311   4.457  21.511
  374    HA   GLU  45           HA       GLU  45  81.738   7.369  21.168
  375   1HB   GLU  45          2HB       GLU  45  83.899   7.692  22.265
  376   2HB   GLU  45          1HB       GLU  45  82.913   6.588  23.219
  377   1HG   GLU  45          2HG       GLU  45  84.122   4.662  22.253
  378   2HG   GLU  45          1HG       GLU  45  85.095   5.758  21.275
  379    H    GLU  46           H        GLU  46  82.380   4.933  19.101
  380    HA   GLU  46           HA       GLU  46  84.243   6.601  17.453
  381   1HB   GLU  46          2HB       GLU  46  85.307   4.474  16.764
  382   2HB   GLU  46          1HB       GLU  46  85.395   4.705  18.509
  383   1HG   GLU  46          2HG       GLU  46  82.953   3.351  18.055
  384   2HG   GLU  46          1HG       GLU  46  84.127   2.565  17.004
  385    HA   PRO  47           HA       PRO  47  81.070   5.816  14.349
  386   1HB   PRO  47          2HB       PRO  47  82.792   6.871  12.282
  387   2HB   PRO  47          1HB       PRO  47  81.380   7.638  13.027
  388   1HG   PRO  47          2HG       PRO  47  84.000   8.457  13.331
  389   2HG   PRO  47          1HG       PRO  47  82.651   8.897  14.385
  390   1HD   PRO  47          2HD       PRO  47  84.825   6.939  14.830
  391   2HD   PRO  47          1HD       PRO  47  83.899   7.902  16.001
  392    H    LYS  48           H        LYS  48  80.768   4.045  13.017
  393    HA   LYS  48           HA       LYS  48  83.175   2.495  12.120
  394   1HB   LYS  48          2HB       LYS  48  80.294   1.641  12.589
  395   2HB   LYS  48          1HB       LYS  48  81.608   0.577  12.088
  396   1HG   LYS  48          2HG       LYS  48  81.671   2.197  14.644
  397   2HG   LYS  48          1HG       LYS  48  81.112   0.525  14.566
  398   1HD   LYS  48          2HD       LYS  48  83.314  -0.095  13.531
  399   2HD   LYS  48          1HD       LYS  48  83.864   1.554  13.833
  400   1HE   LYS  48          2HE       LYS  48  82.989   0.992  16.307
  401   2HE   LYS  48          1HE       LYS  48  83.375  -0.658  15.780
  402   1HZ   LYS  48          1HZ       LYS  48  85.206   1.645  15.391
  403   2HZ   LYS  48          2HZ       LYS  48  85.555  -0.004  15.175
  404   3HZ   LYS  48          3HZ       LYS  48  85.296   0.614  16.736
  405    H    GLU  49           H        GLU  49  83.384   2.192   9.895
  406    HA   GLU  49           HA       GLU  49  81.145   3.129   8.135
  407   1HB   GLU  49          2HB       GLU  49  84.098   3.823   8.017
  408   2HB   GLU  49          1HB       GLU  49  82.898   4.323   6.825
  409   1HG   GLU  49          2HG       GLU  49  81.626   5.478   8.627
  410   2HG   GLU  49          1HG       GLU  49  82.891   5.038   9.772
  411    H    GLY  50           H        GLY  50  81.394   2.376   5.873
  412   1HA   GLY  50          2HA       GLY  50  83.337   0.269   5.285
  413   2HA   GLY  50          1HA       GLY  50  81.677  -0.310   5.437
  414    H    THR  51           H        THR  51  83.688   0.210   3.085
  415    HA   THR  51           HA       THR  51  81.651   1.530   1.311
  416    HB   THR  51           HB       THR  51  84.639   1.465   0.837
  417    HG1  THR  51           HG1      THR  51  84.891   3.129   2.117
  418   1HG2  THR  51          1HG2      THR  51  82.604   2.181  -0.807
  419   2HG2  THR  51          2HG2      THR  51  84.206   2.919  -0.872
  420   3HG2  THR  51          3HG2      THR  51  82.902   3.720   0.002
  421    H    PHE  52           H        PHE  52  81.094   0.332  -0.517
  422    HA   PHE  52           HA       PHE  52  82.891  -1.765  -1.518
  423   1HB   PHE  52          2HB       PHE  52  81.460  -3.628  -1.023
  424   2HB   PHE  52          1HB       PHE  52  81.606  -2.711   0.470
  425    HD1  PHE  52           HD1      PHE  52  79.341  -4.181  -1.900
  426    HD2  PHE  52           HD2      PHE  52  79.702  -0.918   0.963
  427    HE1  PHE  52           HE1      PHE  52  76.840  -3.965  -1.834
  428    HE2  PHE  52           HE2      PHE  52  77.195  -0.703   1.030
  429    HZ   PHE  52           HZ       PHE  52  75.766  -2.228  -0.377
  430    H    THR  53           H        THR  53  81.764  -2.936  -3.438
  431    HA   THR  53           HA       THR  53  80.053  -0.987  -4.948
  432    HB   THR  53           HB       THR  53  81.810  -3.271  -5.913
  433    HG1  THR  53           HG1      THR  53  83.325  -1.788  -6.235
  434   1HG2  THR  53          1HG2      THR  53  81.517  -1.937  -8.107
  435   2HG2  THR  53          2HG2      THR  53  80.147  -1.173  -7.300
  436   3HG2  THR  53          3HG2      THR  53  80.155  -2.917  -7.563
  437    H    ALA  54           H        ALA  54  78.057  -1.737  -5.702
  438    HA   ALA  54           HA       ALA  54  77.334  -4.589  -5.177
  439   1HB   ALA  54          1HB       ALA  54  76.782  -2.488  -3.484
  440   2HB   ALA  54          2HB       ALA  54  75.840  -3.976  -3.561
  441   3HB   ALA  54          3HB       ALA  54  75.319  -2.554  -4.465
  442    H    ARG  55           H        ARG  55  75.719  -5.403  -6.540
  443    HA   ARG  55           HA       ARG  55  74.991  -3.739  -8.900
  444   1HB   ARG  55          2HB       ARG  55  75.924  -6.119  -8.997
  445   2HB   ARG  55          1HB       ARG  55  74.381  -6.649  -8.325
  446   1HG   ARG  55          2HG       ARG  55  73.232  -5.462 -10.227
  447   2HG   ARG  55          1HG       ARG  55  74.822  -5.182 -10.938
  448   1HD   ARG  55          2HD       ARG  55  75.195  -7.704 -10.815
  449   2HD   ARG  55          1HD       ARG  55  73.469  -7.845 -10.429
  450    HE   ARG  55           HE       ARG  55  74.012  -6.164 -12.763
  451   1HH1  ARG  55          1HH1      ARG  55  73.385  -9.432 -11.645
  452   2HH1  ARG  55          2HH1      ARG  55  72.803  -9.946 -13.189
  453   1HH2  ARG  55          1HH2      ARG  55  73.250  -6.887 -14.730
  454   2HH2  ARG  55          2HH2      ARG  55  72.726  -8.527 -14.914
  455    H    VAL  56           H        VAL  56  72.827  -3.244  -9.352
  456    HA   VAL  56           HA       VAL  56  70.963  -3.215  -7.094
  457    HB   VAL  56           HB       VAL  56  70.767  -2.368 -10.005
  458   1HG1  VAL  56          1HG1      VAL  56  69.005  -1.047  -8.050
  459   2HG1  VAL  56          2HG1      VAL  56  68.638  -2.755  -8.264
  460   3HG1  VAL  56          3HG1      VAL  56  68.637  -1.675  -9.658
  461   1HG2  VAL  56          1HG2      VAL  56  71.578  -0.313  -9.345
  462   2HG2  VAL  56          2HG2      VAL  56  72.398  -1.320  -8.152
  463   3HG2  VAL  56          3HG2      VAL  56  70.920  -0.464  -7.715
  464    H    GLY  57           H        GLY  57  69.539  -4.791  -6.669
  465   1HA   GLY  57          2HA       GLY  57  68.935  -6.823  -8.766
  466   2HA   GLY  57          1HA       GLY  57  68.729  -7.071  -7.031
  467    H    GLU  58           H        GLU  58  66.538  -7.776  -7.947
  468    HA   GLU  58           HA       GLU  58  64.628  -5.901  -8.962
  469   1HB   GLU  58          2HB       GLU  58  64.566  -8.470  -8.811
  470   2HB   GLU  58          1HB       GLU  58  64.048  -8.248  -7.139
  471   1HG   GLU  58          2HG       GLU  58  62.049  -8.458  -8.453
  472   2HG   GLU  58          1HG       GLU  58  62.195  -6.755  -8.024
  473    H    GLN  59           H        GLN  59  62.903  -4.830  -7.804
  474    HA   GLN  59           HA       GLN  59  62.074  -3.417  -6.119
  475   1HB   GLN  59          2HB       GLN  59  63.248  -5.637  -4.414
  476   2HB   GLN  59          1HB       GLN  59  62.068  -4.448  -3.865
  477   1HG   GLN  59          2HG       GLN  59  61.626  -6.386  -6.153
  478   2HG   GLN  59          1HG       GLN  59  61.005  -6.604  -4.519
  479   1HE2  GLN  59          1HE2      GLN  59  59.851  -5.773  -7.417
  480   2HE2  GLN  59          2HE2      GLN  59  58.733  -4.567  -6.994
  481    H    GLY  60           H        GLY  60  65.142  -3.294  -6.911
  482   1HA   GLY  60          2HA       GLY  60  66.749  -1.659  -6.410
  483   2HA   GLY  60          1HA       GLY  60  65.606  -1.001  -5.242
  484    H    SER  61           H        SER  61  66.490  -4.340  -4.866
  485    HA   SER  61           HA       SER  61  67.511  -3.791  -2.199
  486   1HB   SER  61          2HB       SER  61  67.525  -6.351  -3.831
  487   2HB   SER  61          1HB       SER  61  67.617  -6.227  -2.077
  488    HG   SER  61           HG       SER  61  65.506  -6.564  -2.474
  489    H    VAL  62           H        VAL  62  69.639  -3.955  -1.472
  490    HA   VAL  62           HA       VAL  62  71.770  -4.722  -3.410
  491    HB   VAL  62           HB       VAL  62  71.525  -2.267  -3.453
  492   1HG1  VAL  62          1HG1      VAL  62  71.939  -0.950  -1.406
  493   2HG1  VAL  62          2HG1      VAL  62  72.050  -2.440  -0.470
  494   3HG1  VAL  62          3HG1      VAL  62  70.521  -1.981  -1.221
  495   1HG2  VAL  62          1HG2      VAL  62  73.832  -3.576  -3.304
  496   2HG2  VAL  62          2HG2      VAL  62  73.973  -2.695  -1.783
  497   3HG2  VAL  62          3HG2      VAL  62  73.794  -1.813  -3.299
  498    H    ILE  63           H        ILE  63  73.554  -5.745  -2.381
  499    HA   ILE  63           HA       ILE  63  73.062  -6.480   0.482
  500    HB   ILE  63           HB       ILE  63  74.622  -7.879  -1.718
  501   1HG1  ILE  63          2HG1      ILE  63  72.219  -7.775  -2.264
  502   2HG1  ILE  63          1HG1      ILE  63  72.681  -9.420  -1.834
  503   1HG2  ILE  63          1HG2      ILE  63  75.472  -8.756   0.266
  504   2HG2  ILE  63          2HG2      ILE  63  74.126  -9.850  -0.053
  505   3HG2  ILE  63          3HG2      ILE  63  73.947  -8.553   1.129
  506   1HD1  ILE  63          1HD1      ILE  63  70.549  -8.769  -0.754
  507   2HD1  ILE  63          2HD1      ILE  63  71.369  -7.425   0.039
  508   3HD1  ILE  63          3HD1      ILE  63  71.805  -9.084   0.444
  509    H    ILE  64           H        ILE  64  74.479  -5.685   1.953
  510    HA   ILE  64           HA       ILE  64  77.108  -4.566   1.200
  511    HB   ILE  64           HB       ILE  64  75.739  -5.104   3.863
  512   1HG1  ILE  64          2HG1      ILE  64  76.084  -2.457   2.437
  513   2HG1  ILE  64          1HG1      ILE  64  74.657  -3.467   2.205
  514   1HG2  ILE  64          1HG2      ILE  64  78.235  -4.898   3.986
  515   2HG2  ILE  64          2HG2      ILE  64  77.391  -3.595   4.823
  516   3HG2  ILE  64          3HG2      ILE  64  78.102  -3.307   3.234
  517   1HD1  ILE  64          1HD1      ILE  64  74.439  -1.683   4.006
  518   2HD1  ILE  64          2HD1      ILE  64  75.625  -2.597   4.938
  519   3HD1  ILE  64          3HD1      ILE  64  74.074  -3.327   4.527
  520    HA   PRO  65           HA       PRO  65  79.215  -8.468   1.579
  521   1HB   PRO  65          2HB       PRO  65  81.709  -7.620   2.307
  522   2HB   PRO  65          1HB       PRO  65  81.075  -7.417   0.658
  523   1HG   PRO  65          2HG       PRO  65  81.057  -5.457   2.926
  524   2HG   PRO  65          1HG       PRO  65  81.620  -5.218   1.259
  525   1HD   PRO  65          2HD       PRO  65  79.213  -4.376   1.962
  526   2HD   PRO  65          1HD       PRO  65  79.437  -5.204   0.399
  527    H    LYS  66           H        LYS  66  79.374  -9.938   3.248
  528    HA   LYS  66           HA       LYS  66  78.605  -9.383   5.915
  529   1HB   LYS  66          2HB       LYS  66  78.634 -11.596   4.750
  530   2HB   LYS  66          1HB       LYS  66  80.393 -11.612   4.889
  531   1HG   LYS  66          2HG       LYS  66  80.179 -11.458   7.360
  532   2HG   LYS  66          1HG       LYS  66  78.423 -11.519   7.194
  533   1HD   LYS  66          2HD       LYS  66  78.673 -13.720   6.011
  534   2HD   LYS  66          1HD       LYS  66  80.397 -13.671   6.382
  535   1HE   LYS  66          2HE       LYS  66  78.486 -13.261   8.650
  536   2HE   LYS  66          1HE       LYS  66  78.695 -14.907   8.022
  537   1HZ   LYS  66          1HZ       LYS  66  80.953 -13.097   8.684
  538   2HZ   LYS  66          2HZ       LYS  66  81.042 -14.744   8.278
  539   3HZ   LYS  66          3HZ       LYS  66  80.350 -14.267   9.754
  540    H    ALA  67           H        ALA  67  81.817  -9.413   4.444
  541    HA   ALA  67           HA       ALA  67  83.439  -9.404   6.780
  542   1HB   ALA  67          1HB       ALA  67  83.727  -8.211   4.013
  543   2HB   ALA  67          2HB       ALA  67  84.417  -9.716   4.621
  544   3HB   ALA  67          3HB       ALA  67  85.038  -8.167   5.191
  545    H    LEU  68           H        LEU  68  81.826  -6.731   5.083
  546    HA   LEU  68           HA       LEU  68  82.960  -4.661   6.806
  547   1HB   LEU  68          2HB       LEU  68  80.709  -4.757   4.778
  548   2HB   LEU  68          1HB       LEU  68  81.201  -3.276   5.596
  549    HG   LEU  68           HG       LEU  68  83.002  -5.019   3.879
  550   1HD1  LEU  68          1HD1      LEU  68  81.099  -3.417   2.908
  551   2HD1  LEU  68          2HD1      LEU  68  82.690  -3.514   2.151
  552   3HD1  LEU  68          3HD1      LEU  68  82.311  -2.181   3.241
  553   1HD2  LEU  68          1HD2      LEU  68  84.382  -2.759   4.121
  554   2HD2  LEU  68          2HD2      LEU  68  84.502  -4.017   5.351
  555   3HD2  LEU  68          3HD2      LEU  68  83.462  -2.618   5.620
  556    H    ARG  69           H        ARG  69  79.968  -6.583   6.763
  557    HA   ARG  69           HA       ARG  69  78.422  -5.112   8.669
  558   1HB   ARG  69          2HB       ARG  69  78.693  -8.126   8.348
  559   2HB   ARG  69          1HB       ARG  69  77.326  -7.284   9.063
  560   1HG   ARG  69          2HG       ARG  69  76.975  -6.150   6.825
  561   2HG   ARG  69          1HG       ARG  69  78.191  -7.247   6.163
  562   1HD   ARG  69          2HD       ARG  69  76.700  -9.083   7.404
  563   2HD   ARG  69          1HD       ARG  69  75.435  -7.867   7.150
  564    HE   ARG  69           HE       ARG  69  76.608  -7.934   4.691
  565   1HH1  ARG  69          1HH1      ARG  69  75.488 -10.519   6.793
  566   2HH1  ARG  69          2HH1      ARG  69  75.202 -11.592   5.470
  567   1HH2  ARG  69          1HH2      ARG  69  76.205  -9.366   3.032
  568   2HH2  ARG  69          2HH2      ARG  69  75.599 -10.953   3.370
  569    H    ASP  70           H        ASP  70  80.812  -7.712   9.120
  570    HA   ASP  70           HA       ASP  70  80.542  -7.885  11.975
  571   1HB   ASP  70          2HB       ASP  70  82.777  -8.669  10.074
  572   2HB   ASP  70          1HB       ASP  70  82.653  -9.216  11.745
  573    H    VAL  71           H        VAL  71  82.999  -6.279   9.924
  574    HA   VAL  71           HA       VAL  71  84.659  -5.294  12.027
  575    HB   VAL  71           HB       VAL  71  84.009  -4.210   9.261
  576   1HG1  VAL  71          1HG1      VAL  71  86.231  -3.104   9.408
  577   2HG1  VAL  71          2HG1      VAL  71  86.351  -3.611  11.093
  578   3HG1  VAL  71          3HG1      VAL  71  85.093  -2.476  10.601
  579   1HG2  VAL  71          1HG2      VAL  71  86.471  -5.750  10.042
  580   2HG2  VAL  71          2HG2      VAL  71  85.717  -5.593   8.455
  581   3HG2  VAL  71          3HG2      VAL  71  84.974  -6.613   9.687
  582    H    ILE  72           H        ILE  72  81.778  -3.905  10.503
  583    HA   ILE  72           HA       ILE  72  81.950  -1.397  11.995
  584    HB   ILE  72           HB       ILE  72  79.777  -2.628  10.255
  585   1HG1  ILE  72          2HG1      ILE  72  81.922  -0.587   9.573
  586   2HG1  ILE  72          1HG1      ILE  72  82.017  -2.299   9.161
  587   1HG2  ILE  72          1HG2      ILE  72  79.246  -0.633  11.886
  588   2HG2  ILE  72          2HG2      ILE  72  78.733  -0.527  10.204
  589   3HG2  ILE  72          3HG2      ILE  72  80.185   0.317  10.737
  590   1HD1  ILE  72          1HD1      ILE  72  80.155  -0.196   8.097
  591   2HD1  ILE  72          2HD1      ILE  72  79.658  -1.893   8.085
  592   3HD1  ILE  72          3HD1      ILE  72  81.107  -1.389   7.212
  593    H    GLY  73           H        GLY  73  80.551  -4.536  12.619
  594   1HA   GLY  73          2HA       GLY  73  79.540  -5.293  14.604
  595   2HA   GLY  73          1HA       GLY  73  79.718  -3.663  15.255
  596    H    ILE  74           H        ILE  74  78.038  -4.470  12.252
  597    HA   ILE  74           HA       ILE  74  75.679  -2.997  13.245
  598    HB   ILE  74           HB       ILE  74  76.344  -4.194  10.534
  599   1HG1  ILE  74          2HG1      ILE  74  78.038  -2.543  11.228
  600   2HG1  ILE  74          1HG1      ILE  74  77.042  -1.891   9.931
  601   1HG2  ILE  74          1HG2      ILE  74  74.728  -2.258   9.864
  602   2HG2  ILE  74          2HG2      ILE  74  74.192  -2.347  11.541
  603   3HG2  ILE  74          3HG2      ILE  74  74.042  -3.756  10.492
  604   1HD1  ILE  74          1HD1      ILE  74  77.216  -0.134  11.533
  605   2HD1  ILE  74          2HD1      ILE  74  76.922  -1.232  12.881
  606   3HD1  ILE  74          3HD1      ILE  74  75.610  -0.822  11.776
  607    H    LYS  75           H        LYS  75  73.632  -3.881  13.509
  608    HA   LYS  75           HA       LYS  75  73.287  -6.810  12.981
  609   1HB   LYS  75          2HB       LYS  75  72.163  -6.951  15.182
  610   2HB   LYS  75          1HB       LYS  75  73.811  -6.358  15.356
  611   1HG   LYS  75          2HG       LYS  75  72.269  -4.044  14.959
  612   2HG   LYS  75          1HG       LYS  75  71.290  -5.048  16.025
  613   1HD   LYS  75          2HD       LYS  75  74.207  -4.362  16.506
  614   2HD   LYS  75          1HD       LYS  75  72.843  -3.559  17.286
  615   1HE   LYS  75          2HE       LYS  75  73.112  -6.563  17.429
  616   2HE   LYS  75          1HE       LYS  75  73.986  -5.521  18.570
  617   1HZ   LYS  75          1HZ       LYS  75  71.729  -6.114  19.347
  618   2HZ   LYS  75          2HZ       LYS  75  71.077  -5.319  17.995
  619   3HZ   LYS  75          3HZ       LYS  75  71.944  -4.442  19.163
  620    HA   PRO  76           HA       PRO  76  69.497  -5.862  10.992
  621   1HB   PRO  76          2HB       PRO  76  67.655  -7.487  12.357
  622   2HB   PRO  76          1HB       PRO  76  68.633  -7.969  10.960
  623   1HG   PRO  76          2HG       PRO  76  69.061  -8.501  13.840
  624   2HG   PRO  76          1HG       PRO  76  69.470  -9.491  12.431
  625   1HD   PRO  76          2HD       PRO  76  71.326  -8.125  13.826
  626   2HD   PRO  76          1HD       PRO  76  71.463  -8.397  12.075
  627    H    GLY  77           H        GLY  77  67.965  -4.255  11.206
  628   1HA   GLY  77          2HA       GLY  77  66.223  -3.032  12.294
  629   2HA   GLY  77          1HA       GLY  77  66.714  -3.740  13.829
  630    H    GLU  78           H        GLU  78  69.566  -2.705  12.481
  631    HA   GLU  78           HA       GLU  78  69.491  -0.192  14.070
  632   1HB   GLU  78          2HB       GLU  78  71.515  -2.177  13.167
  633   2HB   GLU  78          1HB       GLU  78  72.071  -0.511  13.334
  634   1HG   GLU  78          2HG       GLU  78  71.043  -0.478  15.636
  635   2HG   GLU  78          1HG       GLU  78  70.731  -2.204  15.461
  636    H    VAL  79           H        VAL  79  69.520   1.776  13.107
  637    HA   VAL  79           HA       VAL  79  69.325   1.861  10.171
  638    HB   VAL  79           HB       VAL  79  67.684   2.925  11.679
  639   1HG1  VAL  79          1HG1      VAL  79  68.275   4.213  13.435
  640   2HG1  VAL  79          2HG1      VAL  79  69.325   5.220  12.440
  641   3HG1  VAL  79          3HG1      VAL  79  69.940   3.721  13.132
  642   1HG2  VAL  79          1HG2      VAL  79  69.253   4.428   9.658
  643   2HG2  VAL  79          2HG2      VAL  79  68.209   5.403  10.691
  644   3HG2  VAL  79          3HG2      VAL  79  67.523   4.097   9.725
  645    H    ILE  80           H        ILE  80  70.834   2.677   8.833
  646    HA   ILE  80           HA       ILE  80  73.131   4.233   9.959
  647    HB   ILE  80           HB       ILE  80  74.521   3.060   8.257
  648   1HG1  ILE  80          2HG1      ILE  80  72.012   1.442   7.710
  649   2HG1  ILE  80          1HG1      ILE  80  72.654   2.690   6.640
  650   1HG2  ILE  80          1HG2      ILE  80  74.810   1.175   9.553
  651   2HG2  ILE  80          2HG2      ILE  80  73.080   0.834   9.634
  652   3HG2  ILE  80          3HG2      ILE  80  73.780   2.105  10.642
  653   1HD1  ILE  80          1HD1      ILE  80  74.889   1.196   7.009
  654   2HD1  ILE  80          2HD1      ILE  80  73.750   0.919   5.691
  655   3HD1  ILE  80          3HD1      ILE  80  73.656  -0.056   7.158
  656    H    GLU  81           H        GLU  81  74.040   5.759   8.381
  657    HA   GLU  81           HA       GLU  81  72.039   6.787   6.420
  658   1HB   GLU  81          2HB       GLU  81  73.006   8.258   8.217
  659   2HB   GLU  81          1HB       GLU  81  74.603   8.000   7.515
  660   1HG   GLU  81          2HG       GLU  81  73.785   8.942   5.364
  661   2HG   GLU  81          1HG       GLU  81  72.225   9.265   6.122
  662    H    VAL  82           H        VAL  82  72.456   6.540   4.278
  663    HA   VAL  82           HA       VAL  82  75.016   5.204   3.523
  664    HB   VAL  82           HB       VAL  82  72.199   5.107   2.386
  665   1HG1  VAL  82          1HG1      VAL  82  73.722   4.649   0.596
  666   2HG1  VAL  82          2HG1      VAL  82  73.142   3.084   1.168
  667   3HG1  VAL  82          3HG1      VAL  82  74.744   3.653   1.633
  668   1HG2  VAL  82          1HG2      VAL  82  72.068   3.897   4.372
  669   2HG2  VAL  82          2HG2      VAL  82  73.766   3.425   4.314
  670   3HG2  VAL  82          3HG2      VAL  82  72.595   2.638   3.255
  671    H    LEU  83           H        LEU  83  76.285   6.149   2.015
  672    HA   LEU  83           HA       LEU  83  75.209   8.470   0.435
  673   1HB   LEU  83          2HB       LEU  83  78.093   7.890   1.213
  674   2HB   LEU  83          1HB       LEU  83  77.444   9.400   0.586
  675    HG   LEU  83           HG       LEU  83  76.780   8.177   3.283
  676   1HD1  LEU  83          1HD1      LEU  83  78.108   9.968   4.215
  677   2HD1  LEU  83          2HD1      LEU  83  78.346  10.685   2.621
  678   3HD1  LEU  83          3HD1      LEU  83  79.091   9.132   3.011
  679   1HD2  LEU  83          1HD2      LEU  83  74.886   9.409   2.456
  680   2HD2  LEU  83          2HD2      LEU  83  75.912  10.739   1.915
  681   3HD2  LEU  83          3HD2      LEU  83  75.697  10.434   3.641
  682    H    LEU  84           H        LEU  84  75.272   8.134  -1.788
  683    HA   LEU  84           HA       LEU  84  76.663   5.789  -2.933
  684   1HB   LEU  84          2HB       LEU  84  74.834   7.976  -3.868
  685   2HB   LEU  84          1HB       LEU  84  75.790   7.095  -5.064
  686    HG   LEU  84           HG       LEU  84  74.335   5.507  -2.994
  687   1HD1  LEU  84          1HD1      LEU  84  72.635   5.758  -5.287
  688   2HD1  LEU  84          2HD1      LEU  84  72.985   7.380  -4.695
  689   3HD1  LEU  84          3HD1      LEU  84  72.280   6.183  -3.614
  690   1HD2  LEU  84          1HD2      LEU  84  75.510   4.094  -4.387
  691   2HD2  LEU  84          2HD2      LEU  84  75.425   5.203  -5.756
  692   3HD2  LEU  84          3HD2      LEU  84  74.024   4.220  -5.328
  693    H    LEU  85           H        LEU  85  78.583   5.919  -4.124
  694    HA   LEU  85           HA       LEU  85  80.036   8.530  -3.939
  695   1HB   LEU  85          2HB       LEU  85  80.723   5.646  -3.503
  696   2HB   LEU  85          1HB       LEU  85  82.005   6.751  -4.004
  697    HG   LEU  85           HG       LEU  85  80.156   7.369  -1.694
  698   1HD1  LEU  85          1HD1      LEU  85  82.937   6.208  -1.454
  699   2HD1  LEU  85          2HD1      LEU  85  81.493   5.197  -1.422
  700   3HD1  LEU  85          3HD1      LEU  85  81.736   6.426  -0.181
  701   1HD2  LEU  85          1HD2      LEU  85  82.175   8.796  -1.076
  702   2HD2  LEU  85          2HD2      LEU  85  81.313   9.304  -2.529
  703   3HD2  LEU  85          3HD2      LEU  85  82.829   8.413  -2.668
  704    H    GLY  86           H        GLY  86  79.184   5.848  -6.070
  705   1HA   GLY  86          2HA       GLY  86  80.028   7.365  -8.436
  706   2HA   GLY  86          1HA       GLY  86  81.093   6.015  -8.080
  707    H    HIS  87           H        HIS  87  80.022   5.703 -10.427
  708    HA   HIS  87           HA       HIS  87  77.894   3.641 -10.077
  709   1HB   HIS  87          2HB       HIS  87  76.596   4.727 -11.905
  710   2HB   HIS  87          1HB       HIS  87  76.784   5.798 -10.522
  711    HD1  HIS  87           HD1      HIS  87  77.218   5.731 -14.103
  712    HD2  HIS  87           HD2      HIS  87  79.138   7.661 -10.945
  713    HE1  HIS  87           HE1      HIS  87  78.517   7.652 -15.121
  714    H    TYR  88           H        TYR  88  77.885   2.062 -11.789
  715    HA   TYR  88           HA       TYR  88  79.929   2.390 -13.941
  716   1HB   TYR  88          2HB       TYR  88  79.520   0.026 -12.083
  717   2HB   TYR  88          1HB       TYR  88  80.536  -0.022 -13.525
  718    HD1  TYR  88           HD1      TYR  88  80.226   1.184 -10.051
  719    HD2  TYR  88           HD2      TYR  88  82.594   1.415 -13.701
  720    HE1  TYR  88           HE1      TYR  88  82.124   2.207  -8.756
  721    HE2  TYR  88           HE2      TYR  88  84.491   2.437 -12.404
  722    HH   TYR  88           HH       TYR  88  84.769   2.317  -9.119
  723    H    LYS  89           H        LYS  89  79.198   1.643 -15.924
  724    HA   LYS  89           HA       LYS  89  76.583   0.168 -15.975
  725   1HB   LYS  89          2HB       LYS  89  77.673   2.366 -17.761
  726   2HB   LYS  89          1HB       LYS  89  76.169   1.496 -18.066
  727   1HG   LYS  89          2HG       LYS  89  75.135   2.369 -16.123
  728   2HG   LYS  89          1HG       LYS  89  76.675   2.889 -15.438
  729   1HD   LYS  89          2HD       LYS  89  76.799   4.767 -16.779
  730   2HD   LYS  89          1HD       LYS  89  75.865   4.027 -18.080
  731   1HE   LYS  89          2HE       LYS  89  73.796   4.295 -16.840
  732   2HE   LYS  89          1HE       LYS  89  74.681   4.853 -15.406
  733   1HZ   LYS  89          1HZ       LYS  89  74.892   6.164 -18.060
  734   2HZ   LYS  89          2HZ       LYS  89  75.467   6.743 -16.569
  735   3HZ   LYS  89          3HZ       LYS  89  73.797   6.671 -16.868
  736    HA   PRO  90           HA       PRO  90  78.495  -2.969 -18.476
  737   1HB   PRO  90          2HB       PRO  90  76.208  -2.540 -20.376
  738   2HB   PRO  90          1HB       PRO  90  76.806  -4.053 -19.659
  739   1HG   PRO  90          2HG       PRO  90  74.615  -3.007 -18.707
  740   2HG   PRO  90          1HG       PRO  90  75.856  -3.579 -17.573
  741   1HD   PRO  90          2HD       PRO  90  75.256  -0.767 -18.440
  742   2HD   PRO  90          1HD       PRO  90  75.565  -1.401 -16.802
  743    H    ARG  91           H        ARG  91  79.931  -3.025 -20.243
  744    HA   ARG  91           HA       ARG  91  79.872  -0.689 -22.129
  745   1HB   ARG  91          2HB       ARG  91  81.587  -0.557 -20.304
  746   2HB   ARG  91          1HB       ARG  91  82.280  -2.068 -20.897
  747   1HG   ARG  91          2HG       ARG  91  82.662  -1.008 -23.108
  748   2HG   ARG  91          1HG       ARG  91  82.022   0.509 -22.475
  749   1HD   ARG  91          2HD       ARG  91  83.816   0.490 -20.722
  750   2HD   ARG  91          1HD       ARG  91  84.502  -0.951 -21.500
  751    HE   ARG  91           HE       ARG  91  84.645   1.768 -22.534
  752   1HH1  ARG  91          1HH1      ARG  91  84.536  -1.621 -23.445
  753   2HH1  ARG  91          2HH1      ARG  91  85.313  -1.333 -24.961
  754   1HH2  ARG  91          1HH2      ARG  91  85.644   2.076 -24.505
  755   2HH2  ARG  91          2HH2      ARG  91  85.934   0.731 -25.556
  756    H    ASN  92           H        ASN  92  80.216  -1.214 -24.287
  757    HA   ASN  92           HA       ASN  92  80.342  -2.574 -26.214
  758   1HB   ASN  92          2HB       ASN  92  82.673  -2.619 -25.334
  759   2HB   ASN  92          1HB       ASN  92  82.273  -4.065 -24.407
  760   1HD2  ASN  92          1HD2      ASN  92  82.285  -2.844 -27.797
  761   2HD2  ASN  92          2HD2      ASN  92  82.591  -4.359 -28.498
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1  84.031  13.982   1.334
    2   2H    MET   1          2H        MET   1  82.454  13.380   1.147
    3   3H    MET   1          3H        MET   1  82.756  15.044   0.984
    4    HA   MET   1           HA       MET   1  84.153  14.575  -0.985
    5   1HB   MET   1          2HB       MET   1  83.214  11.812  -0.201
    6   2HB   MET   1          1HB       MET   1  83.805  12.164  -1.825
    7   1HG   MET   1          2HG       MET   1  85.909  13.048  -0.824
    8   2HG   MET   1          1HG       MET   1  85.327  12.553   0.766
    9   1HE   MET   1          1HE       MET   1  83.724   9.787  -0.101
   10   2HE   MET   1          2HE       MET   1  84.563  10.294   1.362
   11   3HE   MET   1          3HE       MET   1  85.004   8.776   0.584
   12    H    ASP   2           H        ASP   2  82.978  13.563  -3.124
   13    HA   ASP   2           HA       ASP   2  80.411  14.957  -3.331
   14   1HB   ASP   2          2HB       ASP   2  82.009  13.188  -5.213
   15   2HB   ASP   2          1HB       ASP   2  80.593  14.124  -5.690
   16    H    VAL   3           H        VAL   3  78.368  13.995  -3.439
   17    HA   VAL   3           HA       VAL   3  78.238  11.025  -3.278
   18    HB   VAL   3           HB       VAL   3  77.960  12.420  -1.112
   19   1HG1  VAL   3          1HG1      VAL   3  75.168  12.838  -2.201
   20   2HG1  VAL   3          2HG1      VAL   3  76.396  14.109  -2.164
   21   3HG1  VAL   3          3HG1      VAL   3  75.812  13.402  -0.656
   22   1HG2  VAL   3          1HG2      VAL   3  77.364  10.043  -1.305
   23   2HG2  VAL   3          2HG2      VAL   3  75.783  10.486  -1.951
   24   3HG2  VAL   3          3HG2      VAL   3  76.202  10.896  -0.287
   25    H    LEU   4           H        LEU   4  76.744  10.132  -4.669
   26    HA   LEU   4           HA       LEU   4  75.409  11.900  -6.593
   27   1HB   LEU   4          2HB       LEU   4  75.297   8.881  -6.300
   28   2HB   LEU   4          1HB       LEU   4  74.950   9.812  -7.752
   29    HG   LEU   4           HG       LEU   4  77.648   9.484  -6.393
   30   1HD1  LEU   4          1HD1      LEU   4  78.186   8.044  -8.079
   31   2HD1  LEU   4          2HD1      LEU   4  77.219   8.908  -9.272
   32   3HD1  LEU   4          3HD1      LEU   4  76.442   7.806  -8.135
   33   1HD2  LEU   4          1HD2      LEU   4  76.721  11.394  -8.534
   34   2HD2  LEU   4          2HD2      LEU   4  78.380  10.798  -8.546
   35   3HD2  LEU   4          3HD2      LEU   4  77.779  11.704  -7.153
   36    H    ALA   5           H        ALA   5  74.533  10.202  -3.676
   37    HA   ALA   5           HA       ALA   5  71.948  11.470  -3.566
   38   1HB   ALA   5          1HB       ALA   5  71.969   9.312  -5.222
   39   2HB   ALA   5          2HB       ALA   5  70.551   9.790  -4.287
   40   3HB   ALA   5          3HB       ALA   5  71.614   8.517  -3.687
   41    H    LYS   6           H        LYS   6  70.962  11.091  -1.474
   42    HA   LYS   6           HA       LYS   6  72.646   9.519   0.455
   43   1HB   LYS   6          2HB       LYS   6  73.118  11.990   0.367
   44   2HB   LYS   6          1HB       LYS   6  71.443  12.282   0.835
   45   1HG   LYS   6          2HG       LYS   6  71.782  11.041   2.919
   46   2HG   LYS   6          1HG       LYS   6  73.441  10.677   2.448
   47   1HD   LYS   6          2HD       LYS   6  73.652  13.285   2.209
   48   2HD   LYS   6          1HD       LYS   6  72.246  13.305   3.274
   49   1HE   LYS   6          2HE       LYS   6  73.822  11.489   4.572
   50   2HE   LYS   6          1HE       LYS   6  75.048  12.572   3.883
   51   1HZ   LYS   6          1HZ       LYS   6  72.628  13.484   5.347
   52   2HZ   LYS   6          2HZ       LYS   6  73.889  14.462   4.764
   53   3HZ   LYS   6          3HZ       LYS   6  74.174  13.371   6.035
   54    H    PHE   7           H        PHE   7  71.372   8.112   1.621
   55    HA   PHE   7           HA       PHE   7  68.611   8.909   2.371
   56   1HB   PHE   7          2HB       PHE   7  67.672   6.893   1.311
   57   2HB   PHE   7          1HB       PHE   7  68.494   7.898   0.122
   58    HD1  PHE   7           HD1      PHE   7  68.233   4.595   1.537
   59    HD2  PHE   7           HD2      PHE   7  71.012   7.324  -0.414
   60    HE1  PHE   7           HE1      PHE   7  69.694   2.650   0.894
   61    HE2  PHE   7           HE2      PHE   7  72.475   5.378  -1.048
   62    HZ   PHE   7           HZ       PHE   7  71.814   3.039  -0.390
   63    H    HIS   8           H        HIS   8  67.647   7.342   3.936
   64    HA   HIS   8           HA       HIS   8  69.787   6.090   5.634
   65   1HB   HIS   8          2HB       HIS   8  67.045   7.244   6.265
   66   2HB   HIS   8          1HB       HIS   8  68.151   6.568   7.460
   67    HD1  HIS   8           HD1      HIS   8  70.310   7.924   8.002
   68    HD2  HIS   8           HD2      HIS   8  67.773   9.809   5.284
   69    HE1  HIS   8           HE1      HIS   8  71.116  10.317   7.811
   70    H    THR   9           H        THR   9  69.554   3.946   6.220
   71    HA   THR   9           HA       THR   9  66.954   2.573   5.942
   72    HB   THR   9           HB       THR   9  68.087   2.524   3.691
   73    HG1  THR   9           HG1      THR   9  67.870   0.245   3.482
   74   1HG2  THR   9          1HG2      THR   9  70.157   0.887   5.181
   75   2HG2  THR   9          2HG2      THR   9  70.423   2.465   4.437
   76   3HG2  THR   9          3HG2      THR   9  70.073   1.061   3.428
   77    H    THR  10           H        THR  10  67.077   0.352   6.959
   78    HA   THR  10           HA       THR  10  69.315   0.206   8.944
   79    HB   THR  10           HB       THR  10  66.904   0.598   9.733
   80    HG1  THR  10           HG1      THR  10  67.639  -0.234  11.478
   81   1HG2  THR  10          1HG2      THR  10  66.321  -2.268   9.682
   82   2HG2  THR  10          2HG2      THR  10  66.290  -1.532   8.076
   83   3HG2  THR  10          3HG2      THR  10  65.251  -0.902   9.355
   84    H    VAL  11           H        VAL  11  70.051  -1.995   9.483
   85    HA   VAL  11           HA       VAL  11  70.443  -3.581   7.067
   86    HB   VAL  11           HB       VAL  11  71.224  -4.050   9.966
   87   1HG1  VAL  11          1HG1      VAL  11  71.967  -5.376   7.367
   88   2HG1  VAL  11          2HG1      VAL  11  71.568  -6.119   8.917
   89   3HG1  VAL  11          3HG1      VAL  11  73.128  -5.327   8.695
   90   1HG2  VAL  11          1HG2      VAL  11  72.504  -2.208   9.597
   91   2HG2  VAL  11          2HG2      VAL  11  72.230  -2.256   7.853
   92   3HG2  VAL  11          3HG2      VAL  11  73.483  -3.263   8.577
   93    H    HIS  12           H        HIS  12  69.388  -5.412   6.483
   94    HA   HIS  12           HA       HIS  12  67.501  -6.680   8.439
   95   1HB   HIS  12          2HB       HIS  12  67.397  -6.139   5.493
   96   2HB   HIS  12          1HB       HIS  12  66.565  -7.566   6.118
   97    HD1  HIS  12           HD1      HIS  12  66.855  -3.904   7.203
   98    HD2  HIS  12           HD2      HIS  12  63.992  -6.910   6.827
   99    HE1  HIS  12           HE1      HIS  12  64.656  -2.894   7.949
  100    H    ARG  13           H        ARG  13  67.202  -9.078   7.868
  101    HA   ARG  13           HA       ARG  13  69.452 -10.575   8.432
  102   1HB   ARG  13          2HB       ARG  13  67.006 -11.209   6.771
  103   2HB   ARG  13          1HB       ARG  13  68.125 -12.457   7.332
  104   1HG   ARG  13          2HG       ARG  13  67.754 -11.666   9.676
  105   2HG   ARG  13          1HG       ARG  13  66.545 -10.533   9.068
  106   1HD   ARG  13          2HD       ARG  13  65.306 -12.502   8.075
  107   2HD   ARG  13          1HD       ARG  13  66.440 -13.564   8.931
  108    HE   ARG  13           HE       ARG  13  65.234 -11.506  10.634
  109   1HH1  ARG  13          1HH1      ARG  13  64.916 -14.772   9.384
  110   2HH1  ARG  13          2HH1      ARG  13  63.902 -15.271  10.690
  111   1HH2  ARG  13          1HH2      ARG  13  63.922 -12.210  12.294
  112   2HH2  ARG  13          2HH2      ARG  13  63.345 -13.843  12.318
  113    H    ILE  14           H        ILE  14  70.939 -11.850   7.218
  114    HA   ILE  14           HA       ILE  14  72.471 -12.314   5.499
  115    HB   ILE  14           HB       ILE  14  70.283 -11.257   3.676
  116   1HG1  ILE  14          2HG1      ILE  14  70.798 -14.138   4.461
  117   2HG1  ILE  14          1HG1      ILE  14  69.605 -13.131   5.287
  118   1HG2  ILE  14          1HG2      ILE  14  72.085 -11.509   2.267
  119   2HG2  ILE  14          2HG2      ILE  14  71.500 -13.173   2.269
  120   3HG2  ILE  14          3HG2      ILE  14  72.857 -12.714   3.298
  121   1HD1  ILE  14          1HD1      ILE  14  68.733 -12.628   2.871
  122   2HD1  ILE  14          2HD1      ILE  14  68.310 -14.164   3.630
  123   3HD1  ILE  14          3HD1      ILE  14  69.609 -14.097   2.439
  124    H    GLY  15           H        GLY  15  71.732  -9.239   6.454
  125   1HA   GLY  15          2HA       GLY  15  73.019  -7.278   6.246
  126   2HA   GLY  15          1HA       GLY  15  74.038  -8.121   5.083
  127    H    ARG  16           H        ARG  16  70.657  -8.268   4.379
  128    HA   ARG  16           HA       ARG  16  71.104  -6.744   1.917
  129   1HB   ARG  16          2HB       ARG  16  69.885  -8.900   2.050
  130   2HB   ARG  16          1HB       ARG  16  68.673  -8.143   3.082
  131   1HG   ARG  16          2HG       ARG  16  68.169  -6.530   1.250
  132   2HG   ARG  16          1HG       ARG  16  69.311  -7.389   0.216
  133   1HD   ARG  16          2HD       ARG  16  66.859  -8.641   1.513
  134   2HD   ARG  16          1HD       ARG  16  66.992  -8.180  -0.195
  135    HE   ARG  16           HE       ARG  16  69.238  -9.779   0.316
  136   1HH1  ARG  16          1HH1      ARG  16  65.755 -10.190   0.486
  137   2HH1  ARG  16          2HH1      ARG  16  65.848 -11.884   0.155
  138   1HH2  ARG  16          1HH2      ARG  16  69.292 -11.967  -0.105
  139   2HH2  ARG  16          2HH2      ARG  16  67.821 -12.879  -0.175
  140    H    ILE  17           H        ILE  17  70.129  -4.779   1.385
  141    HA   ILE  17           HA       ILE  17  68.241  -3.561   3.348
  142    HB   ILE  17           HB       ILE  17  69.425  -1.397   3.078
  143   1HG1  ILE  17          2HG1      ILE  17  71.572  -2.955   1.611
  144   2HG1  ILE  17          1HG1      ILE  17  70.337  -2.015   0.775
  145   1HG2  ILE  17          1HG2      ILE  17  70.139  -3.414   4.701
  146   2HG2  ILE  17          2HG2      ILE  17  71.001  -1.876   4.677
  147   3HG2  ILE  17          3HG2      ILE  17  71.639  -3.258   3.787
  148   1HD1  ILE  17          1HD1      ILE  17  71.693  -0.554   2.951
  149   2HD1  ILE  17          2HD1      ILE  17  71.309  -0.029   1.311
  150   3HD1  ILE  17          3HD1      ILE  17  72.747  -1.004   1.611
  151    H    ILE  18           H        ILE  18  66.734  -2.062   2.318
  152    HA   ILE  18           HA       ILE  18  66.662  -2.285  -0.678
  153    HB   ILE  18           HB       ILE  18  64.370  -1.931   1.283
  154   1HG1  ILE  18          2HG1      ILE  18  65.365  -4.167   1.528
  155   2HG1  ILE  18          1HG1      ILE  18  63.804  -4.288   0.723
  156   1HG2  ILE  18          1HG2      ILE  18  63.595  -1.053  -0.733
  157   2HG2  ILE  18          2HG2      ILE  18  63.143  -2.751  -0.897
  158   3HG2  ILE  18          3HG2      ILE  18  64.588  -2.143  -1.707
  159   1HD1  ILE  18          1HD1      ILE  18  66.531  -4.808  -0.338
  160   2HD1  ILE  18          2HD1      ILE  18  65.405  -4.016  -1.442
  161   3HD1  ILE  18          3HD1      ILE  18  64.999  -5.583  -0.744
  162    H    ILE  19           H        ILE  19  66.856  -0.363  -1.729
  163    HA   ILE  19           HA       ILE  19  66.850   2.182  -0.239
  164    HB   ILE  19           HB       ILE  19  67.091   1.524  -3.210
  165   1HG1  ILE  19          2HG1      ILE  19  69.163   1.963  -1.016
  166   2HG1  ILE  19          1HG1      ILE  19  68.863   0.463  -1.882
  167   1HG2  ILE  19          1HG2      ILE  19  67.870   3.770  -3.494
  168   2HG2  ILE  19          2HG2      ILE  19  68.005   4.027  -1.754
  169   3HG2  ILE  19          3HG2      ILE  19  66.415   3.905  -2.508
  170   1HD1  ILE  19          1HD1      ILE  19  70.359   1.081  -3.441
  171   2HD1  ILE  19          2HD1      ILE  19  70.619   2.605  -2.593
  172   3HD1  ILE  19          3HD1      ILE  19  69.366   2.488  -3.829
  173    HA   PRO  20           HA       PRO  20  62.517   3.053  -1.023
  174   1HB   PRO  20          2HB       PRO  20  62.642   5.790  -1.096
  175   2HB   PRO  20          1HB       PRO  20  62.682   4.871   0.419
  176   1HG   PRO  20          2HG       PRO  20  64.982   5.922  -1.193
  177   2HG   PRO  20          1HG       PRO  20  64.675   6.102   0.546
  178   1HD   PRO  20          2HD       PRO  20  66.372   4.257  -0.281
  179   2HD   PRO  20          1HD       PRO  20  65.187   3.848   0.989
  180    H    ALA  21           H        ALA  21  61.350   3.421  -2.915
  181    HA   ALA  21           HA       ALA  21  62.641   3.323  -5.432
  182   1HB   ALA  21          1HB       ALA  21  60.151   2.929  -4.547
  183   2HB   ALA  21          2HB       ALA  21  60.468   3.281  -6.246
  184   3HB   ALA  21          3HB       ALA  21  59.929   4.566  -5.166
  185    H    GLY  22           H        GLY  22  61.756   6.088  -3.443
  186   1HA   GLY  22          2HA       GLY  22  61.821   8.108  -5.493
  187   2HA   GLY  22          1HA       GLY  22  62.071   8.402  -3.770
  188    H    THR  23           H        THR  23  64.363   6.850  -3.319
  189    HA   THR  23           HA       THR  23  66.433   8.619  -4.300
  190    HB   THR  23           HB       THR  23  66.608   5.899  -2.960
  191    HG1  THR  23           HG1      THR  23  66.755   7.205  -1.071
  192   1HG2  THR  23          1HG2      THR  23  68.841   6.275  -2.655
  193   2HG2  THR  23          2HG2      THR  23  68.626   8.017  -2.485
  194   3HG2  THR  23          3HG2      THR  23  68.654   7.286  -4.089
  195    H    ARG  24           H        ARG  24  65.394   5.327  -5.193
  196    HA   ARG  24           HA       ARG  24  67.467   4.655  -7.059
  197   1HB   ARG  24          2HB       ARG  24  64.527   4.072  -7.499
  198   2HB   ARG  24          1HB       ARG  24  65.905   3.085  -7.965
  199   1HG   ARG  24          2HG       ARG  24  66.332   3.010  -5.355
  200   2HG   ARG  24          1HG       ARG  24  64.617   3.397  -5.287
  201   1HD   ARG  24          2HD       ARG  24  64.468   1.439  -7.098
  202   2HD   ARG  24          1HD       ARG  24  65.949   0.919  -6.260
  203    HE   ARG  24           HE       ARG  24  64.350   1.511  -4.155
  204   1HH1  ARG  24          1HH1      ARG  24  63.697  -0.378  -7.038
  205   2HH1  ARG  24          2HH1      ARG  24  62.512  -1.347  -6.241
  206   1HH2  ARG  24          1HH2      ARG  24  62.832   0.230  -3.182
  207   2HH2  ARG  24          2HH2      ARG  24  62.022  -1.010  -4.081
  208    H    LYS  25           H        LYS  25  64.491   6.533  -7.436
  209    HA   LYS  25           HA       LYS  25  64.618   6.942 -10.266
  210   1HB   LYS  25          2HB       LYS  25  62.635   7.258  -8.799
  211   2HB   LYS  25          1HB       LYS  25  63.419   8.650  -8.054
  212   1HG   LYS  25          2HG       LYS  25  63.496   9.774 -10.251
  213   2HG   LYS  25          1HG       LYS  25  62.682   8.391 -10.980
  214   1HD   LYS  25          2HD       LYS  25  60.774   8.747  -9.397
  215   2HD   LYS  25          1HD       LYS  25  61.573  10.214  -8.828
  216   1HE   LYS  25          2HE       LYS  25  61.260  11.332 -10.875
  217   2HE   LYS  25          1HE       LYS  25  61.034   9.818 -11.773
  218   1HZ   LYS  25          1HZ       LYS  25  59.209  10.929  -9.706
  219   2HZ   LYS  25          2HZ       LYS  25  59.024   9.412 -10.448
  220   3HZ   LYS  25          3HZ       LYS  25  58.896  10.833 -11.370
  221    H    PHE  26           H        PHE  26  65.608   9.067  -7.572
  222    HA   PHE  26           HA       PHE  26  66.640  11.236  -9.093
  223   1HB   PHE  26          2HB       PHE  26  66.209  11.178  -6.642
  224   2HB   PHE  26          1HB       PHE  26  67.595  10.107  -6.440
  225    HD1  PHE  26           HD1      PHE  26  69.788  10.986  -6.162
  226    HD2  PHE  26           HD2      PHE  26  66.620  13.497  -7.790
  227    HE1  PHE  26           HE1      PHE  26  71.321  12.980  -6.078
  228    HE2  PHE  26           HE2      PHE  26  68.153  15.489  -7.703
  229    HZ   PHE  26           HZ       PHE  26  70.504  15.230  -6.847
  230    H    TYR  27           H        TYR  27  68.191   8.217  -8.076
  231    HA   TYR  27           HA       TYR  27  70.818   9.016  -9.141
  232   1HB   TYR  27          2HB       TYR  27  70.405   7.715  -7.050
  233   2HB   TYR  27          1HB       TYR  27  69.771   6.399  -8.022
  234    HD1  TYR  27           HD1      TYR  27  72.726   7.905  -6.600
  235    HD2  TYR  27           HD2      TYR  27  71.355   5.370  -9.863
  236    HE1  TYR  27           HE1      TYR  27  75.053   6.996  -6.883
  237    HE2  TYR  27           HE2      TYR  27  73.679   4.462 -10.138
  238    HH   TYR  27           HH       TYR  27  75.761   4.210  -8.553
  239    H    GLY  28           H        GLY  28  68.001   7.440 -10.440
  240   1HA   GLY  28          2HA       GLY  28  67.646   6.649 -12.626
  241   2HA   GLY  28          1HA       GLY  28  69.323   7.057 -12.995
  242    H    ILE  29           H        ILE  29  68.073   4.860 -10.474
  243    HA   ILE  29           HA       ILE  29  70.024   2.819 -11.310
  244    HB   ILE  29           HB       ILE  29  67.960   2.910  -9.076
  245   1HG1  ILE  29          2HG1      ILE  29  70.943   3.467  -9.037
  246   2HG1  ILE  29          1HG1      ILE  29  69.688   4.701  -9.010
  247   1HG2  ILE  29          1HG2      ILE  29  69.916   1.253  -8.191
  248   2HG2  ILE  29          2HG2      ILE  29  69.996   0.912  -9.919
  249   3HG2  ILE  29          3HG2      ILE  29  68.483   0.677  -9.045
  250   1HD1  ILE  29          1HD1      ILE  29  69.793   4.524  -6.754
  251   2HD1  ILE  29          2HD1      ILE  29  70.674   2.996  -6.835
  252   3HD1  ILE  29          3HD1      ILE  29  68.913   3.008  -6.960
  253    H    GLU  30           H        GLU  30  69.556   1.093 -12.540
  254    HA   GLU  30           HA       GLU  30  66.742   0.082 -12.640
  255   1HB   GLU  30          2HB       GLU  30  68.741   0.294 -14.922
  256   2HB   GLU  30          1HB       GLU  30  67.149  -0.455 -15.036
  257   1HG   GLU  30          2HG       GLU  30  66.109   1.712 -14.392
  258   2HG   GLU  30          1HG       GLU  30  67.709   2.451 -14.366
  259    H    GLN  31           H        GLN  31  66.689  -2.292 -12.994
  260    HA   GLN  31           HA       GLN  31  68.530  -3.753 -11.410
  261   1HB   GLN  31          2HB       GLN  31  66.653  -4.557 -13.650
  262   2HB   GLN  31          1HB       GLN  31  67.477  -5.729 -12.621
  263   1HG   GLN  31          2HG       GLN  31  66.435  -4.776 -10.630
  264   2HG   GLN  31          1HG       GLN  31  65.678  -3.512 -11.599
  265   1HE2  GLN  31          1HE2      GLN  31  63.807  -4.855 -10.277
  266   2HE2  GLN  31          2HE2      GLN  31  63.035  -6.037 -11.219
  267    H    GLY  32           H        GLY  32  70.457  -4.775 -11.844
  268   1HA   GLY  32          2HA       GLY  32  72.092  -5.856 -13.226
  269   2HA   GLY  32          1HA       GLY  32  71.338  -5.134 -14.644
  270    H    ASP  33           H        ASP  33  71.424  -2.471 -12.862
  271    HA   ASP  33           HA       ASP  33  73.934  -1.493 -14.014
  272   1HB   ASP  33          2HB       ASP  33  71.860  -0.355 -12.116
  273   2HB   ASP  33          1HB       ASP  33  73.221   0.577 -12.736
  274    H    PHE  34           H        PHE  34  75.730  -0.641 -12.708
  275    HA   PHE  34           HA       PHE  34  75.969  -1.949 -10.018
  276   1HB   PHE  34          2HB       PHE  34  77.990  -1.103 -12.115
  277   2HB   PHE  34          1HB       PHE  34  78.446  -1.622 -10.492
  278    HD1  PHE  34           HD1      PHE  34  76.945  -2.691 -13.734
  279    HD2  PHE  34           HD2      PHE  34  78.244  -3.960  -9.773
  280    HE1  PHE  34           HE1      PHE  34  76.786  -5.096 -14.452
  281    HE2  PHE  34           HE2      PHE  34  78.083  -6.366 -10.491
  282    HZ   PHE  34           HZ       PHE  34  77.353  -6.934 -12.830
  283    H    VAL  35           H        VAL  35  76.331  -0.596  -8.283
  284    HA   VAL  35           HA       VAL  35  77.021   2.257  -8.848
  285    HB   VAL  35           HB       VAL  35  75.408   2.896  -7.062
  286   1HG1  VAL  35          1HG1      VAL  35  74.748   2.764  -9.495
  287   2HG1  VAL  35          2HG1      VAL  35  73.400   2.564  -8.376
  288   3HG1  VAL  35          3HG1      VAL  35  74.098   1.156  -9.175
  289   1HG2  VAL  35          1HG2      VAL  35  75.357   0.898  -5.710
  290   2HG2  VAL  35          2HG2      VAL  35  74.826  -0.080  -7.078
  291   3HG2  VAL  35          3HG2      VAL  35  73.735   1.118  -6.374
  292    H    GLU  36           H        GLU  36  78.256   3.247  -7.111
  293    HA   GLU  36           HA       GLU  36  79.579   1.246  -5.306
  294   1HB   GLU  36          2HB       GLU  36  80.934   2.273  -7.162
  295   2HB   GLU  36          1HB       GLU  36  80.621   3.860  -6.458
  296   1HG   GLU  36          2HG       GLU  36  81.669   3.084  -4.330
  297   2HG   GLU  36          1HG       GLU  36  82.060   1.554  -5.111
  298    H    ILE  37           H        ILE  37  79.124   1.588  -3.195
  299    HA   ILE  37           HA       ILE  37  78.212   4.313  -2.360
  300    HB   ILE  37           HB       ILE  37  76.374   2.837  -3.081
  301   1HG1  ILE  37          2HG1      ILE  37  76.221   2.873  -0.080
  302   2HG1  ILE  37          1HG1      ILE  37  76.282   4.390  -0.976
  303   1HG2  ILE  37          1HG2      ILE  37  77.407   0.972  -0.924
  304   2HG2  ILE  37          2HG2      ILE  37  77.428   0.669  -2.663
  305   3HG2  ILE  37          3HG2      ILE  37  75.891   0.764  -1.802
  306   1HD1  ILE  37          1HD1      ILE  37  74.389   2.807  -2.345
  307   2HD1  ILE  37          2HD1      ILE  37  74.061   4.194  -1.309
  308   3HD1  ILE  37          3HD1      ILE  37  74.051   2.568  -0.630
  309    H    LYS  38           H        LYS  38  78.263   4.657  -0.029
  310    HA   LYS  38           HA       LYS  38  79.891   2.690   1.531
  311   1HB   LYS  38          2HB       LYS  38  81.169   4.695   0.622
  312   2HB   LYS  38          1HB       LYS  38  80.161   5.704   1.667
  313   1HG   LYS  38          2HG       LYS  38  80.907   4.443   3.635
  314   2HG   LYS  38          1HG       LYS  38  81.884   3.396   2.606
  315   1HD   LYS  38          2HD       LYS  38  83.169   5.404   1.854
  316   2HD   LYS  38          1HD       LYS  38  82.241   6.384   2.989
  317   1HE   LYS  38          2HE       LYS  38  83.102   4.354   4.627
  318   2HE   LYS  38          1HE       LYS  38  84.476   4.529   3.518
  319   1HZ   LYS  38          1HZ       LYS  38  84.310   6.962   3.854
  320   2HZ   LYS  38          2HZ       LYS  38  84.725   6.121   5.271
  321   3HZ   LYS  38          3HZ       LYS  38  83.140   6.694   5.053
  322    H    ILE  39           H        ILE  39  79.301   2.516   3.719
  323    HA   ILE  39           HA       ILE  39  76.850   4.044   4.547
  324    HB   ILE  39           HB       ILE  39  76.411   2.027   5.964
  325   1HG1  ILE  39          2HG1      ILE  39  78.655   0.705   4.422
  326   2HG1  ILE  39          1HG1      ILE  39  78.902   1.399   6.024
  327   1HG2  ILE  39          1HG2      ILE  39  75.178   1.763   4.067
  328   2HG2  ILE  39          2HG2      ILE  39  76.313   0.444   3.775
  329   3HG2  ILE  39          3HG2      ILE  39  76.564   2.010   3.003
  330   1HD1  ILE  39          1HD1      ILE  39  77.349  -1.015   5.223
  331   2HD1  ILE  39          2HD1      ILE  39  76.712  -0.051   6.554
  332   3HD1  ILE  39          3HD1      ILE  39  78.334  -0.735   6.659
  333    H    VAL  40           H        VAL  40  76.770   4.798   6.718
  334    HA   VAL  40           HA       VAL  40  79.233   4.488   8.375
  335    HB   VAL  40           HB       VAL  40  77.808   7.095   7.726
  336   1HG1  VAL  40          1HG1      VAL  40  79.958   7.983   8.905
  337   2HG1  VAL  40          2HG1      VAL  40  80.064   6.361   9.590
  338   3HG1  VAL  40          3HG1      VAL  40  78.648   7.363   9.911
  339   1HG2  VAL  40          1HG2      VAL  40  79.095   6.814   5.834
  340   2HG2  VAL  40          2HG2      VAL  40  80.227   5.727   6.638
  341   3HG2  VAL  40          3HG2      VAL  40  80.344   7.467   6.894
  342    H    LYS  41           H        LYS  41  78.625   3.853  10.375
  343    HA   LYS  41           HA       LYS  41  76.056   4.861  11.527
  344   1HB   LYS  41          2HB       LYS  41  75.785   2.527  10.773
  345   2HB   LYS  41          1HB       LYS  41  77.213   2.056  11.688
  346   1HG   LYS  41          2HG       LYS  41  75.323   1.473  13.046
  347   2HG   LYS  41          1HG       LYS  41  76.030   2.917  13.768
  348   1HD   LYS  41          2HD       LYS  41  74.298   4.095  12.074
  349   2HD   LYS  41          1HD       LYS  41  73.437   2.582  12.350
  350   1HE   LYS  41          2HE       LYS  41  74.554   3.913  14.770
  351   2HE   LYS  41          1HE       LYS  41  73.153   4.688  14.004
  352   1HZ   LYS  41          1HZ       LYS  41  72.354   3.023  15.508
  353   2HZ   LYS  41          2HZ       LYS  41  73.382   1.847  14.843
  354   3HZ   LYS  41          3HZ       LYS  41  72.093   2.468  13.928
  355    H    TYR  42           H        TYR  42  76.219   5.355  13.744
  356    HA   TYR  42           HA       TYR  42  79.013   5.392  14.829
  357   1HB   TYR  42          2HB       TYR  42  77.681   7.514  14.388
  358   2HB   TYR  42          1HB       TYR  42  76.595   7.007  15.682
  359    HD1  TYR  42           HD1      TYR  42  80.181   7.817  14.894
  360    HD2  TYR  42           HD2      TYR  42  77.168   7.321  18.000
  361    HE1  TYR  42           HE1      TYR  42  81.782   8.747  16.593
  362    HE2  TYR  42           HE2      TYR  42  78.769   8.253  19.702
  363    HH   TYR  42           HH       TYR  42  81.559   9.939  18.895
  364    H    GLU  43           H        GLU  43  79.461   4.163  16.619
  365    HA   GLU  43           HA       GLU  43  77.192   3.341  18.389
  366   1HB   GLU  43          2HB       GLU  43  78.216   1.076  18.474
  367   2HB   GLU  43          1HB       GLU  43  77.736   1.511  16.835
  368   1HG   GLU  43          2HG       GLU  43  80.082   2.223  16.372
  369   2HG   GLU  43          1HG       GLU  43  80.539   1.675  17.986
  370    H    GLY  44           H        GLY  44  77.653   3.768  20.503
  371   1HA   GLY  44          2HA       GLY  44  78.846   4.392  22.421
  372   2HA   GLY  44          1HA       GLY  44  80.187   3.445  21.778
  373    H    GLU  45           H        GLU  45  81.968   4.716  21.747
  374    HA   GLU  45           HA       GLU  45  81.685   7.590  20.981
  375   1HB   GLU  45          2HB       GLU  45  83.809   7.871  22.161
  376   2HB   GLU  45          1HB       GLU  45  82.676   6.999  23.187
  377   1HG   GLU  45          2HG       GLU  45  83.745   4.863  22.581
  378   2HG   GLU  45          1HG       GLU  45  84.855   5.713  21.507
  379    H    GLU  46           H        GLU  46  82.089   4.947  19.217
  380    HA   GLU  46           HA       GLU  46  84.283   6.130  17.563
  381   1HB   GLU  46          2HB       GLU  46  85.055   3.826  17.146
  382   2HB   GLU  46          1HB       GLU  46  85.038   4.179  18.871
  383   1HG   GLU  46          2HG       GLU  46  82.719   3.101  18.933
  384   2HG   GLU  46          1HG       GLU  46  83.047   2.530  17.298
  385    HA   PRO  47           HA       PRO  47  81.066   5.593  14.422
  386   1HB   PRO  47          2HB       PRO  47  82.888   6.700  12.458
  387   2HB   PRO  47          1HB       PRO  47  81.441   7.445  13.154
  388   1HG   PRO  47          2HG       PRO  47  84.017   8.281  13.614
  389   2HG   PRO  47          1HG       PRO  47  82.631   8.629  14.657
  390   1HD   PRO  47          2HD       PRO  47  84.812   6.646  15.015
  391   2HD   PRO  47          1HD       PRO  47  83.898   7.565  16.232
  392    H    LYS  48           H        LYS  48  80.790   3.897  12.976
  393    HA   LYS  48           HA       LYS  48  83.221   2.383  12.081
  394   1HB   LYS  48          2HB       LYS  48  80.375   1.448  12.593
  395   2HB   LYS  48          1HB       LYS  48  81.699   0.424  12.037
  396   1HG   LYS  48          2HG       LYS  48  81.741   1.986  14.634
  397   2HG   LYS  48          1HG       LYS  48  81.306   0.279  14.509
  398   1HD   LYS  48          2HD       LYS  48  83.531  -0.137  13.418
  399   2HD   LYS  48          1HD       LYS  48  83.961   1.536  13.771
  400   1HE   LYS  48          2HE       LYS  48  83.110   0.748  16.232
  401   2HE   LYS  48          1HE       LYS  48  83.769  -0.780  15.614
  402   1HZ   LYS  48          1HZ       LYS  48  85.805   0.290  15.050
  403   2HZ   LYS  48          2HZ       LYS  48  85.459   0.696  16.663
  404   3HZ   LYS  48          3HZ       LYS  48  85.183   1.823  15.422
  405    H    GLU  49           H        GLU  49  83.413   2.114   9.855
  406    HA   GLU  49           HA       GLU  49  81.132   3.023   8.133
  407   1HB   GLU  49          2HB       GLU  49  84.075   3.752   7.973
  408   2HB   GLU  49          1HB       GLU  49  82.849   4.250   6.807
  409   1HG   GLU  49          2HG       GLU  49  81.599   5.378   8.640
  410   2HG   GLU  49          1HG       GLU  49  82.883   4.935   9.763
  411    H    GLY  50           H        GLY  50  81.384   2.306   5.850
  412   1HA   GLY  50          2HA       GLY  50  83.321   0.197   5.243
  413   2HA   GLY  50          1HA       GLY  50  81.657  -0.372   5.386
  414    H    THR  51           H        THR  51  83.677   0.157   3.045
  415    HA   THR  51           HA       THR  51  81.655   1.511   1.278
  416    HB   THR  51           HB       THR  51  84.639   1.424   0.793
  417    HG1  THR  51           HG1      THR  51  84.898   2.794   2.337
  418   1HG2  THR  51          1HG2      THR  51  84.212   2.935  -0.870
  419   2HG2  THR  51          2HG2      THR  51  82.920   3.721   0.035
  420   3HG2  THR  51          3HG2      THR  51  82.606   2.207  -0.815
  421    H    PHE  52           H        PHE  52  81.083   0.321  -0.550
  422    HA   PHE  52           HA       PHE  52  82.874  -1.770  -1.575
  423   1HB   PHE  52          2HB       PHE  52  81.451  -3.637  -1.083
  424   2HB   PHE  52          1HB       PHE  52  81.594  -2.726   0.414
  425    HD1  PHE  52           HD1      PHE  52  79.334  -4.198  -1.957
  426    HD2  PHE  52           HD2      PHE  52  79.685  -0.940   0.912
  427    HE1  PHE  52           HE1      PHE  52  76.832  -3.993  -1.888
  428    HE2  PHE  52           HE2      PHE  52  77.177  -0.735   0.983
  429    HZ   PHE  52           HZ       PHE  52  75.752  -2.264  -0.426
  430    H    THR  53           H        THR  53  81.749  -2.927  -3.497
  431    HA   THR  53           HA       THR  53  80.041  -0.969  -4.998
  432    HB   THR  53           HB       THR  53  81.798  -3.250  -5.969
  433    HG1  THR  53           HG1      THR  53  83.154  -1.522  -6.626
  434   1HG2  THR  53          1HG2      THR  53  80.162  -1.128  -7.359
  435   2HG2  THR  53          2HG2      THR  53  80.127  -2.875  -7.609
  436   3HG2  THR  53          3HG2      THR  53  81.513  -1.931  -8.161
  437    H    ALA  54           H        ALA  54  78.042  -1.704  -5.744
  438    HA   ALA  54           HA       ALA  54  77.313  -4.563  -5.271
  439   1HB   ALA  54          1HB       ALA  54  75.842  -3.983  -3.624
  440   2HB   ALA  54          2HB       ALA  54  75.304  -2.548  -4.496
  441   3HB   ALA  54          3HB       ALA  54  76.776  -2.490  -3.531
  442    H    ARG  55           H        ARG  55  75.713  -5.346  -6.670
  443    HA   ARG  55           HA       ARG  55  74.950  -3.588  -8.950
  444   1HB   ARG  55          2HB       ARG  55  75.942  -5.974  -9.106
  445   2HB   ARG  55          1HB       ARG  55  74.350  -6.527  -8.579
  446   1HG   ARG  55          2HG       ARG  55  73.323  -5.276 -10.473
  447   2HG   ARG  55          1HG       ARG  55  74.939  -4.835 -11.027
  448   1HD   ARG  55          2HD       ARG  55  74.397  -6.762 -12.313
  449   2HD   ARG  55          1HD       ARG  55  75.404  -7.403 -11.000
  450    HE   ARG  55           HE       ARG  55  72.541  -7.281 -10.370
  451   1HH1  ARG  55          1HH1      ARG  55  75.133  -9.250 -11.685
  452   2HH1  ARG  55          2HH1      ARG  55  74.303 -10.727 -11.351
  453   1HH2  ARG  55          1HH2      ARG  55  71.518  -9.221  -9.968
  454   2HH2  ARG  55          2HH2      ARG  55  72.283 -10.715 -10.394
  455    H    VAL  56           H        VAL  56  72.778  -3.123  -9.380
  456    HA   VAL  56           HA       VAL  56  70.932  -3.202  -7.115
  457    HB   VAL  56           HB       VAL  56  70.716  -2.274  -9.999
  458   1HG1  VAL  56          1HG1      VAL  56  68.596  -2.727  -8.231
  459   2HG1  VAL  56          2HG1      VAL  56  68.563  -1.688  -9.655
  460   3HG1  VAL  56          3HG1      VAL  56  68.919  -1.002  -8.069
  461   1HG2  VAL  56          1HG2      VAL  56  72.323  -1.262  -8.105
  462   2HG2  VAL  56          2HG2      VAL  56  70.832  -0.438  -7.651
  463   3HG2  VAL  56          3HG2      VAL  56  71.496  -0.230  -9.272
  464    H    GLY  57           H        GLY  57  69.514  -4.798  -6.719
  465   1HA   GLY  57          2HA       GLY  57  68.926  -6.787  -8.862
  466   2HA   GLY  57          1HA       GLY  57  68.767  -7.094  -7.134
  467    H    GLU  58           H        GLU  58  66.601  -7.843  -7.876
  468    HA   GLU  58           HA       GLU  58  64.593  -6.119  -8.946
  469   1HB   GLU  58          2HB       GLU  58  64.547  -8.622  -8.738
  470   2HB   GLU  58          1HB       GLU  58  64.295  -8.435  -7.003
  471   1HG   GLU  58          2HG       GLU  58  62.227  -7.145  -7.458
  472   2HG   GLU  58          1HG       GLU  58  62.466  -7.388  -9.185
  473    H    GLN  59           H        GLN  59  62.918  -4.947  -7.876
  474    HA   GLN  59           HA       GLN  59  62.076  -3.440  -6.276
  475   1HB   GLN  59          2HB       GLN  59  63.039  -5.796  -4.645
  476   2HB   GLN  59          1HB       GLN  59  62.163  -4.448  -3.917
  477   1HG   GLN  59          2HG       GLN  59  60.241  -4.837  -5.295
  478   2HG   GLN  59          1HG       GLN  59  61.118  -5.980  -6.307
  479   1HE2  GLN  59          1HE2      GLN  59  59.380  -7.574  -5.718
  480   2HE2  GLN  59          2HE2      GLN  59  59.470  -8.379  -4.226
  481    H    GLY  60           H        GLY  60  65.146  -3.372  -6.968
  482   1HA   GLY  60          2HA       GLY  60  66.752  -1.740  -6.456
  483   2HA   GLY  60          1HA       GLY  60  65.589  -1.061  -5.321
  484    H    SER  61           H        SER  61  66.452  -4.396  -4.875
  485    HA   SER  61           HA       SER  61  67.482  -3.804  -2.215
  486   1HB   SER  61          2HB       SER  61  66.074  -5.785  -2.938
  487   2HB   SER  61          1HB       SER  61  67.496  -6.408  -3.768
  488    HG   SER  61           HG       SER  61  68.218  -7.061  -1.915
  489    H    VAL  62           H        VAL  62  69.605  -4.007  -1.502
  490    HA   VAL  62           HA       VAL  62  71.715  -4.804  -3.449
  491    HB   VAL  62           HB       VAL  62  71.488  -2.347  -3.506
  492   1HG1  VAL  62          1HG1      VAL  62  71.890  -1.009  -1.487
  493   2HG1  VAL  62          2HG1      VAL  62  72.064  -2.481  -0.531
  494   3HG1  VAL  62          3HG1      VAL  62  70.505  -2.074  -1.246
  495   1HG2  VAL  62          1HG2      VAL  62  73.945  -2.843  -1.852
  496   2HG2  VAL  62          2HG2      VAL  62  73.766  -1.879  -3.317
  497   3HG2  VAL  62          3HG2      VAL  62  73.780  -3.640  -3.416
  498    H    ILE  63           H        ILE  63  73.503  -5.824  -2.423
  499    HA   ILE  63           HA       ILE  63  73.004  -6.567   0.434
  500    HB   ILE  63           HB       ILE  63  74.606  -7.945  -1.751
  501   1HG1  ILE  63          2HG1      ILE  63  72.220  -7.853  -2.356
  502   2HG1  ILE  63          1HG1      ILE  63  72.673  -9.496  -1.911
  503   1HG2  ILE  63          1HG2      ILE  63  73.980  -9.908  -0.051
  504   2HG2  ILE  63          2HG2      ILE  63  73.959  -8.567   1.094
  505   3HG2  ILE  63          3HG2      ILE  63  75.420  -8.913   0.171
  506   1HD1  ILE  63          1HD1      ILE  63  71.733  -9.168   0.337
  507   2HD1  ILE  63          2HD1      ILE  63  70.512  -8.838  -0.893
  508   3HD1  ILE  63          3HD1      ILE  63  71.315  -7.503  -0.070
  509    H    ILE  64           H        ILE  64  74.410  -5.754   1.916
  510    HA   ILE  64           HA       ILE  64  77.033  -4.617   1.171
  511    HB   ILE  64           HB       ILE  64  75.674  -5.165   3.837
  512   1HG1  ILE  64          2HG1      ILE  64  75.964  -2.527   2.378
  513   2HG1  ILE  64          1HG1      ILE  64  74.541  -3.557   2.201
  514   1HG2  ILE  64          1HG2      ILE  64  78.017  -3.353   3.178
  515   2HG2  ILE  64          2HG2      ILE  64  78.156  -4.923   3.971
  516   3HG2  ILE  64          3HG2      ILE  64  77.303  -3.603   4.771
  517   1HD1  ILE  64          1HD1      ILE  64  73.919  -2.106   3.943
  518   2HD1  ILE  64          2HD1      ILE  64  75.533  -2.119   4.655
  519   3HD1  ILE  64          3HD1      ILE  64  74.491  -3.533   4.807
  520    HA   PRO  65           HA       PRO  65  79.157  -8.510   1.535
  521   1HB   PRO  65          2HB       PRO  65  81.652  -7.642   2.246
  522   2HB   PRO  65          1HB       PRO  65  81.007  -7.459   0.599
  523   1HG   PRO  65          2HG       PRO  65  80.988  -5.477   2.848
  524   2HG   PRO  65          1HG       PRO  65  81.540  -5.251   1.176
  525   1HD   PRO  65          2HD       PRO  65  79.133  -4.416   1.881
  526   2HD   PRO  65          1HD       PRO  65  79.350  -5.265   0.328
  527    H    LYS  66           H        LYS  66  79.240  -9.964   3.210
  528    HA   LYS  66           HA       LYS  66  78.518  -9.369   5.879
  529   1HB   LYS  66          2HB       LYS  66  78.452 -11.585   4.714
  530   2HB   LYS  66          1HB       LYS  66  80.208 -11.675   4.858
  531   1HG   LYS  66          2HG       LYS  66  79.998 -11.508   7.325
  532   2HG   LYS  66          1HG       LYS  66  78.242 -11.485   7.159
  533   1HD   LYS  66          2HD       LYS  66  78.385 -13.699   5.984
  534   2HD   LYS  66          1HD       LYS  66  80.110 -13.731   6.349
  535   1HE   LYS  66          2HE       LYS  66  79.714 -13.834   8.705
  536   2HE   LYS  66          1HE       LYS  66  78.003 -13.405   8.506
  537   1HZ   LYS  66          1HZ       LYS  66  77.759 -15.427   7.126
  538   2HZ   LYS  66          2HZ       LYS  66  78.161 -15.771   8.740
  539   3HZ   LYS  66          3HZ       LYS  66  79.346 -15.868   7.528
  540    H    ALA  67           H        ALA  67  81.716  -9.539   4.388
  541    HA   ALA  67           HA       ALA  67  83.354  -9.591   6.713
  542   1HB   ALA  67          1HB       ALA  67  83.632  -8.508   3.911
  543   2HB   ALA  67          2HB       ALA  67  84.383  -9.940   4.617
  544   3HB   ALA  67          3HB       ALA  67  84.950  -8.333   5.071
  545    H    LEU  68           H        LEU  68  81.828  -6.863   5.030
  546    HA   LEU  68           HA       LEU  68  83.043  -4.834   6.748
  547   1HB   LEU  68          2HB       LEU  68  80.781  -4.848   4.732
  548   2HB   LEU  68          1HB       LEU  68  81.327  -3.388   5.554
  549    HG   LEU  68           HG       LEU  68  83.055  -5.181   3.814
  550   1HD1  LEU  68          1HD1      LEU  68  81.205  -3.486   2.882
  551   2HD1  LEU  68          2HD1      LEU  68  82.774  -3.663   2.098
  552   3HD1  LEU  68          3HD1      LEU  68  82.485  -2.315   3.198
  553   1HD2  LEU  68          1HD2      LEU  68  84.649  -3.187   4.053
  554   2HD2  LEU  68          2HD2      LEU  68  84.465  -4.198   5.486
  555   3HD2  LEU  68          3HD2      LEU  68  83.623  -2.652   5.384
  556    H    ARG  69           H        ARG  69  79.994  -6.663   6.720
  557    HA   ARG  69           HA       ARG  69  78.490  -5.142   8.612
  558   1HB   ARG  69          2HB       ARG  69  78.690  -8.165   8.333
  559   2HB   ARG  69          1HB       ARG  69  77.344  -7.282   9.037
  560   1HG   ARG  69          2HG       ARG  69  77.015  -6.173   6.784
  561   2HG   ARG  69          1HG       ARG  69  78.206  -7.307   6.136
  562   1HD   ARG  69          2HD       ARG  69  76.675  -9.090   7.407
  563   2HD   ARG  69          1HD       ARG  69  75.438  -7.850   7.138
  564    HE   ARG  69           HE       ARG  69  76.604  -7.983   4.678
  565   1HH1  ARG  69          1HH1      ARG  69  75.430 -10.507   6.822
  566   2HH1  ARG  69          2HH1      ARG  69  75.109 -11.590   5.516
  567   1HH2  ARG  69          1HH2      ARG  69  76.154  -9.426   3.041
  568   2HH2  ARG  69          2HH2      ARG  69  75.509 -10.990   3.405
  569    H    ASP  70           H        ASP  70  80.797  -7.808   9.101
  570    HA   ASP  70           HA       ASP  70  80.537  -7.911  11.963
  571   1HB   ASP  70          2HB       ASP  70  82.723  -8.824  10.064
  572   2HB   ASP  70          1HB       ASP  70  82.594  -9.327  11.749
  573    H    VAL  71           H        VAL  71  83.051  -6.462   9.862
  574    HA   VAL  71           HA       VAL  71  84.751  -5.487  11.938
  575    HB   VAL  71           HB       VAL  71  84.149  -4.463   9.138
  576   1HG1  VAL  71          1HG1      VAL  71  86.385  -3.415   9.244
  577   2HG1  VAL  71          2HG1      VAL  71  86.537  -3.918  10.928
  578   3HG1  VAL  71          3HG1      VAL  71  85.304  -2.744  10.467
  579   1HG2  VAL  71          1HG2      VAL  71  86.564  -6.052   9.940
  580   2HG2  VAL  71          2HG2      VAL  71  85.762  -5.956   8.372
  581   3HG2  VAL  71          3HG2      VAL  71  85.034  -6.890   9.679
  582    H    ILE  72           H        ILE  72  81.925  -4.027  10.376
  583    HA   ILE  72           HA       ILE  72  82.219  -1.480  11.772
  584    HB   ILE  72           HB       ILE  72  79.980  -2.674  10.093
  585   1HG1  ILE  72          2HG1      ILE  72  82.208  -0.759   9.319
  586   2HG1  ILE  72          1HG1      ILE  72  82.225  -2.488   8.974
  587   1HG2  ILE  72          1HG2      ILE  72  80.521   0.266  10.448
  588   2HG2  ILE  72          2HG2      ILE  72  79.558  -0.589  11.649
  589   3HG2  ILE  72          3HG2      ILE  72  79.027  -0.536   9.971
  590   1HD1  ILE  72          1HD1      ILE  72  80.453  -0.348   7.835
  591   2HD1  ILE  72          2HD1      ILE  72  79.874  -2.017   7.902
  592   3HD1  ILE  72          3HD1      ILE  72  81.338  -1.624   6.996
  593    H    GLY  73           H        GLY  73  80.676  -4.523  12.520
  594   1HA   GLY  73          2HA       GLY  73  79.639  -5.156  14.534
  595   2HA   GLY  73          1HA       GLY  73  79.900  -3.515  15.125
  596    H    ILE  74           H        ILE  74  78.167  -4.345  12.157
  597    HA   ILE  74           HA       ILE  74  75.883  -2.729  13.104
  598    HB   ILE  74           HB       ILE  74  76.460  -4.077  10.445
  599   1HG1  ILE  74          2HG1      ILE  74  78.234  -2.473  11.041
  600   2HG1  ILE  74          1HG1      ILE  74  77.249  -1.835   9.729
  601   1HG2  ILE  74          1HG2      ILE  74  74.918  -2.134   9.686
  602   2HG2  ILE  74          2HG2      ILE  74  74.420  -2.066  11.376
  603   3HG2  ILE  74          3HG2      ILE  74  74.170  -3.540  10.442
  604   1HD1  ILE  74          1HD1      ILE  74  75.936  -0.916  11.994
  605   2HD1  ILE  74          2HD1      ILE  74  77.045   0.029  11.002
  606   3HD1  ILE  74          3HD1      ILE  74  77.637  -0.795  12.444
  607    H    LYS  75           H        LYS  75  73.849  -3.532  13.539
  608    HA   LYS  75           HA       LYS  75  73.461  -6.501  13.356
  609   1HB   LYS  75          2HB       LYS  75  72.455  -4.535  15.446
  610   2HB   LYS  75          1HB       LYS  75  72.270  -6.285  15.496
  611   1HG   LYS  75          2HG       LYS  75  74.913  -4.789  15.557
  612   2HG   LYS  75          1HG       LYS  75  74.133  -5.550  16.943
  613   1HD   LYS  75          2HD       LYS  75  74.197  -7.727  15.594
  614   2HD   LYS  75          1HD       LYS  75  75.293  -6.887  14.497
  615   1HE   LYS  75          2HE       LYS  75  77.030  -6.934  15.992
  616   2HE   LYS  75          1HE       LYS  75  75.963  -6.671  17.386
  617   1HZ   LYS  75          1HZ       LYS  75  76.067  -9.185  15.806
  618   2HZ   LYS  75          2HZ       LYS  75  75.175  -8.912  17.226
  619   3HZ   LYS  75          3HZ       LYS  75  76.873  -8.957  17.282
  620    HA   PRO  76           HA       PRO  76  69.665  -5.835  11.193
  621   1HB   PRO  76          2HB       PRO  76  67.894  -7.447  12.628
  622   2HB   PRO  76          1HB       PRO  76  68.962  -8.008  11.329
  623   1HG   PRO  76          2HG       PRO  76  69.288  -8.214  14.267
  624   2HG   PRO  76          1HG       PRO  76  69.788  -9.333  12.991
  625   1HD   PRO  76          2HD       PRO  76  71.530  -7.724  14.288
  626   2HD   PRO  76          1HD       PRO  76  71.752  -8.213  12.593
  627    H    GLY  77           H        GLY  77  68.124  -4.237  11.319
  628   1HA   GLY  77          2HA       GLY  77  66.338  -3.003  12.309
  629   2HA   GLY  77          1HA       GLY  77  66.782  -3.664  13.879
  630    H    GLU  78           H        GLU  78  69.649  -2.589  12.544
  631    HA   GLU  78           HA       GLU  78  69.493  -0.047  14.083
  632   1HB   GLU  78          2HB       GLU  78  71.588  -1.991  13.241
  633   2HB   GLU  78          1HB       GLU  78  72.087  -0.306  13.401
  634   1HG   GLU  78          2HG       GLU  78  71.040  -0.276  15.684
  635   2HG   GLU  78          1HG       GLU  78  70.744  -2.006  15.522
  636    H    VAL  79           H        VAL  79  69.517   1.898  13.069
  637    HA   VAL  79           HA       VAL  79  69.339   1.898  10.131
  638    HB   VAL  79           HB       VAL  79  67.684   3.006  11.590
  639   1HG1  VAL  79          1HG1      VAL  79  69.312   5.322  12.310
  640   2HG1  VAL  79          2HG1      VAL  79  69.933   3.844  13.040
  641   3HG1  VAL  79          3HG1      VAL  79  68.263   4.331  13.323
  642   1HG2  VAL  79          1HG2      VAL  79  67.884   5.341  10.511
  643   2HG2  VAL  79          2HG2      VAL  79  67.813   3.957   9.421
  644   3HG2  VAL  79          3HG2      VAL  79  69.360   4.732   9.762
  645    H    ILE  80           H        ILE  80  70.879   2.644   8.788
  646    HA   ILE  80           HA       ILE  80  73.188   4.191   9.902
  647    HB   ILE  80           HB       ILE  80  74.523   3.050   8.136
  648   1HG1  ILE  80          2HG1      ILE  80  71.984   1.479   7.596
  649   2HG1  ILE  80          1HG1      ILE  80  72.612   2.756   6.553
  650   1HG2  ILE  80          1HG2      ILE  80  73.875   2.034  10.499
  651   2HG2  ILE  80          2HG2      ILE  80  74.791   1.085   9.330
  652   3HG2  ILE  80          3HG2      ILE  80  73.055   0.831   9.507
  653   1HD1  ILE  80          1HD1      ILE  80  74.483   1.502   5.921
  654   2HD1  ILE  80          2HD1      ILE  80  73.233   0.263   6.030
  655   3HD1  ILE  80          3HD1      ILE  80  74.391   0.465   7.345
  656    H    GLU  81           H        GLU  81  74.088   5.740   8.362
  657    HA   GLU  81           HA       GLU  81  72.101   6.848   6.432
  658   1HB   GLU  81          2HB       GLU  81  73.082   8.289   8.225
  659   2HB   GLU  81          1HB       GLU  81  74.687   7.968   7.572
  660   1HG   GLU  81          2HG       GLU  81  73.978   8.949   5.403
  661   2HG   GLU  81          1HG       GLU  81  72.407   9.329   6.108
  662    H    VAL  82           H        VAL  82  72.488   6.548   4.295
  663    HA   VAL  82           HA       VAL  82  75.044   5.216   3.524
  664    HB   VAL  82           HB       VAL  82  72.219   5.110   2.406
  665   1HG1  VAL  82          1HG1      VAL  82  74.765   3.660   1.645
  666   2HG1  VAL  82          2HG1      VAL  82  73.733   4.646   0.608
  667   3HG1  VAL  82          3HG1      VAL  82  73.162   3.081   1.192
  668   1HG2  VAL  82          1HG2      VAL  82  72.556   2.668   3.286
  669   2HG2  VAL  82          2HG2      VAL  82  72.156   3.940   4.441
  670   3HG2  VAL  82          3HG2      VAL  82  73.823   3.385   4.281
  671    H    LEU  83           H        LEU  83  76.311   6.190   2.041
  672    HA   LEU  83           HA       LEU  83  75.221   8.510   0.469
  673   1HB   LEU  83          2HB       LEU  83  78.113   7.923   1.218
  674   2HB   LEU  83          1HB       LEU  83  77.455   9.441   0.623
  675    HG   LEU  83           HG       LEU  83  76.809   8.173   3.304
  676   1HD1  LEU  83          1HD1      LEU  83  78.155   9.937   4.261
  677   2HD1  LEU  83          2HD1      LEU  83  78.386  10.684   2.679
  678   3HD1  LEU  83          3HD1      LEU  83  79.126   9.121   3.034
  679   1HD2  LEU  83          1HD2      LEU  83  75.948  10.692   3.536
  680   2HD2  LEU  83          2HD2      LEU  83  74.917   9.417   2.885
  681   3HD2  LEU  83          3HD2      LEU  83  75.750  10.521   1.790
  682    H    LEU  84           H        LEU  84  75.274   8.188  -1.762
  683    HA   LEU  84           HA       LEU  84  76.661   5.850  -2.925
  684   1HB   LEU  84          2HB       LEU  84  74.828   8.040  -3.846
  685   2HB   LEU  84          1HB       LEU  84  75.777   7.162  -5.048
  686    HG   LEU  84           HG       LEU  84  74.324   5.576  -2.972
  687   1HD1  LEU  84          1HD1      LEU  84  72.630   5.824  -5.271
  688   2HD1  LEU  84          2HD1      LEU  84  72.980   7.446  -4.682
  689   3HD1  LEU  84          3HD1      LEU  84  72.271   6.252  -3.600
  690   1HD2  LEU  84          1HD2      LEU  84  74.015   4.286  -5.308
  691   2HD2  LEU  84          2HD2      LEU  84  75.495   4.153  -4.358
  692   3HD2  LEU  84          3HD2      LEU  84  75.424   5.261  -5.729
  693    H    LEU  85           H        LEU  85  78.572   5.988  -4.127
  694    HA   LEU  85           HA       LEU  85  80.020   8.602  -3.946
  695   1HB   LEU  85          2HB       LEU  85  80.761   5.712  -3.546
  696   2HB   LEU  85          1HB       LEU  85  82.012   6.904  -3.913
  697    HG   LEU  85           HG       LEU  85  80.012   7.172  -1.650
  698   1HD1  LEU  85          1HD1      LEU  85  81.631   5.271  -1.365
  699   2HD1  LEU  85          2HD1      LEU  85  81.826   6.546  -0.163
  700   3HD1  LEU  85          3HD1      LEU  85  82.949   6.433  -1.516
  701   1HD2  LEU  85          1HD2      LEU  85  82.081   8.786  -1.023
  702   2HD2  LEU  85          2HD2      LEU  85  80.707   9.341  -1.978
  703   3HD2  LEU  85          3HD2      LEU  85  82.198   8.851  -2.782
  704    H    GLY  86           H        GLY  86  79.169   5.912  -6.064
  705   1HA   GLY  86          2HA       GLY  86  80.035   7.415  -8.428
  706   2HA   GLY  86          1HA       GLY  86  81.096   6.065  -8.066
  707    H    HIS  87           H        HIS  87  80.056   5.728 -10.410
  708    HA   HIS  87           HA       HIS  87  77.927   3.670 -10.070
  709   1HB   HIS  87          2HB       HIS  87  76.642   4.734 -11.919
  710   2HB   HIS  87          1HB       HIS  87  76.808   5.815 -10.541
  711    HD1  HIS  87           HD1      HIS  87  78.044   5.299 -14.058
  712    HD2  HIS  87           HD2      HIS  87  78.392   8.121 -11.009
  713    HE1  HIS  87           HE1      HIS  87  79.141   7.335 -15.089
  714    H    TYR  88           H        TYR  88  77.897   2.116 -11.825
  715    HA   TYR  88           HA       TYR  88  79.981   2.421 -13.937
  716   1HB   TYR  88          2HB       TYR  88  79.604   0.090 -12.030
  717   2HB   TYR  88          1HB       TYR  88  80.630   0.027 -13.463
  718    HD1  TYR  88           HD1      TYR  88  80.328   1.184  -9.997
  719    HD2  TYR  88           HD2      TYR  88  82.605   1.624 -13.685
  720    HE1  TYR  88           HE1      TYR  88  82.197   2.275  -8.714
  721    HE2  TYR  88           HE2      TYR  88  84.472   2.716 -12.403
  722    HH   TYR  88           HH       TYR  88  84.768   3.953 -10.249
  723    H    LYS  89           H        LYS  89  79.369   1.455 -15.901
  724    HA   LYS  89           HA       LYS  89  76.637   0.214 -15.974
  725   1HB   LYS  89          2HB       LYS  89  78.207   2.008 -17.827
  726   2HB   LYS  89          1HB       LYS  89  76.831   1.076 -18.418
  727   1HG   LYS  89          2HG       LYS  89  75.341   2.143 -16.851
  728   2HG   LYS  89          1HG       LYS  89  76.688   2.924 -16.022
  729   1HD   LYS  89          2HD       LYS  89  77.030   4.462 -17.732
  730   2HD   LYS  89          1HD       LYS  89  76.312   3.413 -18.957
  731   1HE   LYS  89          2HE       LYS  89  74.572   4.425 -16.721
  732   2HE   LYS  89          1HE       LYS  89  74.944   5.495 -18.087
  733   1HZ   LYS  89          1HZ       LYS  89  73.910   2.718 -18.321
  734   2HZ   LYS  89          2HZ       LYS  89  74.242   3.773 -19.610
  735   3HZ   LYS  89          3HZ       LYS  89  72.980   4.122 -18.528
  736    HA   PRO  90           HA       PRO  90  78.320  -3.592 -17.502
  737   1HB   PRO  90          2HB       PRO  90  76.270  -3.357 -19.684
  738   2HB   PRO  90          1HB       PRO  90  76.603  -4.724 -18.594
  739   1HG   PRO  90          2HG       PRO  90  74.501  -3.249 -18.136
  740   2HG   PRO  90          1HG       PRO  90  75.560  -3.680 -16.777
  741   1HD   PRO  90          2HD       PRO  90  75.410  -1.094 -18.294
  742   2HD   PRO  90          1HD       PRO  90  75.503  -1.364 -16.535
  743    H    ARG  91           H        ARG  91  79.917  -4.168 -18.997
  744    HA   ARG  91           HA       ARG  91  80.194  -2.524 -21.480
  745   1HB   ARG  91          2HB       ARG  91  82.614  -2.323 -20.958
  746   2HB   ARG  91          1HB       ARG  91  81.620  -1.600 -19.694
  747   1HG   ARG  91          2HG       ARG  91  81.799  -3.791 -18.435
  748   2HG   ARG  91          1HG       ARG  91  82.989  -4.303 -19.632
  749   1HD   ARG  91          2HD       ARG  91  84.364  -2.284 -19.072
  750   2HD   ARG  91          1HD       ARG  91  83.207  -1.901 -17.782
  751    HE   ARG  91           HE       ARG  91  85.142  -4.097 -17.752
  752   1HH1  ARG  91          1HH1      ARG  91  82.078  -2.935 -16.495
  753   2HH1  ARG  91          2HH1      ARG  91  82.169  -3.938 -15.090
  754   1HH2  ARG  91          1HH2      ARG  91  85.203  -5.369 -15.919
  755   2HH2  ARG  91          2HH2      ARG  91  83.913  -5.299 -14.766
  756    H    ASN  92           H        ASN  92  81.486  -3.610 -23.149
  757    HA   ASN  92           HA       ASN  92  82.015  -5.497 -24.469
  758   1HB   ASN  92          2HB       ASN  92  82.846  -6.408 -21.694
  759   2HB   ASN  92          1HB       ASN  92  83.336  -7.203 -23.191
  760   1HD2  ASN  92          1HD2      ASN  92  85.216  -5.956 -21.357
  761   2HD2  ASN  92          2HD2      ASN  92  85.936  -4.653 -22.171
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1  83.611  14.506   0.211
    2   2H    MET   1          2H        MET   1  84.865  13.363   0.281
    3   3H    MET   1          3H        MET   1  83.245  12.852   0.303
    4    HA   MET   1           HA       MET   1  84.659  14.135  -1.980
    5   1HB   MET   1          2HB       MET   1  83.717  11.358  -1.251
    6   2HB   MET   1          1HB       MET   1  84.061  11.810  -2.921
    7   1HG   MET   1          2HG       MET   1  86.340  12.538  -2.209
    8   2HG   MET   1          1HG       MET   1  85.990  11.935  -0.588
    9   1HE   MET   1          1HE       MET   1  87.059  10.104  -4.415
   10   2HE   MET   1          2HE       MET   1  85.986  11.472  -4.136
   11   3HE   MET   1          3HE       MET   1  85.308   9.859  -4.346
   12    H    ASP   2           H        ASP   2  83.127  13.352  -3.974
   13    HA   ASP   2           HA       ASP   2  80.632  14.852  -3.696
   14   1HB   ASP   2          2HB       ASP   2  81.813  13.125  -5.898
   15   2HB   ASP   2          1HB       ASP   2  80.399  14.160  -6.094
   16    H    VAL   3           H        VAL   3  78.501  13.956  -3.805
   17    HA   VAL   3           HA       VAL   3  78.317  10.999  -3.480
   18    HB   VAL   3           HB       VAL   3  78.150  12.537  -1.393
   19   1HG1  VAL   3          1HG1      VAL   3  76.034  13.571  -0.912
   20   2HG1  VAL   3          2HG1      VAL   3  75.316  12.913  -2.386
   21   3HG1  VAL   3          3HG1      VAL   3  76.554  14.170  -2.490
   22   1HG2  VAL   3          1HG2      VAL   3  77.538  10.172  -1.369
   23   2HG2  VAL   3          2HG2      VAL   3  75.953  10.555  -2.041
   24   3HG2  VAL   3          3HG2      VAL   3  76.377  11.098  -0.417
   25    H    LEU   4           H        LEU   4  76.713  10.048  -4.713
   26    HA   LEU   4           HA       LEU   4  75.348  11.740  -6.697
   27   1HB   LEU   4          2HB       LEU   4  75.262   8.739  -6.252
   28   2HB   LEU   4          1HB       LEU   4  74.827   9.591  -7.730
   29    HG   LEU   4           HG       LEU   4  77.597   9.380  -6.497
   30   1HD1  LEU   4          1HD1      LEU   4  78.028   8.388  -8.836
   31   2HD1  LEU   4          2HD1      LEU   4  76.275   8.257  -8.964
   32   3HD1  LEU   4          3HD1      LEU   4  77.134   7.392  -7.688
   33   1HD2  LEU   4          1HD2      LEU   4  77.644  11.547  -7.401
   34   2HD2  LEU   4          2HD2      LEU   4  76.515  11.134  -8.696
   35   3HD2  LEU   4          3HD2      LEU   4  78.183  10.568  -8.769
   36    H    ALA   5           H        ALA   5  74.555  10.201  -3.670
   37    HA   ALA   5           HA       ALA   5  71.987  11.494  -3.542
   38   1HB   ALA   5          1HB       ALA   5  71.666   8.522  -3.580
   39   2HB   ALA   5          2HB       ALA   5  71.876   9.327  -5.134
   40   3HB   ALA   5          3HB       ALA   5  70.531   9.774  -4.084
   41    H    LYS   6           H        LYS   6  71.002  11.140  -1.425
   42    HA   LYS   6           HA       LYS   6  72.708   9.622   0.524
   43   1HB   LYS   6          2HB       LYS   6  73.207  12.071   0.435
   44   2HB   LYS   6          1HB       LYS   6  71.520  12.402   0.829
   45   1HG   LYS   6          2HG       LYS   6  71.752  11.232   2.959
   46   2HG   LYS   6          1HG       LYS   6  73.409  10.788   2.563
   47   1HD   LYS   6          2HD       LYS   6  73.609  13.441   2.211
   48   2HD   LYS   6          1HD       LYS   6  72.304  13.425   3.397
   49   1HE   LYS   6          2HE       LYS   6  74.023  11.612   4.515
   50   2HE   LYS   6          1HE       LYS   6  75.160  12.738   3.747
   51   1HZ   LYS   6          1HZ       LYS   6  72.886  13.494   5.508
   52   2HZ   LYS   6          2HZ       LYS   6  73.940  14.583   4.740
   53   3HZ   LYS   6          3HZ       LYS   6  74.526  13.535   5.941
   54    H    PHE   7           H        PHE   7  71.423   8.199   1.657
   55    HA   PHE   7           HA       PHE   7  68.664   9.006   2.417
   56   1HB   PHE   7          2HB       PHE   7  67.724   7.001   1.336
   57   2HB   PHE   7          1HB       PHE   7  68.553   8.014   0.158
   58    HD1  PHE   7           HD1      PHE   7  68.268   4.699   1.532
   59    HD2  PHE   7           HD2      PHE   7  71.081   7.435  -0.361
   60    HE1  PHE   7           HE1      PHE   7  69.725   2.754   0.879
   61    HE2  PHE   7           HE2      PHE   7  72.539   5.489  -1.006
   62    HZ   PHE   7           HZ       PHE   7  71.859   3.146  -0.381
   63    H    HIS   8           H        HIS   8  67.694   7.454   3.979
   64    HA   HIS   8           HA       HIS   8  69.817   6.148   5.658
   65   1HB   HIS   8          2HB       HIS   8  67.092   7.335   6.302
   66   2HB   HIS   8          1HB       HIS   8  68.181   6.619   7.489
   67    HD1  HIS   8           HD1      HIS   8  70.374   7.918   8.047
   68    HD2  HIS   8           HD2      HIS   8  67.860   9.908   5.383
   69    HE1  HIS   8           HE1      HIS   8  71.223  10.300   7.904
   70    H    THR   9           H        THR   9  69.553   3.997   6.206
   71    HA   THR   9           HA       THR   9  66.937   2.662   5.890
   72    HB   THR   9           HB       THR   9  68.077   2.650   3.645
   73    HG1  THR   9           HG1      THR   9  67.228   0.765   3.352
   74   1HG2  THR   9          1HG2      THR   9  70.123   0.953   5.101
   75   2HG2  THR   9          2HG2      THR   9  70.410   2.549   4.405
   76   3HG2  THR   9          3HG2      THR   9  70.050   1.180   3.353
   77    H    THR  10           H        THR  10  67.027   0.418   6.853
   78    HA   THR  10           HA       THR  10  69.240   0.205   8.856
   79    HB   THR  10           HB       THR  10  66.829   0.612   9.629
   80    HG1  THR  10           HG1      THR  10  68.242  -1.688  10.455
   81   1HG2  THR  10          1HG2      THR  10  66.198  -2.240   9.509
   82   2HG2  THR  10          2HG2      THR  10  66.210  -1.476   7.916
   83   3HG2  THR  10          3HG2      THR  10  65.159  -0.848   9.187
   84    H    VAL  11           H        VAL  11  69.982  -1.991   9.342
   85    HA   VAL  11           HA       VAL  11  70.359  -3.540   6.901
   86    HB   VAL  11           HB       VAL  11  71.157  -4.055   9.789
   87   1HG1  VAL  11          1HG1      VAL  11  72.261  -5.173   7.190
   88   2HG1  VAL  11          2HG1      VAL  11  71.292  -6.069   8.360
   89   3HG1  VAL  11          3HG1      VAL  11  72.900  -5.497   8.801
   90   1HG2  VAL  11          1HG2      VAL  11  73.408  -3.236   8.410
   91   2HG2  VAL  11          2HG2      VAL  11  72.425  -2.199   9.444
   92   3HG2  VAL  11          3HG2      VAL  11  72.151  -2.224   7.701
   93    H    HIS  12           H        HIS  12  69.379  -5.432   6.329
   94    HA   HIS  12           HA       HIS  12  67.464  -6.696   8.259
   95   1HB   HIS  12          2HB       HIS  12  67.380  -6.171   5.304
   96   2HB   HIS  12          1HB       HIS  12  66.521  -7.572   5.953
   97    HD1  HIS  12           HD1      HIS  12  66.851  -3.871   6.884
   98    HD2  HIS  12           HD2      HIS  12  63.972  -6.881   6.721
   99    HE1  HIS  12           HE1      HIS  12  64.671  -2.817   7.618
  100    H    ARG  13           H        ARG  13  67.170  -9.090   7.675
  101    HA   ARG  13           HA       ARG  13  69.416 -10.579   8.264
  102   1HB   ARG  13          2HB       ARG  13  66.956 -11.216   8.095
  103   2HB   ARG  13          1HB       ARG  13  67.233 -11.490   6.377
  104   1HG   ARG  13          2HG       ARG  13  69.028 -13.118   6.951
  105   2HG   ARG  13          1HG       ARG  13  68.666 -12.882   8.660
  106   1HD   ARG  13          2HD       ARG  13  66.314 -13.630   8.229
  107   2HD   ARG  13          1HD       ARG  13  66.778 -13.991   6.554
  108    HE   ARG  13           HE       ARG  13  68.015 -15.850   7.332
  109   1HH1  ARG  13          1HH1      ARG  13  67.188 -13.755  10.024
  110   2HH1  ARG  13          2HH1      ARG  13  67.772 -14.880  11.199
  111   1HH2  ARG  13          1HH2      ARG  13  68.752 -17.263   8.895
  112   2HH2  ARG  13          2HH2      ARG  13  68.647 -16.840  10.570
  113    H    ILE  14           H        ILE  14  70.918 -11.857   7.066
  114    HA   ILE  14           HA       ILE  14  72.484 -12.303   5.370
  115    HB   ILE  14           HB       ILE  14  70.348 -11.211   3.508
  116   1HG1  ILE  14          2HG1      ILE  14  70.839 -14.100   4.284
  117   2HG1  ILE  14          1HG1      ILE  14  69.601 -13.101   5.046
  118   1HG2  ILE  14          1HG2      ILE  14  72.926 -12.675   3.177
  119   2HG2  ILE  14          2HG2      ILE  14  72.197 -11.438   2.154
  120   3HG2  ILE  14          3HG2      ILE  14  71.598 -13.097   2.097
  121   1HD1  ILE  14          1HD1      ILE  14  68.993 -12.599   2.482
  122   2HD1  ILE  14          2HD1      ILE  14  68.322 -13.982   3.348
  123   3HD1  ILE  14          3HD1      ILE  14  69.707 -14.200   2.278
  124    H    GLY  15           H        GLY  15  71.708  -9.244   6.354
  125   1HA   GLY  15          2HA       GLY  15  73.002  -7.283   6.219
  126   2HA   GLY  15          1HA       GLY  15  74.056  -8.107   5.074
  127    H    ARG  16           H        ARG  16  70.694  -8.234   4.258
  128    HA   ARG  16           HA       ARG  16  71.209  -6.629   1.860
  129   1HB   ARG  16          2HB       ARG  16  69.970  -8.779   1.862
  130   2HB   ARG  16          1HB       ARG  16  68.744  -8.064   2.907
  131   1HG   ARG  16          2HG       ARG  16  68.196  -6.410   1.178
  132   2HG   ARG  16          1HG       ARG  16  69.456  -7.065   0.133
  133   1HD   ARG  16          2HD       ARG  16  67.342  -8.027  -0.579
  134   2HD   ARG  16          1HD       ARG  16  68.244  -9.305   0.259
  135    HE   ARG  16           HE       ARG  16  66.556  -7.701   2.036
  136   1HH1  ARG  16          1HH1      ARG  16  66.688 -10.527  -0.041
  137   2HH1  ARG  16          2HH1      ARG  16  65.373 -11.300   0.772
  138   1HH2  ARG  16          1HH2      ARG  16  64.865  -8.748   3.046
  139   2HH2  ARG  16          2HH2      ARG  16  64.354 -10.309   2.497
  140    H    ILE  17           H        ILE  17  70.242  -4.650   1.376
  141    HA   ILE  17           HA       ILE  17  68.321  -3.497   3.349
  142    HB   ILE  17           HB       ILE  17  69.474  -1.313   3.118
  143   1HG1  ILE  17          2HG1      ILE  17  71.642  -2.811   1.619
  144   2HG1  ILE  17          1HG1      ILE  17  70.395  -1.867   0.806
  145   1HG2  ILE  17          1HG2      ILE  17  71.371  -3.553   3.878
  146   2HG2  ILE  17          2HG2      ILE  17  70.137  -2.864   4.933
  147   3HG2  ILE  17          3HG2      ILE  17  71.492  -1.872   4.396
  148   1HD1  ILE  17          1HD1      ILE  17  72.796  -0.849   1.665
  149   2HD1  ILE  17          2HD1      ILE  17  71.735  -0.439   3.013
  150   3HD1  ILE  17          3HD1      ILE  17  71.347   0.118   1.383
  151    H    ILE  18           H        ILE  18  66.796  -2.003   2.330
  152    HA   ILE  18           HA       ILE  18  66.735  -2.211  -0.668
  153    HB   ILE  18           HB       ILE  18  64.439  -1.887   1.296
  154   1HG1  ILE  18          2HG1      ILE  18  65.456  -4.115   1.527
  155   2HG1  ILE  18          1HG1      ILE  18  63.895  -4.245   0.723
  156   1HG2  ILE  18          1HG2      ILE  18  64.647  -2.099  -1.697
  157   2HG2  ILE  18          2HG2      ILE  18  63.670  -0.997  -0.723
  158   3HG2  ILE  18          3HG2      ILE  18  63.204  -2.693  -0.874
  159   1HD1  ILE  18          1HD1      ILE  18  66.625  -4.734  -0.346
  160   2HD1  ILE  18          2HD1      ILE  18  65.492  -3.943  -1.443
  161   3HD1  ILE  18          3HD1      ILE  18  65.099  -5.519  -0.755
  162    H    ILE  19           H        ILE  19  66.898  -0.283  -1.717
  163    HA   ILE  19           HA       ILE  19  66.876   2.258  -0.218
  164    HB   ILE  19           HB       ILE  19  67.105   1.605  -3.191
  165   1HG1  ILE  19          2HG1      ILE  19  69.190   2.073  -1.016
  166   2HG1  ILE  19          1HG1      ILE  19  68.896   0.564  -1.867
  167   1HG2  ILE  19          1HG2      ILE  19  66.405   3.971  -2.542
  168   2HG2  ILE  19          2HG2      ILE  19  67.911   3.864  -3.453
  169   3HG2  ILE  19          3HG2      ILE  19  67.954   4.120  -1.709
  170   1HD1  ILE  19          1HD1      ILE  19  70.601   2.749  -2.623
  171   2HD1  ILE  19          2HD1      ILE  19  69.353   2.542  -3.855
  172   3HD1  ILE  19          3HD1      ILE  19  70.397   1.188  -3.419
  173    HA   PRO  20           HA       PRO  20  62.532   3.095  -0.985
  174   1HB   PRO  20          2HB       PRO  20  62.635   5.832  -1.069
  175   2HB   PRO  20          1HB       PRO  20  62.689   4.920   0.450
  176   1HG   PRO  20          2HG       PRO  20  64.972   5.981  -1.179
  177   2HG   PRO  20          1HG       PRO  20  64.673   6.168   0.561
  178   1HD   PRO  20          2HD       PRO  20  66.380   4.333  -0.267
  179   2HD   PRO  20          1HD       PRO  20  65.206   3.919   1.012
  180    H    ALA  21           H        ALA  21  61.354   3.446  -2.876
  181    HA   ALA  21           HA       ALA  21  62.639   3.342  -5.393
  182   1HB   ALA  21          1HB       ALA  21  59.868   4.167  -4.493
  183   2HB   ALA  21          2HB       ALA  21  60.377   2.608  -5.143
  184   3HB   ALA  21          3HB       ALA  21  60.293   4.019  -6.198
  185    H    GLY  22           H        GLY  22  61.746   6.116  -3.420
  186   1HA   GLY  22          2HA       GLY  22  61.802   8.124  -5.483
  187   2HA   GLY  22          1HA       GLY  22  62.051   8.428  -3.761
  188    H    THR  23           H        THR  23  64.348   6.888  -3.300
  189    HA   THR  23           HA       THR  23  66.412   8.653  -4.296
  190    HB   THR  23           HB       THR  23  66.589   5.946  -2.931
  191    HG1  THR  23           HG1      THR  23  66.698   7.231  -1.053
  192   1HG2  THR  23          1HG2      THR  23  68.824   6.320  -2.638
  193   2HG2  THR  23          2HG2      THR  23  68.613   8.064  -2.479
  194   3HG2  THR  23          3HG2      THR  23  68.637   7.321  -4.079
  195    H    ARG  24           H        ARG  24  65.377   5.351  -5.165
  196    HA   ARG  24           HA       ARG  24  67.452   4.672  -7.024
  197   1HB   ARG  24          2HB       ARG  24  64.511   4.082  -7.454
  198   2HB   ARG  24          1HB       ARG  24  65.886   3.097  -7.927
  199   1HG   ARG  24          2HG       ARG  24  66.334   3.034  -5.318
  200   2HG   ARG  24          1HG       ARG  24  64.617   3.410  -5.242
  201   1HD   ARG  24          2HD       ARG  24  64.468   1.445  -7.045
  202   2HD   ARG  24          1HD       ARG  24  65.957   0.938  -6.216
  203    HE   ARG  24           HE       ARG  24  64.354   1.537  -4.107
  204   1HH1  ARG  24          1HH1      ARG  24  63.745  -0.400  -6.967
  205   2HH1  ARG  24          2HH1      ARG  24  62.589  -1.394  -6.156
  206   1HH2  ARG  24          1HH2      ARG  24  62.873   0.226  -3.116
  207   2HH2  ARG  24          2HH2      ARG  24  62.095  -1.046  -3.998
  208    H    LYS  25           H        LYS  25  64.476   6.546  -7.414
  209    HA   LYS  25           HA       LYS  25  64.593   6.931 -10.245
  210   1HB   LYS  25          2HB       LYS  25  62.621   7.275  -8.770
  211   2HB   LYS  25          1HB       LYS  25  63.419   8.669  -8.043
  212   1HG   LYS  25          2HG       LYS  25  63.490   9.773 -10.249
  213   2HG   LYS  25          1HG       LYS  25  62.663   8.388 -10.963
  214   1HD   LYS  25          2HD       LYS  25  60.771   8.770  -9.360
  215   2HD   LYS  25          1HD       LYS  25  61.579  10.245  -8.828
  216   1HE   LYS  25          2HE       LYS  25  61.513  11.097 -11.176
  217   2HE   LYS  25          1HE       LYS  25  60.598   9.648 -11.642
  218   1HZ   LYS  25          1HZ       LYS  25  59.804  11.495  -9.455
  219   2HZ   LYS  25          2HZ       LYS  25  58.908  10.182 -10.056
  220   3HZ   LYS  25          3HZ       LYS  25  59.162  11.555 -11.024
  221    H    PHE  26           H        PHE  26  65.612   9.072  -7.575
  222    HA   PHE  26           HA       PHE  26  66.663  11.216  -9.120
  223   1HB   PHE  26          2HB       PHE  26  66.238  11.184  -6.667
  224   2HB   PHE  26          1HB       PHE  26  67.614  10.103  -6.459
  225    HD1  PHE  26           HD1      PHE  26  69.822  10.962  -6.217
  226    HD2  PHE  26           HD2      PHE  26  66.659  13.493  -7.820
  227    HE1  PHE  26           HE1      PHE  26  71.373  12.942  -6.157
  228    HE2  PHE  26           HE2      PHE  26  68.210  15.471  -7.760
  229    HZ   PHE  26           HZ       PHE  26  70.568  15.196  -6.928
  230    H    TYR  27           H        TYR  27  68.200   8.202  -8.054
  231    HA   TYR  27           HA       TYR  27  70.818   8.965  -9.173
  232   1HB   TYR  27          2HB       TYR  27  70.450   7.745  -7.036
  233   2HB   TYR  27          1HB       TYR  27  69.764   6.404  -7.933
  234    HD1  TYR  27           HD1      TYR  27  72.776   7.855  -6.604
  235    HD2  TYR  27           HD2      TYR  27  71.289   5.308  -9.806
  236    HE1  TYR  27           HE1      TYR  27  75.071   6.866  -6.892
  237    HE2  TYR  27           HE2      TYR  27  73.579   4.323 -10.090
  238    HH   TYR  27           HH       TYR  27  76.019   4.638  -7.806
  239    H    GLY  28           H        GLY  28  67.980   7.347 -10.376
  240   1HA   GLY  28          2HA       GLY  28  67.592   6.482 -12.528
  241   2HA   GLY  28          1HA       GLY  28  69.261   6.881 -12.937
  242    H    ILE  29           H        ILE  29  68.063   4.769 -10.322
  243    HA   ILE  29           HA       ILE  29  70.007   2.702 -11.110
  244    HB   ILE  29           HB       ILE  29  67.957   2.856  -8.868
  245   1HG1  ILE  29          2HG1      ILE  29  70.932   3.450  -8.872
  246   2HG1  ILE  29          1HG1      ILE  29  69.661   4.667  -8.856
  247   1HG2  ILE  29          1HG2      ILE  29  68.731   0.866  -8.084
  248   2HG2  ILE  29          2HG2      ILE  29  70.400   1.234  -8.514
  249   3HG2  ILE  29          3HG2      ILE  29  69.292   0.609  -9.734
  250   1HD1  ILE  29          1HD1      ILE  29  69.797   4.546  -6.600
  251   2HD1  ILE  29          2HD1      ILE  29  70.708   3.033  -6.656
  252   3HD1  ILE  29          3HD1      ILE  29  68.945   3.009  -6.754
  253    H    GLU  30           H        GLU  30  69.513   1.026 -12.401
  254    HA   GLU  30           HA       GLU  30  66.719  -0.048 -12.397
  255   1HB   GLU  30          2HB       GLU  30  67.261   1.267 -14.471
  256   2HB   GLU  30          1HB       GLU  30  68.601   0.161 -14.774
  257   1HG   GLU  30          2HG       GLU  30  66.723  -0.612 -16.077
  258   2HG   GLU  30          1HG       GLU  30  66.934  -1.735 -14.734
  259    H    GLN  31           H        GLN  31  66.687  -2.405 -12.699
  260    HA   GLN  31           HA       GLN  31  68.653  -3.855 -11.280
  261   1HB   GLN  31          2HB       GLN  31  66.303  -4.534 -11.896
  262   2HB   GLN  31          1HB       GLN  31  66.895  -4.891 -13.518
  263   1HG   GLN  31          2HG       GLN  31  68.489  -6.519 -12.599
  264   2HG   GLN  31          1HG       GLN  31  67.939  -6.150 -10.965
  265   1HE2  GLN  31          1HE2      GLN  31  67.702  -8.791 -11.779
  266   2HE2  GLN  31          2HE2      GLN  31  66.077  -9.178 -12.078
  267    H    GLY  32           H        GLY  32  70.528  -4.896 -11.859
  268   1HA   GLY  32          2HA       GLY  32  72.106  -5.903 -13.363
  269   2HA   GLY  32          1HA       GLY  32  71.283  -5.125 -14.711
  270    H    ASP  33           H        ASP  33  71.411  -2.530 -12.871
  271    HA   ASP  33           HA       ASP  33  73.912  -1.509 -14.018
  272   1HB   ASP  33          2HB       ASP  33  71.848  -0.407 -12.087
  273   2HB   ASP  33          1HB       ASP  33  73.182   0.540 -12.746
  274    H    PHE  34           H        PHE  34  75.684  -0.633 -12.665
  275    HA   PHE  34           HA       PHE  34  75.899  -1.984  -9.993
  276   1HB   PHE  34          2HB       PHE  34  77.928  -1.180 -12.093
  277   2HB   PHE  34          1HB       PHE  34  78.391  -1.659 -10.460
  278    HD1  PHE  34           HD1      PHE  34  76.899  -2.800 -13.676
  279    HD2  PHE  34           HD2      PHE  34  78.159  -3.981  -9.676
  280    HE1  PHE  34           HE1      PHE  34  76.727  -5.222 -14.337
  281    HE2  PHE  34           HE2      PHE  34  77.985  -6.402 -10.337
  282    HZ   PHE  34           HZ       PHE  34  77.269  -7.022 -12.666
  283    H    VAL  35           H        VAL  35  76.300  -0.642  -8.243
  284    HA   VAL  35           HA       VAL  35  77.001   2.210  -8.807
  285    HB   VAL  35           HB       VAL  35  75.416   2.853  -7.000
  286   1HG1  VAL  35          1HG1      VAL  35  73.992   1.112  -9.027
  287   2HG1  VAL  35          2HG1      VAL  35  74.750   2.644  -9.463
  288   3HG1  VAL  35          3HG1      VAL  35  73.425   2.615  -8.301
  289   1HG2  VAL  35          1HG2      VAL  35  75.380   0.852  -5.650
  290   2HG2  VAL  35          2HG2      VAL  35  74.817  -0.119  -7.011
  291   3HG2  VAL  35          3HG2      VAL  35  73.748   1.084  -6.284
  292    H    GLU  36           H        GLU  36  78.256   3.192  -7.077
  293    HA   GLU  36           HA       GLU  36  79.571   1.188  -5.268
  294   1HB   GLU  36          2HB       GLU  36  80.955   2.173  -7.116
  295   2HB   GLU  36          1HB       GLU  36  80.633   3.778  -6.459
  296   1HG   GLU  36          2HG       GLU  36  81.632   3.010  -4.280
  297   2HG   GLU  36          1HG       GLU  36  82.101   1.512  -5.084
  298    H    ILE  37           H        ILE  37  79.115   1.554  -3.162
  299    HA   ILE  37           HA       ILE  37  78.224   4.299  -2.365
  300    HB   ILE  37           HB       ILE  37  76.377   2.818  -3.045
  301   1HG1  ILE  37          2HG1      ILE  37  76.200   2.865  -0.054
  302   2HG1  ILE  37          1HG1      ILE  37  76.354   4.392  -0.922
  303   1HG2  ILE  37          1HG2      ILE  37  77.418   0.654  -2.607
  304   2HG2  ILE  37          2HG2      ILE  37  75.899   0.769  -1.716
  305   3HG2  ILE  37          3HG2      ILE  37  77.435   0.984  -0.874
  306   1HD1  ILE  37          1HD1      ILE  37  74.130   4.312  -1.294
  307   2HD1  ILE  37          2HD1      ILE  37  74.031   2.672  -0.655
  308   3HD1  ILE  37          3HD1      ILE  37  74.413   2.934  -2.357
  309    H    LYS  38           H        LYS  38  78.254   4.672  -0.039
  310    HA   LYS  38           HA       LYS  38  79.966   2.798   1.549
  311   1HB   LYS  38          2HB       LYS  38  80.958   5.000   0.486
  312   2HB   LYS  38          1HB       LYS  38  80.112   5.793   1.815
  313   1HG   LYS  38          2HG       LYS  38  81.645   3.421   2.655
  314   2HG   LYS  38          1HG       LYS  38  82.648   4.690   1.959
  315   1HD   LYS  38          2HD       LYS  38  80.568   5.565   3.899
  316   2HD   LYS  38          1HD       LYS  38  81.940   4.675   4.559
  317   1HE   LYS  38          2HE       LYS  38  82.941   6.742   4.581
  318   2HE   LYS  38          1HE       LYS  38  83.206   6.422   2.855
  319   1HZ   LYS  38          1HZ       LYS  38  82.022   8.540   3.276
  320   2HZ   LYS  38          2HZ       LYS  38  80.747   7.660   3.973
  321   3HZ   LYS  38          3HZ       LYS  38  81.125   7.455   2.329
  322    H    ILE  39           H        ILE  39  79.314   2.590   3.728
  323    HA   ILE  39           HA       ILE  39  76.866   4.133   4.537
  324    HB   ILE  39           HB       ILE  39  76.422   2.139   5.990
  325   1HG1  ILE  39          2HG1      ILE  39  78.675   0.834   4.438
  326   2HG1  ILE  39          1HG1      ILE  39  78.858   1.444   6.082
  327   1HG2  ILE  39          1HG2      ILE  39  75.144   1.846   4.142
  328   2HG2  ILE  39          2HG2      ILE  39  76.284   0.544   3.796
  329   3HG2  ILE  39          3HG2      ILE  39  76.490   2.123   3.035
  330   1HD1  ILE  39          1HD1      ILE  39  76.681  -0.018   6.503
  331   2HD1  ILE  39          2HD1      ILE  39  78.285  -0.753   6.533
  332   3HD1  ILE  39          3HD1      ILE  39  77.276  -0.895   5.093
  333    H    VAL  40           H        VAL  40  76.781   4.897   6.689
  334    HA   VAL  40           HA       VAL  40  79.251   4.641   8.346
  335    HB   VAL  40           HB       VAL  40  77.781   7.212   7.649
  336   1HG1  VAL  40          1HG1      VAL  40  78.773   7.095   9.960
  337   2HG1  VAL  40          2HG1      VAL  40  79.501   8.335   8.939
  338   3HG1  VAL  40          3HG1      VAL  40  80.347   6.813   9.217
  339   1HG2  VAL  40          1HG2      VAL  40  80.557   6.247   6.872
  340   2HG2  VAL  40          2HG2      VAL  40  79.851   7.807   6.450
  341   3HG2  VAL  40          3HG2      VAL  40  79.168   6.322   5.788
  342    H    LYS  41           H        LYS  41  78.623   3.963  10.322
  343    HA   LYS  41           HA       LYS  41  76.079   5.011  11.498
  344   1HB   LYS  41          2HB       LYS  41  75.841   2.652  10.696
  345   2HB   LYS  41          1HB       LYS  41  77.189   2.194  11.736
  346   1HG   LYS  41          2HG       LYS  41  75.885   3.137  13.687
  347   2HG   LYS  41          1HG       LYS  41  74.507   3.300  12.599
  348   1HD   LYS  41          2HD       LYS  41  74.616   0.872  12.115
  349   2HD   LYS  41          1HD       LYS  41  75.960   0.720  13.247
  350   1HE   LYS  41          2HE       LYS  41  73.336   1.933  14.132
  351   2HE   LYS  41          1HE       LYS  41  73.595   0.177  14.155
  352   1HZ   LYS  41          1HZ       LYS  41  75.465   2.140  15.359
  353   2HZ   LYS  41          2HZ       LYS  41  75.537   0.448  15.480
  354   3HZ   LYS  41          3HZ       LYS  41  74.282   1.303  16.240
  355    H    TYR  42           H        TYR  42  76.271   5.468  13.738
  356    HA   TYR  42           HA       TYR  42  79.083   5.526  14.748
  357   1HB   TYR  42          2HB       TYR  42  77.586   7.584  14.509
  358   2HB   TYR  42          1HB       TYR  42  76.640   6.933  15.849
  359    HD1  TYR  42           HD1      TYR  42  80.163   7.849  14.857
  360    HD2  TYR  42           HD2      TYR  42  77.318   7.304  18.110
  361    HE1  TYR  42           HE1      TYR  42  81.849   8.765  16.481
  362    HE2  TYR  42           HE2      TYR  42  79.002   8.223  19.736
  363    HH   TYR  42           HH       TYR  42  81.501  10.016  19.004
  364    H    GLU  43           H        GLU  43  79.683   4.236  16.444
  365    HA   GLU  43           HA       GLU  43  77.542   3.074  18.192
  366   1HB   GLU  43          2HB       GLU  43  79.946   1.700  16.940
  367   2HB   GLU  43          1HB       GLU  43  78.844   0.945  18.094
  368   1HG   GLU  43          2HG       GLU  43  76.957   1.372  16.533
  369   2HG   GLU  43          1HG       GLU  43  78.095   2.038  15.366
  370    H    GLY  44           H        GLY  44  78.010   3.376  20.335
  371   1HA   GLY  44          2HA       GLY  44  79.189   3.947  22.280
  372   2HA   GLY  44          1HA       GLY  44  80.592   3.185  21.530
  373    H    GLU  45           H        GLU  45  82.253   4.607  21.582
  374    HA   GLU  45           HA       GLU  45  81.706   7.495  21.049
  375   1HB   GLU  45          2HB       GLU  45  83.831   7.872  22.203
  376   2HB   GLU  45          1HB       GLU  45  82.798   6.840  23.186
  377   1HG   GLU  45          2HG       GLU  45  84.021   4.848  22.413
  378   2HG   GLU  45          1HG       GLU  45  85.029   5.857  21.375
  379    H    GLU  46           H        GLU  46  82.368   4.970  19.130
  380    HA   GLU  46           HA       GLU  46  84.318   6.518  17.471
  381   1HB   GLU  46          2HB       GLU  46  85.333   4.324  16.889
  382   2HB   GLU  46          1HB       GLU  46  85.415   4.651  18.618
  383   1HG   GLU  46          2HG       GLU  46  83.362   3.267  18.940
  384   2HG   GLU  46          1HG       GLU  46  83.388   2.879  17.221
  385    HA   PRO  47           HA       PRO  47  81.150   5.721  14.374
  386   1HB   PRO  47          2HB       PRO  47  82.877   6.699  12.279
  387   2HB   PRO  47          1HB       PRO  47  81.499   7.518  13.032
  388   1HG   PRO  47          2HG       PRO  47  84.158   8.246  13.290
  389   2HG   PRO  47          1HG       PRO  47  82.829   8.775  14.328
  390   1HD   PRO  47          2HD       PRO  47  84.934   6.768  14.846
  391   2HD   PRO  47          1HD       PRO  47  84.019   7.781  15.982
  392    H    LYS  48           H        LYS  48  80.805   3.986  12.997
  393    HA   LYS  48           HA       LYS  48  83.171   2.365  12.117
  394   1HB   LYS  48          2HB       LYS  48  80.279   1.574  12.618
  395   2HB   LYS  48          1HB       LYS  48  81.555   0.481  12.084
  396   1HG   LYS  48          2HG       LYS  48  81.704   2.079  14.651
  397   2HG   LYS  48          1HG       LYS  48  81.106   0.421  14.570
  398   1HD   LYS  48          2HD       LYS  48  83.278  -0.232  13.482
  399   2HD   LYS  48          1HD       LYS  48  83.869   1.396  13.810
  400   1HE   LYS  48          2HE       LYS  48  84.606   0.398  15.758
  401   2HE   LYS  48          1HE       LYS  48  82.943   0.728  16.281
  402   1HZ   LYS  48          1HZ       LYS  48  82.312  -1.438  15.289
  403   2HZ   LYS  48          2HZ       LYS  48  83.374  -1.589  16.606
  404   3HZ   LYS  48          3HZ       LYS  48  83.954  -1.764  15.018
  405    H    GLU  49           H        GLU  49  83.362   2.067   9.890
  406    HA   GLU  49           HA       GLU  49  81.120   3.045   8.152
  407   1HB   GLU  49          2HB       GLU  49  84.090   3.654   7.986
  408   2HB   GLU  49          1HB       GLU  49  82.886   4.182   6.808
  409   1HG   GLU  49          2HG       GLU  49  81.677   5.383   8.622
  410   2HG   GLU  49          1HG       GLU  49  82.944   4.912   9.753
  411    H    GLY  50           H        GLY  50  81.349   2.294   5.876
  412   1HA   GLY  50          2HA       GLY  50  83.202   0.105   5.293
  413   2HA   GLY  50          1HA       GLY  50  81.518  -0.403   5.444
  414    H    THR  51           H        THR  51  83.553   0.035   3.094
  415    HA   THR  51           HA       THR  51  81.568   1.420   1.310
  416    HB   THR  51           HB       THR  51  84.558   1.408   0.882
  417    HG1  THR  51           HG1      THR  51  84.570   3.413   1.981
  418   1HG2  THR  51          1HG2      THR  51  82.522   2.231  -0.712
  419   2HG2  THR  51          2HG2      THR  51  84.125   2.968  -0.729
  420   3HG2  THR  51          3HG2      THR  51  82.822   3.713   0.198
  421    H    PHE  52           H        PHE  52  81.048   0.250  -0.543
  422    HA   PHE  52           HA       PHE  52  82.896  -1.784  -1.581
  423   1HB   PHE  52          2HB       PHE  52  81.485  -3.684  -1.147
  424   2HB   PHE  52          1HB       PHE  52  81.629  -2.809   0.370
  425    HD1  PHE  52           HD1      PHE  52  79.365  -4.268  -1.991
  426    HD2  PHE  52           HD2      PHE  52  79.712  -1.016   0.886
  427    HE1  PHE  52           HE1      PHE  52  76.863  -4.082  -1.904
  428    HE2  PHE  52           HE2      PHE  52  77.203  -0.831   0.973
  429    HZ   PHE  52           HZ       PHE  52  75.781  -2.365  -0.429
  430    H    THR  53           H        THR  53  81.787  -2.947  -3.522
  431    HA   THR  53           HA       THR  53  80.058  -0.998  -5.011
  432    HB   THR  53           HB       THR  53  81.830  -3.260  -5.999
  433    HG1  THR  53           HG1      THR  53  83.195  -1.549  -6.622
  434   1HG2  THR  53          1HG2      THR  53  80.167  -1.149  -7.366
  435   2HG2  THR  53          2HG2      THR  53  80.166  -2.891  -7.640
  436   3HG2  THR  53          3HG2      THR  53  81.532  -1.915  -8.180
  437    H    ALA  54           H        ALA  54  78.062  -1.752  -5.753
  438    HA   ALA  54           HA       ALA  54  77.363  -4.617  -5.262
  439   1HB   ALA  54          1HB       ALA  54  75.344  -2.598  -4.513
  440   2HB   ALA  54          2HB       ALA  54  76.810  -2.546  -3.538
  441   3HB   ALA  54          3HB       ALA  54  75.870  -4.034  -3.635
  442    H    ARG  55           H        ARG  55  75.752  -5.426  -6.629
  443    HA   ARG  55           HA       ARG  55  74.997  -3.739  -8.962
  444   1HB   ARG  55          2HB       ARG  55  75.963  -6.110  -9.078
  445   2HB   ARG  55          1HB       ARG  55  74.417  -6.662  -8.432
  446   1HG   ARG  55          2HG       ARG  55  73.268  -5.495 -10.330
  447   2HG   ARG  55          1HG       ARG  55  74.854  -5.127 -11.008
  448   1HD   ARG  55          2HD       ARG  55  75.338  -7.628 -10.961
  449   2HD   ARG  55          1HD       ARG  55  73.620  -7.863 -10.585
  450    HE   ARG  55           HE       ARG  55  74.092  -6.094 -12.871
  451   1HH1  ARG  55          1HH1      ARG  55  73.601  -9.415 -11.843
  452   2HH1  ARG  55          2HH1      ARG  55  73.041  -9.910 -13.401
  453   1HH2  ARG  55          1HH2      ARG  55  73.361  -6.793 -14.859
  454   2HH2  ARG  55          2HH2      ARG  55  72.905  -8.449 -15.086
  455    H    VAL  56           H        VAL  56  72.813  -3.285  -9.416
  456    HA   VAL  56           HA       VAL  56  70.978  -3.250  -7.141
  457    HB   VAL  56           HB       VAL  56  70.704  -2.482 -10.068
  458   1HG1  VAL  56          1HG1      VAL  56  68.982  -1.113  -8.118
  459   2HG1  VAL  56          2HG1      VAL  56  68.636  -2.837  -8.238
  460   3HG1  VAL  56          3HG1      VAL  56  68.572  -1.822  -9.680
  461   1HG2  VAL  56          1HG2      VAL  56  71.035  -0.647  -7.698
  462   2HG2  VAL  56          2HG2      VAL  56  71.320  -0.298  -9.404
  463   3HG2  VAL  56          3HG2      VAL  56  72.436  -1.337  -8.518
  464    H    GLY  57           H        GLY  57  69.576  -4.833  -6.660
  465   1HA   GLY  57          2HA       GLY  57  68.995  -6.928  -8.698
  466   2HA   GLY  57          1HA       GLY  57  68.826  -7.141  -6.956
  467    H    GLU  58           H        GLU  58  66.656  -7.934  -7.715
  468    HA   GLU  58           HA       GLU  58  64.653  -6.224  -8.827
  469   1HB   GLU  58          2HB       GLU  58  64.591  -8.720  -8.574
  470   2HB   GLU  58          1HB       GLU  58  64.352  -8.503  -6.840
  471   1HG   GLU  58          2HG       GLU  58  62.294  -7.190  -7.316
  472   2HG   GLU  58          1HG       GLU  58  62.515  -7.496  -9.035
  473    H    GLN  59           H        GLN  59  62.961  -5.056  -7.759
  474    HA   GLN  59           HA       GLN  59  62.122  -3.525  -6.182
  475   1HB   GLN  59          2HB       GLN  59  63.124  -5.850  -4.538
  476   2HB   GLN  59          1HB       GLN  59  62.299  -4.482  -3.790
  477   1HG   GLN  59          2HG       GLN  59  60.347  -4.832  -5.223
  478   2HG   GLN  59          1HG       GLN  59  61.168  -6.151  -6.054
  479   1HE2  GLN  59          1HE2      GLN  59  61.185  -8.216  -5.045
  480   2HE2  GLN  59          2HE2      GLN  59  60.446  -8.527  -3.550
  481    H    GLY  60           H        GLY  60  65.190  -3.438  -6.914
  482   1HA   GLY  60          2HA       GLY  60  66.783  -1.774  -6.459
  483   2HA   GLY  60          1HA       GLY  60  65.620  -1.078  -5.333
  484    H    SER  61           H        SER  61  66.526  -4.390  -4.806
  485    HA   SER  61           HA       SER  61  67.561  -3.716  -2.167
  486   1HB   SER  61          2HB       SER  61  67.559  -6.100  -1.878
  487   2HB   SER  61          1HB       SER  61  66.169  -5.735  -2.897
  488    HG   SER  61           HG       SER  61  67.100  -7.188  -4.129
  489    H    VAL  62           H        VAL  62  69.698  -3.952  -1.438
  490    HA   VAL  62           HA       VAL  62  71.800  -4.739  -3.398
  491    HB   VAL  62           HB       VAL  62  71.577  -2.280  -3.448
  492   1HG1  VAL  62          1HG1      VAL  62  72.007  -0.954  -1.421
  493   2HG1  VAL  62          2HG1      VAL  62  72.154  -2.435  -0.473
  494   3HG1  VAL  62          3HG1      VAL  62  70.603  -1.997  -1.193
  495   1HG2  VAL  62          1HG2      VAL  62  74.041  -2.794  -1.807
  496   2HG2  VAL  62          2HG2      VAL  62  73.858  -1.816  -3.263
  497   3HG2  VAL  62          3HG2      VAL  62  73.866  -3.576  -3.378
  498    H    ILE  63           H        ILE  63  73.585  -5.775  -2.379
  499    HA   ILE  63           HA       ILE  63  73.108  -6.494   0.489
  500    HB   ILE  63           HB       ILE  63  74.660  -7.905  -1.711
  501   1HG1  ILE  63          2HG1      ILE  63  72.258  -7.801  -2.253
  502   2HG1  ILE  63          1HG1      ILE  63  72.715  -9.444  -1.812
  503   1HG2  ILE  63          1HG2      ILE  63  74.139  -9.864  -0.022
  504   2HG2  ILE  63          2HG2      ILE  63  74.013  -8.548   1.145
  505   3HG2  ILE  63          3HG2      ILE  63  75.515  -8.796   0.255
  506   1HD1  ILE  63          1HD1      ILE  63  71.845  -9.087   0.466
  507   2HD1  ILE  63          2HD1      ILE  63  70.588  -8.784  -0.734
  508   3HD1  ILE  63          3HD1      ILE  63  71.408  -7.432   0.045
  509    H    ILE  64           H        ILE  64  74.535  -5.704   1.954
  510    HA   ILE  64           HA       ILE  64  77.157  -4.579   1.192
  511    HB   ILE  64           HB       ILE  64  75.800  -5.137   3.857
  512   1HG1  ILE  64          2HG1      ILE  64  76.146  -2.478   2.457
  513   2HG1  ILE  64          1HG1      ILE  64  74.719  -3.486   2.208
  514   1HG2  ILE  64          1HG2      ILE  64  78.155  -3.326   3.246
  515   2HG2  ILE  64          2HG2      ILE  64  78.303  -4.932   3.960
  516   3HG2  ILE  64          3HG2      ILE  64  77.456  -3.655   4.831
  517   1HD1  ILE  64          1HD1      ILE  64  74.010  -2.150   3.978
  518   2HD1  ILE  64          2HD1      ILE  64  75.621  -2.061   4.690
  519   3HD1  ILE  64          3HD1      ILE  64  74.668  -3.536   4.847
  520    HA   PRO  65           HA       PRO  65  79.288  -8.474   1.547
  521   1HB   PRO  65          2HB       PRO  65  81.770  -7.618   2.313
  522   2HB   PRO  65          1HB       PRO  65  81.154  -7.406   0.658
  523   1HG   PRO  65          2HG       PRO  65  81.099  -5.463   2.939
  524   2HG   PRO  65          1HG       PRO  65  81.678  -5.209   1.280
  525   1HD   PRO  65          2HD       PRO  65  79.259  -4.385   1.960
  526   2HD   PRO  65          1HD       PRO  65  79.504  -5.205   0.396
  527    H    LYS  66           H        LYS  66  79.411  -9.958   3.202
  528    HA   LYS  66           HA       LYS  66  78.613  -9.427   5.863
  529   1HB   LYS  66          2HB       LYS  66  78.645 -11.627   4.675
  530   2HB   LYS  66          1HB       LYS  66  80.401 -11.657   4.840
  531   1HG   LYS  66          2HG       LYS  66  80.152 -11.529   7.308
  532   2HG   LYS  66          1HG       LYS  66  78.398 -11.575   7.116
  533   1HD   LYS  66          2HD       LYS  66  78.646 -13.763   5.914
  534   2HD   LYS  66          1HD       LYS  66  80.366 -13.732   6.303
  535   1HE   LYS  66          2HE       LYS  66  79.888 -13.767   8.689
  536   2HE   LYS  66          1HE       LYS  66  78.148 -13.617   8.378
  537   1HZ   LYS  66          1HZ       LYS  66  78.812 -15.941   8.696
  538   2HZ   LYS  66          2HZ       LYS  66  79.883 -15.817   7.382
  539   3HZ   LYS  66          3HZ       LYS  66  78.208 -15.672   7.134
  540    H    ALA  67           H        ALA  67  81.845  -9.467   4.437
  541    HA   ALA  67           HA       ALA  67  83.435  -9.488   6.797
  542   1HB   ALA  67          1HB       ALA  67  85.151  -9.022   5.312
  543   2HB   ALA  67          2HB       ALA  67  84.216  -7.791   4.462
  544   3HB   ALA  67          3HB       ALA  67  83.906  -9.500   4.158
  545    H    LEU  68           H        LEU  68  81.861  -6.792   5.102
  546    HA   LEU  68           HA       LEU  68  82.983  -4.745   6.859
  547   1HB   LEU  68          2HB       LEU  68  80.763  -4.807   4.797
  548   2HB   LEU  68          1HB       LEU  68  81.247  -3.337   5.640
  549    HG   LEU  68           HG       LEU  68  83.067  -5.068   3.930
  550   1HD1  LEU  68          1HD1      LEU  68  82.774  -3.551   2.214
  551   2HD1  LEU  68          2HD1      LEU  68  82.419  -2.219   3.312
  552   3HD1  LEU  68          3HD1      LEU  68  81.183  -3.428   2.963
  553   1HD2  LEU  68          1HD2      LEU  68  84.550  -4.093   5.437
  554   2HD2  LEU  68          2HD2      LEU  68  83.514  -2.693   5.709
  555   3HD2  LEU  68          3HD2      LEU  68  84.454  -2.818   4.222
  556    H    ARG  69           H        ARG  69  79.980  -6.649   6.759
  557    HA   ARG  69           HA       ARG  69  78.410  -5.181   8.641
  558   1HB   ARG  69          2HB       ARG  69  78.676  -8.194   8.311
  559   2HB   ARG  69          1HB       ARG  69  77.301  -7.353   9.013
  560   1HG   ARG  69          2HG       ARG  69  77.003  -6.192   6.775
  561   2HG   ARG  69          1HG       ARG  69  78.208  -7.309   6.127
  562   1HD   ARG  69          2HD       ARG  69  76.665  -9.121   7.342
  563   2HD   ARG  69          1HD       ARG  69  75.427  -7.881   7.073
  564    HE   ARG  69           HE       ARG  69  76.645  -7.969   4.634
  565   1HH1  ARG  69          1HH1      ARG  69  75.411 -10.520   6.711
  566   2HH1  ARG  69          2HH1      ARG  69  75.099 -11.575   5.380
  567   1HH2  ARG  69          1HH2      ARG  69  76.209  -9.379   2.963
  568   2HH2  ARG  69          2HH2      ARG  69  75.541 -10.942   3.287
  569    H    ASP  70           H        ASP  70  80.778  -7.794   9.132
  570    HA   ASP  70           HA       ASP  70  80.466  -7.954  11.987
  571   1HB   ASP  70          2HB       ASP  70  82.717  -8.767  10.116
  572   2HB   ASP  70          1HB       ASP  70  82.569  -9.302  11.790
  573    H    VAL  71           H        VAL  71  82.976  -6.395   9.961
  574    HA   VAL  71           HA       VAL  71  84.606  -5.407  12.085
  575    HB   VAL  71           HB       VAL  71  84.028  -4.349   9.293
  576   1HG1  VAL  71          1HG1      VAL  71  85.113  -2.632  10.691
  577   2HG1  VAL  71          2HG1      VAL  71  86.219  -3.231   9.455
  578   3HG1  VAL  71          3HG1      VAL  71  86.380  -3.780  11.124
  579   1HG2  VAL  71          1HG2      VAL  71  84.939  -6.756   9.743
  580   2HG2  VAL  71          2HG2      VAL  71  86.438  -5.929  10.163
  581   3HG2  VAL  71          3HG2      VAL  71  85.757  -5.752   8.547
  582    H    ILE  72           H        ILE  72  81.773  -4.001  10.490
  583    HA   ILE  72           HA       ILE  72  81.960  -1.469  11.936
  584    HB   ILE  72           HB       ILE  72  79.804  -2.709  10.185
  585   1HG1  ILE  72          2HG1      ILE  72  81.969  -0.692   9.505
  586   2HG1  ILE  72          1HG1      ILE  72  82.063  -2.412   9.126
  587   1HG2  ILE  72          1HG2      ILE  72  80.220   0.240  10.637
  588   2HG2  ILE  72          2HG2      ILE  72  79.239  -0.691  11.765
  589   3HG2  ILE  72          3HG2      ILE  72  78.779  -0.598  10.067
  590   1HD1  ILE  72          1HD1      ILE  72  81.183  -1.560   7.145
  591   2HD1  ILE  72          2HD1      ILE  72  80.250  -0.315   7.977
  592   3HD1  ILE  72          3HD1      ILE  72  79.710  -1.998   8.015
  593    H    GLY  73           H        GLY  73  80.501  -4.573  12.606
  594   1HA   GLY  73          2HA       GLY  73  79.444  -5.268  14.592
  595   2HA   GLY  73          1HA       GLY  73  79.637  -3.626  15.208
  596    H    ILE  74           H        ILE  74  77.997  -4.476  12.194
  597    HA   ILE  74           HA       ILE  74  75.662  -2.914  13.086
  598    HB   ILE  74           HB       ILE  74  76.339  -4.267  10.453
  599   1HG1  ILE  74          2HG1      ILE  74  78.042  -2.606  11.098
  600   2HG1  ILE  74          1HG1      ILE  74  77.087  -2.010   9.744
  601   1HG2  ILE  74          1HG2      ILE  74  74.067  -3.799  10.278
  602   2HG2  ILE  74          2HG2      ILE  74  74.769  -2.292   9.690
  603   3HG2  ILE  74          3HG2      ILE  74  74.168  -2.397  11.344
  604   1HD1  ILE  74          1HD1      ILE  74  76.976  -1.166  12.641
  605   2HD1  ILE  74          2HD1      ILE  74  75.621  -0.863  11.555
  606   3HD1  ILE  74          3HD1      ILE  74  77.200  -0.159  11.210
  607    H    LYS  75           H        LYS  75  73.588  -3.722  13.363
  608    HA   LYS  75           HA       LYS  75  73.202  -6.692  13.145
  609   1HB   LYS  75          2HB       LYS  75  72.591  -4.722  15.357
  610   2HB   LYS  75          1HB       LYS  75  71.819  -6.306  15.283
  611   1HG   LYS  75          2HG       LYS  75  73.645  -6.947  16.502
  612   2HG   LYS  75          1HG       LYS  75  74.407  -7.032  14.915
  613   1HD   LYS  75          2HD       LYS  75  75.935  -5.626  15.870
  614   2HD   LYS  75          1HD       LYS  75  74.743  -4.391  15.463
  615   1HE   LYS  75          2HE       LYS  75  74.865  -5.858  18.125
  616   2HE   LYS  75          1HE       LYS  75  75.453  -4.208  17.842
  617   1HZ   LYS  75          1HZ       LYS  75  73.216  -3.673  16.959
  618   2HZ   LYS  75          2HZ       LYS  75  73.205  -4.071  18.611
  619   3HZ   LYS  75          3HZ       LYS  75  72.681  -5.203  17.457
  620    HA   PRO  76           HA       PRO  76  69.391  -5.945  10.999
  621   1HB   PRO  76          2HB       PRO  76  67.968  -7.629  12.984
  622   2HB   PRO  76          1HB       PRO  76  68.088  -7.818  11.225
  623   1HG   PRO  76          2HG       PRO  76  69.416  -9.394  12.958
  624   2HG   PRO  76          1HG       PRO  76  70.027  -8.996  11.346
  625   1HD   PRO  76          2HD       PRO  76  70.938  -8.037  13.989
  626   2HD   PRO  76          1HD       PRO  76  71.831  -8.188  12.463
  627    H    GLY  77           H        GLY  77  67.917  -4.288  11.153
  628   1HA   GLY  77          2HA       GLY  77  66.157  -3.032  12.160
  629   2HA   GLY  77          1HA       GLY  77  66.594  -3.715  13.722
  630    H    GLU  78           H        GLU  78  69.476  -2.669  12.414
  631    HA   GLU  78           HA       GLU  78  69.360  -0.150  13.991
  632   1HB   GLU  78          2HB       GLU  78  71.399  -2.133  13.133
  633   2HB   GLU  78          1HB       GLU  78  71.946  -0.464  13.274
  634   1HG   GLU  78          2HG       GLU  78  70.946  -0.388  15.574
  635   2HG   GLU  78          1HG       GLU  78  70.579  -2.106  15.425
  636    H    VAL  79           H        VAL  79  69.436   1.824  13.010
  637    HA   VAL  79           HA       VAL  79  69.334   1.870  10.065
  638    HB   VAL  79           HB       VAL  79  67.633   2.961  11.518
  639   1HG1  VAL  79          1HG1      VAL  79  68.232   5.100  12.643
  640   2HG1  VAL  79          2HG1      VAL  79  69.927   4.805  12.266
  641   3HG1  VAL  79          3HG1      VAL  79  69.066   3.724  13.359
  642   1HG2  VAL  79          1HG2      VAL  79  67.853   3.800   9.279
  643   2HG2  VAL  79          2HG2      VAL  79  69.291   4.727   9.704
  644   3HG2  VAL  79          3HG2      VAL  79  67.716   5.203  10.338
  645    H    ILE  80           H        ILE  80  70.833   2.758   8.759
  646    HA   ILE  80           HA       ILE  80  73.141   4.245   9.954
  647    HB   ILE  80           HB       ILE  80  74.540   3.075   8.254
  648   1HG1  ILE  80          2HG1      ILE  80  72.018   1.504   7.643
  649   2HG1  ILE  80          1HG1      ILE  80  72.692   2.761   6.604
  650   1HG2  ILE  80          1HG2      ILE  80  74.697   1.046   9.426
  651   2HG2  ILE  80          2HG2      ILE  80  72.953   0.950   9.685
  652   3HG2  ILE  80          3HG2      ILE  80  73.920   2.111  10.598
  653   1HD1  ILE  80          1HD1      ILE  80  73.749   0.962   5.646
  654   2HD1  ILE  80          2HD1      ILE  80  73.680   0.002   7.123
  655   3HD1  ILE  80          3HD1      ILE  80  74.902   1.260   6.946
  656    H    GLU  81           H        GLU  81  74.098   5.784   8.412
  657    HA   GLU  81           HA       GLU  81  72.138   6.887   6.453
  658   1HB   GLU  81          2HB       GLU  81  73.108   8.328   8.247
  659   2HB   GLU  81          1HB       GLU  81  74.720   7.994   7.615
  660   1HG   GLU  81          2HG       GLU  81  74.044   8.972   5.433
  661   2HG   GLU  81          1HG       GLU  81  72.469   9.367   6.119
  662    H    VAL  82           H        VAL  82  72.542   6.633   4.309
  663    HA   VAL  82           HA       VAL  82  75.095   5.292   3.537
  664    HB   VAL  82           HB       VAL  82  72.267   5.175   2.429
  665   1HG1  VAL  82          1HG1      VAL  82  74.810   3.724   1.659
  666   2HG1  VAL  82          2HG1      VAL  82  73.789   4.728   0.628
  667   3HG1  VAL  82          3HG1      VAL  82  73.203   3.163   1.197
  668   1HG2  VAL  82          1HG2      VAL  82  72.235   4.011   4.476
  669   2HG2  VAL  82          2HG2      VAL  82  73.891   3.437   4.278
  670   3HG2  VAL  82          3HG2      VAL  82  72.594   2.740   3.306
  671    H    LEU  83           H        LEU  83  76.352   6.259   2.039
  672    HA   LEU  83           HA       LEU  83  75.251   8.560   0.450
  673   1HB   LEU  83          2HB       LEU  83  78.137   8.001   1.244
  674   2HB   LEU  83          1HB       LEU  83  77.489   9.501   0.592
  675    HG   LEU  83           HG       LEU  83  76.796   8.310   3.296
  676   1HD1  LEU  83          1HD1      LEU  83  78.389  10.795   2.605
  677   2HD1  LEU  83          2HD1      LEU  83  79.104   9.254   3.086
  678   3HD1  LEU  83          3HD1      LEU  83  78.089  10.149   4.219
  679   1HD2  LEU  83          1HD2      LEU  83  75.592  10.421   3.654
  680   2HD2  LEU  83          2HD2      LEU  83  74.948   9.573   2.249
  681   3HD2  LEU  83          3HD2      LEU  83  76.023  10.954   2.027
  682    H    LEU  84           H        LEU  84  75.314   8.224  -1.778
  683    HA   LEU  84           HA       LEU  84  76.672   5.857  -2.910
  684   1HB   LEU  84          2HB       LEU  84  74.886   8.072  -3.873
  685   2HB   LEU  84          1HB       LEU  84  75.796   7.122  -5.052
  686    HG   LEU  84           HG       LEU  84  74.332   5.643  -2.912
  687   1HD1  LEU  84          1HD1      LEU  84  72.562   5.871  -5.135
  688   2HD1  LEU  84          2HD1      LEU  84  73.010   7.509  -4.663
  689   3HD1  LEU  84          3HD1      LEU  84  72.297   6.416  -3.480
  690   1HD2  LEU  84          1HD2      LEU  84  74.149   4.797  -5.723
  691   2HD2  LEU  84          2HD2      LEU  84  74.690   3.892  -4.312
  692   3HD2  LEU  84          3HD2      LEU  84  75.812   4.955  -5.159
  693    H    LEU  85           H        LEU  85  78.597   5.932  -4.073
  694    HA   LEU  85           HA       LEU  85  80.103   8.508  -3.928
  695   1HB   LEU  85          2HB       LEU  85  80.710   5.608  -3.587
  696   2HB   LEU  85          1HB       LEU  85  81.998   6.632  -4.229
  697    HG   LEU  85           HG       LEU  85  80.432   7.377  -1.752
  698   1HD1  LEU  85          1HD1      LEU  85  81.563   5.164  -1.454
  699   2HD1  LEU  85          2HD1      LEU  85  82.236   6.424  -0.420
  700   3HD1  LEU  85          3HD1      LEU  85  83.094   5.928  -1.879
  701   1HD2  LEU  85          1HD2      LEU  85  82.753   8.563  -1.411
  702   2HD2  LEU  85          2HD2      LEU  85  81.580   9.269  -2.524
  703   3HD2  LEU  85          3HD2      LEU  85  82.927   8.317  -3.149
  704    H    GLY  86           H        GLY  86  79.159   5.873  -6.102
  705   1HA   GLY  86          2HA       GLY  86  79.775   7.507  -8.455
  706   2HA   GLY  86          1HA       GLY  86  80.930   6.199  -8.230
  707    H    HIS  87           H        HIS  87  79.693   5.962 -10.507
  708    HA   HIS  87           HA       HIS  87  77.691   3.778 -10.100
  709   1HB   HIS  87          2HB       HIS  87  76.328   4.805 -11.919
  710   2HB   HIS  87          1HB       HIS  87  76.488   5.889 -10.544
  711    HD1  HIS  87           HD1      HIS  87  77.705   5.400 -14.077
  712    HD2  HIS  87           HD2      HIS  87  77.943   8.261 -11.054
  713    HE1  HIS  87           HE1      HIS  87  78.700   7.477 -15.132
  714    H    TYR  88           H        TYR  88  77.854   2.119 -11.704
  715    HA   TYR  88           HA       TYR  88  79.940   2.518 -13.821
  716   1HB   TYR  88          2HB       TYR  88  79.500   0.044 -12.111
  717   2HB   TYR  88          1HB       TYR  88  80.772   0.270 -13.305
  718    HD1  TYR  88           HD1      TYR  88  81.648   3.106 -12.721
  719    HD2  TYR  88           HD2      TYR  88  80.645  -0.179 -10.038
  720    HE1  TYR  88           HE1      TYR  88  83.104   4.117 -10.936
  721    HE2  TYR  88           HE2      TYR  88  82.105   0.831  -8.258
  722    HH   TYR  88           HH       TYR  88  84.193   2.460  -8.276
  723    H    LYS  89           H        LYS  89  79.410   1.619 -15.816
  724    HA   LYS  89           HA       LYS  89  76.844   0.069 -15.991
  725   1HB   LYS  89          2HB       LYS  89  77.890   2.478 -17.384
  726   2HB   LYS  89          1HB       LYS  89  77.051   1.304 -18.400
  727   1HG   LYS  89          2HG       LYS  89  75.312   1.373 -16.362
  728   2HG   LYS  89          1HG       LYS  89  75.992   2.991 -16.180
  729   1HD   LYS  89          2HD       LYS  89  75.461   3.515 -18.507
  730   2HD   LYS  89          1HD       LYS  89  74.868   1.874 -18.765
  731   1HE   LYS  89          2HE       LYS  89  72.871   3.041 -18.334
  732   2HE   LYS  89          1HE       LYS  89  73.291   2.454 -16.712
  733   1HZ   LYS  89          1HZ       LYS  89  74.095   5.080 -17.849
  734   2HZ   LYS  89          2HZ       LYS  89  74.468   4.511 -16.293
  735   3HZ   LYS  89          3HZ       LYS  89  72.858   4.850 -16.712
  736    HA   PRO  90           HA       PRO  90  79.062  -3.149 -18.090
  737   1HB   PRO  90          2HB       PRO  90  76.936  -2.946 -20.201
  738   2HB   PRO  90          1HB       PRO  90  77.518  -4.380 -19.325
  739   1HG   PRO  90          2HG       PRO  90  75.220  -3.353 -18.643
  740   2HG   PRO  90          1HG       PRO  90  76.374  -3.793 -17.368
  741   1HD   PRO  90          2HD       PRO  90  75.762  -1.078 -18.490
  742   2HD   PRO  90          1HD       PRO  90  75.948  -1.578 -16.791
  743    H    ARG  91           H        ARG  91  80.730  -3.170 -19.600
  744    HA   ARG  91           HA       ARG  91  80.629  -1.222 -21.868
  745   1HB   ARG  91          2HB       ARG  91  82.963  -0.592 -21.304
  746   2HB   ARG  91          1HB       ARG  91  81.864  -0.245 -19.970
  747   1HG   ARG  91          2HG       ARG  91  82.507  -2.486 -18.980
  748   2HG   ARG  91          1HG       ARG  91  83.757  -2.599 -20.221
  749   1HD   ARG  91          2HD       ARG  91  84.692  -0.412 -19.415
  750   2HD   ARG  91          1HD       ARG  91  83.512  -0.447 -18.089
  751    HE   ARG  91           HE       ARG  91  85.864  -2.173 -18.335
  752   1HH1  ARG  91          1HH1      ARG  91  82.660  -1.843 -16.941
  753   2HH1  ARG  91          2HH1      ARG  91  82.997  -2.968 -15.672
  754   1HH2  ARG  91          1HH2      ARG  91  86.239  -3.616 -16.675
  755   2HH2  ARG  91          2HH2      ARG  91  84.994  -3.959 -15.521
  756    H    ASN  92           H        ASN  92  82.092  -1.814 -23.639
  757    HA   ASN  92           HA       ASN  92  82.695  -4.751 -23.706
  758   1HB   ASN  92          2HB       ASN  92  80.950  -3.609 -25.231
  759   2HB   ASN  92          1HB       ASN  92  82.331  -2.880 -26.052
  760   1HD2  ASN  92          1HD2      ASN  92  81.763  -4.179 -28.002
  761   2HD2  ASN  92          2HD2      ASN  92  82.165  -5.826 -28.067
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1  84.087  15.586  -0.683
    2   2H    MET   1          2H        MET   1  84.946  14.674   0.464
    3   3H    MET   1          3H        MET   1  83.332  15.112   0.760
    4    HA   MET   1           HA       MET   1  84.322  13.183  -1.276
    5   1HB   MET   1          2HB       MET   1  84.184  12.538   1.146
    6   2HB   MET   1          1HB       MET   1  82.468  12.948   1.117
    7   1HG   MET   1          2HG       MET   1  82.141  11.289  -0.718
    8   2HG   MET   1          1HG       MET   1  83.837  10.829  -0.566
    9   1HE   MET   1          1HE       MET   1  80.691  11.563   0.967
   10   2HE   MET   1          2HE       MET   1  80.953  11.249   2.681
   11   3HE   MET   1          3HE       MET   1  80.183  10.024   1.677
   12    H    ASP   2           H        ASP   2  83.156  13.408  -3.137
   13    HA   ASP   2           HA       ASP   2  80.621  14.829  -3.290
   14   1HB   ASP   2          2HB       ASP   2  82.130  13.029  -5.216
   15   2HB   ASP   2          1HB       ASP   2  80.745  14.023  -5.663
   16    H    VAL   3           H        VAL   3  78.540  13.946  -3.462
   17    HA   VAL   3           HA       VAL   3  78.294  10.982  -3.248
   18    HB   VAL   3           HB       VAL   3  77.991  12.430  -1.127
   19   1HG1  VAL   3          1HG1      VAL   3  75.266  12.972  -2.320
   20   2HG1  VAL   3          2HG1      VAL   3  76.563  14.171  -2.307
   21   3HG1  VAL   3          3HG1      VAL   3  75.908  13.565  -0.785
   22   1HG2  VAL   3          1HG2      VAL   3  77.278  10.126  -1.163
   23   2HG2  VAL   3          2HG2      VAL   3  75.835  10.537  -2.089
   24   3HG2  VAL   3          3HG2      VAL   3  75.989  11.072  -0.415
   25    H    LEU   4           H        LEU   4  76.796  10.106  -4.655
   26    HA   LEU   4           HA       LEU   4  75.501  11.896  -6.609
   27   1HB   LEU   4          2HB       LEU   4  75.405   8.874  -6.340
   28   2HB   LEU   4          1HB       LEU   4  75.042   9.813  -7.782
   29    HG   LEU   4           HG       LEU   4  77.751   9.494  -6.444
   30   1HD1  LEU   4          1HD1      LEU   4  78.253   8.690  -8.865
   31   2HD1  LEU   4          2HD1      LEU   4  76.503   8.528  -9.007
   32   3HD1  LEU   4          3HD1      LEU   4  77.377   7.604  -7.785
   33   1HD2  LEU   4          1HD2      LEU   4  78.444  10.819  -8.616
   34   2HD2  LEU   4          2HD2      LEU   4  77.885  11.710  -7.196
   35   3HD2  LEU   4          3HD2      LEU   4  76.787  11.421  -8.549
   36    H    ALA   5           H        ALA   5  74.647  10.239  -3.673
   37    HA   ALA   5           HA       ALA   5  72.079  11.498  -3.521
   38   1HB   ALA   5          1HB       ALA   5  71.675   8.557  -3.706
   39   2HB   ALA   5          2HB       ALA   5  72.033   9.371  -5.228
   40   3HB   ALA   5          3HB       ALA   5  70.636   9.865  -4.271
   41    H    LYS   6           H        LYS   6  71.148  11.124  -1.407
   42    HA   LYS   6           HA       LYS   6  72.748   9.357   0.413
   43   1HB   LYS   6          2HB       LYS   6  73.517  11.701   0.515
   44   2HB   LYS   6          1HB       LYS   6  71.869  12.232   0.849
   45   1HG   LYS   6          2HG       LYS   6  71.854  11.247   2.990
   46   2HG   LYS   6          1HG       LYS   6  73.212  10.189   2.613
   47   1HD   LYS   6          2HD       LYS   6  73.970  12.000   4.073
   48   2HD   LYS   6          1HD       LYS   6  74.693  12.189   2.476
   49   1HE   LYS   6          2HE       LYS   6  73.539  14.120   2.041
   50   2HE   LYS   6          1HE       LYS   6  72.080  13.555   2.881
   51   1HZ   LYS   6          1HZ       LYS   6  74.602  14.528   4.109
   52   2HZ   LYS   6          2HZ       LYS   6  73.383  13.732   4.986
   53   3HZ   LYS   6          3HZ       LYS   6  73.061  15.225   4.240
   54    H    PHE   7           H        PHE   7  71.440   8.054   1.603
   55    HA   PHE   7           HA       PHE   7  68.706   8.954   2.356
   56   1HB   PHE   7          2HB       PHE   7  67.723   6.957   1.286
   57   2HB   PHE   7          1HB       PHE   7  68.573   7.948   0.104
   58    HD1  PHE   7           HD1      PHE   7  68.234   4.646   1.511
   59    HD2  PHE   7           HD2      PHE   7  71.081   7.316  -0.425
   60    HE1  PHE   7           HE1      PHE   7  69.657   2.671   0.871
   61    HE2  PHE   7           HE2      PHE   7  72.505   5.340  -1.054
   62    HZ   PHE   7           HZ       PHE   7  71.791   3.016  -0.401
   63    H    HIS   8           H        HIS   8  67.693   7.425   3.928
   64    HA   HIS   8           HA       HIS   8  69.794   6.096   5.620
   65   1HB   HIS   8          2HB       HIS   8  67.091   7.340   6.256
   66   2HB   HIS   8          1HB       HIS   8  68.174   6.625   7.449
   67    HD1  HIS   8           HD1      HIS   8  67.504   9.584   7.736
   68    HD2  HIS   8           HD2      HIS   8  70.768   8.213   5.536
   69    HE1  HIS   8           HE1      HIS   8  69.141  11.511   7.608
   70    H    THR   9           H        THR   9  69.506   3.957   6.168
   71    HA   THR   9           HA       THR   9  66.867   2.656   5.891
   72    HB   THR   9           HB       THR   9  67.988   2.618   3.633
   73    HG1  THR   9           HG1      THR   9  67.660   0.388   3.357
   74   1HG2  THR   9          1HG2      THR   9  70.022   0.899   5.082
   75   2HG2  THR   9          2HG2      THR   9  70.326   2.486   4.372
   76   3HG2  THR   9          3HG2      THR   9  69.936   1.115   3.333
   77    H    THR  10           H        THR  10  66.940   0.415   6.870
   78    HA   THR  10           HA       THR  10  69.167   0.202   8.855
   79    HB   THR  10           HB       THR  10  66.758   0.609   9.636
   80    HG1  THR  10           HG1      THR  10  67.474  -0.257  11.371
   81   1HG2  THR  10          1HG2      THR  10  66.143  -2.252   9.530
   82   2HG2  THR  10          2HG2      THR  10  66.128  -1.482   7.939
   83   3HG2  THR  10          3HG2      THR  10  65.090  -0.867   9.226
   84    H    VAL  11           H        VAL  11  69.919  -1.983   9.341
   85    HA   VAL  11           HA       VAL  11  70.279  -3.536   6.898
   86    HB   VAL  11           HB       VAL  11  71.147  -4.028   9.770
   87   1HG1  VAL  11          1HG1      VAL  11  72.425  -5.770   9.026
   88   2HG1  VAL  11          2HG1      VAL  11  72.772  -4.991   7.482
   89   3HG1  VAL  11          3HG1      VAL  11  71.240  -5.826   7.722
   90   1HG2  VAL  11          1HG2      VAL  11  72.024  -2.128   7.711
   91   2HG2  VAL  11          2HG2      VAL  11  73.340  -3.148   8.285
   92   3HG2  VAL  11          3HG2      VAL  11  72.416  -2.179   9.429
   93    H    HIS  12           H        HIS  12  69.315  -5.433   6.354
   94    HA   HIS  12           HA       HIS  12  67.459  -6.724   8.322
   95   1HB   HIS  12          2HB       HIS  12  67.350  -6.244   5.363
   96   2HB   HIS  12          1HB       HIS  12  66.540  -7.667   6.026
   97    HD1  HIS  12           HD1      HIS  12  66.762  -3.958   6.954
   98    HD2  HIS  12           HD2      HIS  12  63.967  -7.045   6.774
   99    HE1  HIS  12           HE1      HIS  12  64.552  -2.965   7.691
  100    H    ARG  13           H        ARG  13  67.233  -9.138   7.781
  101    HA   ARG  13           HA       ARG  13  69.512 -10.557   8.398
  102   1HB   ARG  13          2HB       ARG  13  67.121 -11.287   6.698
  103   2HB   ARG  13          1HB       ARG  13  68.267 -12.494   7.294
  104   1HG   ARG  13          2HG       ARG  13  67.828 -11.684   9.622
  105   2HG   ARG  13          1HG       ARG  13  66.593 -10.603   8.976
  106   1HD   ARG  13          2HD       ARG  13  65.444 -12.628   7.985
  107   2HD   ARG  13          1HD       ARG  13  66.596 -13.638   8.883
  108    HE   ARG  13           HE       ARG  13  65.508 -13.029  10.893
  109   1HH1  ARG  13          1HH1      ARG  13  64.500 -10.892   8.298
  110   2HH1  ARG  13          2HH1      ARG  13  63.280 -10.142   9.264
  111   1HH2  ARG  13          1HH2      ARG  13  63.917 -12.024  12.093
  112   2HH2  ARG  13          2HH2      ARG  13  62.952 -10.773  11.385
  113    H    ILE  14           H        ILE  14  71.069 -11.793   7.242
  114    HA   ILE  14           HA       ILE  14  72.657 -12.231   5.567
  115    HB   ILE  14           HB       ILE  14  70.480 -11.286   3.674
  116   1HG1  ILE  14          2HG1      ILE  14  71.080 -14.130   4.525
  117   2HG1  ILE  14          1HG1      ILE  14  69.828 -13.155   5.296
  118   1HG2  ILE  14          1HG2      ILE  14  73.111 -12.661   3.385
  119   2HG2  ILE  14          2HG2      ILE  14  72.331 -11.493   2.319
  120   3HG2  ILE  14          3HG2      ILE  14  71.798 -13.174   2.327
  121   1HD1  ILE  14          1HD1      ILE  14  68.538 -14.113   3.649
  122   2HD1  ILE  14          2HD1      ILE  14  69.903 -14.317   2.553
  123   3HD1  ILE  14          3HD1      ILE  14  69.147 -12.732   2.734
  124    H    GLY  15           H        GLY  15  71.785  -9.173   6.451
  125   1HA   GLY  15          2HA       GLY  15  73.009  -7.175   6.247
  126   2HA   GLY  15          1HA       GLY  15  74.087  -7.999   5.125
  127    H    ARG  16           H        ARG  16  70.731  -8.264   4.327
  128    HA   ARG  16           HA       ARG  16  71.185  -6.706   1.881
  129   1HB   ARG  16          2HB       ARG  16  70.044  -8.905   1.938
  130   2HB   ARG  16          1HB       ARG  16  68.788  -8.223   2.971
  131   1HG   ARG  16          2HG       ARG  16  68.107  -6.685   1.216
  132   2HG   ARG  16          1HG       ARG  16  69.447  -7.202   0.192
  133   1HD   ARG  16          2HD       ARG  16  67.429  -8.361  -0.547
  134   2HD   ARG  16          1HD       ARG  16  68.476  -9.546   0.259
  135    HE   ARG  16           HE       ARG  16  66.929  -9.643   2.047
  136   1HH1  ARG  16          1HH1      ARG  16  66.240  -6.861   0.024
  137   2HH1  ARG  16          2HH1      ARG  16  64.768  -6.504   0.856
  138   1HH2  ARG  16          1HH2      ARG  16  65.020  -9.135   3.082
  139   2HH2  ARG  16          2HH2      ARG  16  64.083  -7.773   2.564
  140    H    ILE  17           H        ILE  17  70.187  -4.750   1.373
  141    HA   ILE  17           HA       ILE  17  68.232  -3.613   3.324
  142    HB   ILE  17           HB       ILE  17  69.387  -1.427   3.110
  143   1HG1  ILE  17          2HG1      ILE  17  71.580  -2.924   1.649
  144   2HG1  ILE  17          1HG1      ILE  17  70.341  -1.996   0.807
  145   1HG2  ILE  17          1HG2      ILE  17  70.088  -3.421   4.734
  146   2HG2  ILE  17          2HG2      ILE  17  70.996  -1.910   4.693
  147   3HG2  ILE  17          3HG2      ILE  17  71.589  -3.320   3.815
  148   1HD1  ILE  17          1HD1      ILE  17  71.632  -0.539   3.024
  149   2HD1  ILE  17          2HD1      ILE  17  71.272  -0.001   1.383
  150   3HD1  ILE  17          3HD1      ILE  17  72.721  -0.956   1.701
  151    H    ILE  18           H        ILE  18  66.756  -2.057   2.306
  152    HA   ILE  18           HA       ILE  18  66.696  -2.255  -0.692
  153    HB   ILE  18           HB       ILE  18  64.406  -1.874   1.269
  154   1HG1  ILE  18          2HG1      ILE  18  65.351  -4.134   1.482
  155   2HG1  ILE  18          1HG1      ILE  18  63.790  -4.209   0.672
  156   1HG2  ILE  18          1HG2      ILE  18  64.609  -2.074  -1.726
  157   2HG2  ILE  18          2HG2      ILE  18  63.673  -0.941  -0.746
  158   3HG2  ILE  18          3HG2      ILE  18  63.144  -2.618  -0.905
  159   1HD1  ILE  18          1HD1      ILE  18  65.455  -3.913  -1.470
  160   2HD1  ILE  18          2HD1      ILE  18  64.922  -5.476  -0.852
  161   3HD1  ILE  18          3HD1      ILE  18  66.490  -4.825  -0.369
  162    H    ILE  19           H        ILE  19  66.902  -0.322  -1.734
  163    HA   ILE  19           HA       ILE  19  66.971   2.205  -0.216
  164    HB   ILE  19           HB       ILE  19  67.149   1.575  -3.198
  165   1HG1  ILE  19          2HG1      ILE  19  69.256   1.920  -1.021
  166   2HG1  ILE  19          1HG1      ILE  19  68.924   0.458  -1.937
  167   1HG2  ILE  19          1HG2      ILE  19  66.526   3.941  -2.600
  168   2HG2  ILE  19          2HG2      ILE  19  68.093   3.820  -3.399
  169   3HG2  ILE  19          3HG2      ILE  19  68.010   4.054  -1.653
  170   1HD1  ILE  19          1HD1      ILE  19  69.431   2.419  -3.880
  171   2HD1  ILE  19          2HD1      ILE  19  70.516   1.119  -3.387
  172   3HD1  ILE  19          3HD1      ILE  19  70.631   2.703  -2.617
  173    HA   PRO  20           HA       PRO  20  62.650   3.185  -0.902
  174   1HB   PRO  20          2HB       PRO  20  62.839   5.915  -1.030
  175   2HB   PRO  20          1HB       PRO  20  62.894   5.023   0.500
  176   1HG   PRO  20          2HG       PRO  20  65.179   5.986  -1.189
  177   2HG   PRO  20          1HG       PRO  20  64.922   6.203   0.554
  178   1HD   PRO  20          2HD       PRO  20  66.549   4.303  -0.280
  179   2HD   PRO  20          1HD       PRO  20  65.382   3.941   1.021
  180    H    ALA  21           H        ALA  21  61.438   3.528  -2.765
  181    HA   ALA  21           HA       ALA  21  62.654   3.381  -5.317
  182   1HB   ALA  21          1HB       ALA  21  60.425   2.675  -5.170
  183   2HB   ALA  21          2HB       ALA  21  60.248   4.229  -5.985
  184   3HB   ALA  21          3HB       ALA  21  59.932   4.100  -4.255
  185    H    GLY  22           H        GLY  22  61.826   6.180  -3.347
  186   1HA   GLY  22          2HA       GLY  22  61.866   8.170  -5.429
  187   2HA   GLY  22          1HA       GLY  22  62.144   8.487  -3.714
  188    H    THR  23           H        THR  23  64.434   6.914  -3.290
  189    HA   THR  23           HA       THR  23  66.503   8.656  -4.319
  190    HB   THR  23           HB       THR  23  66.615   5.964  -2.909
  191    HG1  THR  23           HG1      THR  23  65.546   7.818  -1.862
  192   1HG2  THR  23          1HG2      THR  23  68.698   7.814  -3.878
  193   2HG2  THR  23          2HG2      THR  23  68.824   6.115  -3.419
  194   3HG2  THR  23          3HG2      THR  23  68.860   7.368  -2.178
  195    H    ARG  24           H        ARG  24  65.417   5.363  -5.167
  196    HA   ARG  24           HA       ARG  24  67.447   4.666  -7.065
  197   1HB   ARG  24          2HB       ARG  24  64.494   4.097  -7.435
  198   2HB   ARG  24          1HB       ARG  24  65.854   3.101  -7.934
  199   1HG   ARG  24          2HG       ARG  24  66.350   3.044  -5.331
  200   2HG   ARG  24          1HG       ARG  24  64.634   3.423  -5.227
  201   1HD   ARG  24          2HD       ARG  24  64.455   1.454  -7.023
  202   2HD   ARG  24          1HD       ARG  24  65.957   0.947  -6.217
  203    HE   ARG  24           HE       ARG  24  64.389   1.551  -4.083
  204   1HH1  ARG  24          1HH1      ARG  24  63.724  -0.384  -6.932
  205   2HH1  ARG  24          2HH1      ARG  24  62.580  -1.375  -6.101
  206   1HH2  ARG  24          1HH2      ARG  24  62.929   0.236  -3.064
  207   2HH2  ARG  24          2HH2      ARG  24  62.133  -1.034  -3.933
  208    H    LYS  25           H        LYS  25  64.472   6.553  -7.408
  209    HA   LYS  25           HA       LYS  25  64.556   6.931 -10.244
  210   1HB   LYS  25          2HB       LYS  25  62.594   7.261  -8.754
  211   2HB   LYS  25          1HB       LYS  25  63.388   8.658  -8.030
  212   1HG   LYS  25          2HG       LYS  25  63.431   9.768 -10.234
  213   2HG   LYS  25          1HG       LYS  25  62.611   8.377 -10.945
  214   1HD   LYS  25          2HD       LYS  25  60.724   8.739  -9.335
  215   2HD   LYS  25          1HD       LYS  25  61.526  10.214  -8.793
  216   1HE   LYS  25          2HE       LYS  25  61.546  10.785 -11.384
  217   2HE   LYS  25          1HE       LYS  25  60.183   9.649 -11.415
  218   1HZ   LYS  25          1HZ       LYS  25  59.527  11.976 -10.899
  219   2HZ   LYS  25          2HZ       LYS  25  60.441  11.878  -9.469
  220   3HZ   LYS  25          3HZ       LYS  25  59.096  10.864  -9.693
  221    H    PHE  26           H        PHE  26  65.585   9.087  -7.587
  222    HA   PHE  26           HA       PHE  26  66.613  11.230  -9.153
  223   1HB   PHE  26          2HB       PHE  26  66.205  11.213  -6.697
  224   2HB   PHE  26          1HB       PHE  26  67.584  10.137  -6.491
  225    HD1  PHE  26           HD1      PHE  26  69.831  10.974  -6.401
  226    HD2  PHE  26           HD2      PHE  26  66.576  13.544  -7.735
  227    HE1  PHE  26           HE1      PHE  26  71.379  12.956  -6.362
  228    HE2  PHE  26           HE2      PHE  26  68.122  15.526  -7.696
  229    HZ   PHE  26           HZ       PHE  26  70.524  15.232  -7.009
  230    H    TYR  27           H        TYR  27  68.155   8.222  -8.088
  231    HA   TYR  27           HA       TYR  27  70.780   8.988  -9.173
  232   1HB   TYR  27          2HB       TYR  27  70.347   7.720  -7.063
  233   2HB   TYR  27          1HB       TYR  27  69.725   6.389  -8.022
  234    HD1  TYR  27           HD1      TYR  27  72.651   7.898  -6.571
  235    HD2  TYR  27           HD2      TYR  27  71.338   5.365  -9.858
  236    HE1  TYR  27           HE1      TYR  27  74.982   6.989  -6.810
  237    HE2  TYR  27           HE2      TYR  27  73.666   4.457 -10.092
  238    HH   TYR  27           HH       TYR  27  75.698   4.203  -8.690
  239    H    GLY  28           H        GLY  28  67.958   7.404 -10.451
  240   1HA   GLY  28          2HA       GLY  28  67.600   6.580 -12.624
  241   2HA   GLY  28          1HA       GLY  28  69.274   6.992 -13.002
  242    H    ILE  29           H        ILE  29  68.042   4.816 -10.455
  243    HA   ILE  29           HA       ILE  29  70.003   2.777 -11.278
  244    HB   ILE  29           HB       ILE  29  67.960   2.885  -9.029
  245   1HG1  ILE  29          2HG1      ILE  29  70.938   3.461  -9.026
  246   2HG1  ILE  29          1HG1      ILE  29  69.677   4.688  -9.004
  247   1HG2  ILE  29          1HG2      ILE  29  69.931   1.253  -8.139
  248   2HG2  ILE  29          2HG2      ILE  29  70.000   0.888  -9.862
  249   3HG2  ILE  29          3HG2      ILE  29  68.496   0.657  -8.972
  250   1HD1  ILE  29          1HD1      ILE  29  70.693   3.019  -6.814
  251   2HD1  ILE  29          2HD1      ILE  29  68.930   3.023  -6.923
  252   3HD1  ILE  29          3HD1      ILE  29  69.804   4.544  -6.747
  253    H    GLU  30           H        GLU  30  69.533   1.059 -12.515
  254    HA   GLU  30           HA       GLU  30  66.727   0.019 -12.580
  255   1HB   GLU  30          2HB       GLU  30  67.347   1.291 -14.660
  256   2HB   GLU  30          1HB       GLU  30  68.677   0.158 -14.907
  257   1HG   GLU  30          2HG       GLU  30  66.823  -0.609 -16.246
  258   2HG   GLU  30          1HG       GLU  30  66.981  -1.711 -14.880
  259    H    GLN  31           H        GLN  31  66.672  -2.337 -12.846
  260    HA   GLN  31           HA       GLN  31  68.588  -3.801 -11.365
  261   1HB   GLN  31          2HB       GLN  31  66.643  -4.622 -13.542
  262   2HB   GLN  31          1HB       GLN  31  67.481  -5.774 -12.502
  263   1HG   GLN  31          2HG       GLN  31  66.476  -4.788 -10.516
  264   2HG   GLN  31          1HG       GLN  31  65.724  -3.522 -11.487
  265   1HE2  GLN  31          1HE2      GLN  31  63.736  -4.612 -10.302
  266   2HE2  GLN  31          2HE2      GLN  31  62.976  -5.873 -11.148
  267    H    GLY  32           H        GLY  32  70.494  -4.844 -11.895
  268   1HA   GLY  32          2HA       GLY  32  72.073  -5.889 -13.378
  269   2HA   GLY  32          1HA       GLY  32  71.272  -5.114 -14.742
  270    H    ASP  33           H        ASP  33  71.392  -2.508 -12.913
  271    HA   ASP  33           HA       ASP  33  73.898  -1.504 -14.058
  272   1HB   ASP  33          2HB       ASP  33  71.822  -0.391 -12.148
  273   2HB   ASP  33          1HB       ASP  33  73.173   0.550 -12.773
  274    H    PHE  34           H        PHE  34  75.667  -0.624 -12.719
  275    HA   PHE  34           HA       PHE  34  75.911  -1.972 -10.048
  276   1HB   PHE  34          2HB       PHE  34  77.925  -1.114 -12.145
  277   2HB   PHE  34          1HB       PHE  34  78.391  -1.621 -10.522
  278    HD1  PHE  34           HD1      PHE  34  76.910  -2.716 -13.760
  279    HD2  PHE  34           HD2      PHE  34  78.183  -3.958  -9.783
  280    HE1  PHE  34           HE1      PHE  34  76.763  -5.125 -14.466
  281    HE2  PHE  34           HE2      PHE  34  78.033  -6.369 -10.489
  282    HZ   PHE  34           HZ       PHE  34  77.323  -6.952 -12.830
  283    H    VAL  35           H        VAL  35  76.293  -0.633  -8.295
  284    HA   VAL  35           HA       VAL  35  76.985   2.223  -8.846
  285    HB   VAL  35           HB       VAL  35  75.396   2.859  -7.039
  286   1HG1  VAL  35          1HG1      VAL  35  73.464   2.730  -8.379
  287   2HG1  VAL  35          2HG1      VAL  35  73.886   1.134  -8.998
  288   3HG1  VAL  35          3HG1      VAL  35  74.771   2.556  -9.551
  289   1HG2  VAL  35          1HG2      VAL  35  75.345   0.865  -5.691
  290   2HG2  VAL  35          2HG2      VAL  35  74.813  -0.114  -7.057
  291   3HG2  VAL  35          3HG2      VAL  35  73.721   1.079  -6.349
  292    H    GLU  36           H        GLU  36  78.249   3.192  -7.116
  293    HA   GLU  36           HA       GLU  36  79.571   1.169  -5.332
  294   1HB   GLU  36          2HB       GLU  36  80.917   2.177  -7.206
  295   2HB   GLU  36          1HB       GLU  36  80.639   3.768  -6.498
  296   1HG   GLU  36          2HG       GLU  36  81.704   2.975  -4.385
  297   2HG   GLU  36          1HG       GLU  36  82.059   1.439  -5.171
  298    H    ILE  37           H        ILE  37  79.144   1.520  -3.217
  299    HA   ILE  37           HA       ILE  37  78.253   4.252  -2.386
  300    HB   ILE  37           HB       ILE  37  76.414   2.771  -3.101
  301   1HG1  ILE  37          2HG1      ILE  37  76.203   2.793  -0.113
  302   2HG1  ILE  37          1HG1      ILE  37  76.368   4.327  -0.965
  303   1HG2  ILE  37          1HG2      ILE  37  77.455   0.925  -0.932
  304   2HG2  ILE  37          2HG2      ILE  37  77.451   0.604  -2.667
  305   3HG2  ILE  37          3HG2      ILE  37  75.926   0.715  -1.786
  306   1HD1  ILE  37          1HD1      ILE  37  74.447   2.885  -2.440
  307   2HD1  ILE  37          2HD1      ILE  37  74.151   4.251  -1.367
  308   3HD1  ILE  37          3HD1      ILE  37  74.042   2.606  -0.745
  309    H    LYS  38           H        LYS  38  78.282   4.588  -0.045
  310    HA   LYS  38           HA       LYS  38  79.942   2.649   1.514
  311   1HB   LYS  38          2HB       LYS  38  81.180   4.677   0.574
  312   2HB   LYS  38          1HB       LYS  38  80.182   5.666   1.648
  313   1HG   LYS  38          2HG       LYS  38  80.984   4.399   3.589
  314   2HG   LYS  38          1HG       LYS  38  81.951   3.370   2.532
  315   1HD   LYS  38          2HD       LYS  38  83.190   5.406   1.765
  316   2HD   LYS  38          1HD       LYS  38  82.285   6.358   2.941
  317   1HE   LYS  38          2HE       LYS  38  83.208   4.321   4.529
  318   2HE   LYS  38          1HE       LYS  38  84.548   4.510   3.379
  319   1HZ   LYS  38          1HZ       LYS  38  84.729   6.070   5.244
  320   2HZ   LYS  38          2HZ       LYS  38  83.220   6.735   4.836
  321   3HZ   LYS  38          3HZ       LYS  38  84.533   6.881   3.767
  322    H    ILE  39           H        ILE  39  79.363   2.491   3.711
  323    HA   ILE  39           HA       ILE  39  76.902   4.004   4.536
  324    HB   ILE  39           HB       ILE  39  76.506   2.009   5.998
  325   1HG1  ILE  39          2HG1      ILE  39  78.734   0.679   4.440
  326   2HG1  ILE  39          1HG1      ILE  39  79.005   1.407   6.023
  327   1HG2  ILE  39          1HG2      ILE  39  76.589   1.959   3.040
  328   2HG2  ILE  39          2HG2      ILE  39  75.238   1.683   4.142
  329   3HG2  ILE  39          3HG2      ILE  39  76.397   0.391   3.827
  330   1HD1  ILE  39          1HD1      ILE  39  78.475  -0.733   6.692
  331   2HD1  ILE  39          2HD1      ILE  39  77.438  -1.027   5.297
  332   3HD1  ILE  39          3HD1      ILE  39  76.851  -0.048   6.642
  333    H    VAL  40           H        VAL  40  76.827   4.787   6.687
  334    HA   VAL  40           HA       VAL  40  79.315   4.570   8.326
  335    HB   VAL  40           HB       VAL  40  77.789   7.114   7.654
  336   1HG1  VAL  40          1HG1      VAL  40  79.502   8.264   8.941
  337   2HG1  VAL  40          2HG1      VAL  40  80.367   6.752   9.216
  338   3HG1  VAL  40          3HG1      VAL  40  78.790   7.013   9.959
  339   1HG2  VAL  40          1HG2      VAL  40  80.366   5.907   6.662
  340   2HG2  VAL  40          2HG2      VAL  40  80.170   7.659   6.695
  341   3HG2  VAL  40          3HG2      VAL  40  79.071   6.667   5.737
  342    H    LYS  41           H        LYS  41  78.772   4.029  10.389
  343    HA   LYS  41           HA       LYS  41  76.129   4.885  11.495
  344   1HB   LYS  41          2HB       LYS  41  76.077   2.527  10.621
  345   2HB   LYS  41          1HB       LYS  41  77.368   2.127  11.756
  346   1HG   LYS  41          2HG       LYS  41  75.894   2.935  13.622
  347   2HG   LYS  41          1HG       LYS  41  74.591   3.123  12.448
  348   1HD   LYS  41          2HD       LYS  41  74.858   0.701  11.852
  349   2HD   LYS  41          1HD       LYS  41  76.025   0.552  13.166
  350   1HE   LYS  41          2HE       LYS  41  73.134   1.444  13.491
  351   2HE   LYS  41          1HE       LYS  41  73.778  -0.152  13.924
  352   1HZ   LYS  41          1HZ       LYS  41  75.463   1.056  15.295
  353   2HZ   LYS  41          2HZ       LYS  41  73.871   1.169  15.874
  354   3HZ   LYS  41          3HZ       LYS  41  74.572   2.477  15.047
  355    H    TYR  42           H        TYR  42  76.204   5.273  13.762
  356    HA   TYR  42           HA       TYR  42  78.964   5.538  14.869
  357   1HB   TYR  42          2HB       TYR  42  77.041   7.349  14.642
  358   2HB   TYR  42          1HB       TYR  42  76.476   6.623  16.148
  359    HD1  TYR  42           HD1      TYR  42  79.780   7.636  14.603
  360    HD2  TYR  42           HD2      TYR  42  77.238   7.641  18.137
  361    HE1  TYR  42           HE1      TYR  42  81.545   8.908  15.864
  362    HE2  TYR  42           HE2      TYR  42  79.000   8.916  19.403
  363    HH   TYR  42           HH       TYR  42  82.118   9.120  18.542
  364    H    GLU  43           H        GLU  43  79.642   4.180  16.488
  365    HA   GLU  43           HA       GLU  43  77.574   2.850  18.200
  366   1HB   GLU  43          2HB       GLU  43  80.017   1.615  16.887
  367   2HB   GLU  43          1HB       GLU  43  78.969   0.785  18.039
  368   1HG   GLU  43          2HG       GLU  43  77.038   1.191  16.506
  369   2HG   GLU  43          1HG       GLU  43  78.153   1.886  15.334
  370    H    GLY  44           H        GLY  44  78.068   3.019  20.355
  371   1HA   GLY  44          2HA       GLY  44  79.245   3.555  22.312
  372   2HA   GLY  44          1HA       GLY  44  80.678   2.935  21.492
  373    H    GLU  45           H        GLU  45  82.242   4.457  21.606
  374    HA   GLU  45           HA       GLU  45  81.498   7.331  21.274
  375   1HB   GLU  45          2HB       GLU  45  83.604   7.777  22.427
  376   2HB   GLU  45          1HB       GLU  45  82.676   6.596  23.345
  377   1HG   GLU  45          2HG       GLU  45  84.032   4.768  22.364
  378   2HG   GLU  45          1HG       GLU  45  84.959   5.952  21.447
  379    H    GLU  46           H        GLU  46  82.334   4.958  19.196
  380    HA   GLU  46           HA       GLU  46  84.128   6.760  17.618
  381   1HB   GLU  46          2HB       GLU  46  85.331   4.700  16.921
  382   2HB   GLU  46          1HB       GLU  46  85.385   4.936  18.667
  383   1HG   GLU  46          2HG       GLU  46  83.466   3.359  18.905
  384   2HG   GLU  46          1HG       GLU  46  83.516   3.075  17.165
  385    HA   PRO  47           HA       PRO  47  81.085   5.833  14.418
  386   1HB   PRO  47          2HB       PRO  47  82.368   7.052  12.329
  387   2HB   PRO  47          1HB       PRO  47  81.429   7.943  13.538
  388   1HG   PRO  47          2HG       PRO  47  84.360   7.651  13.265
  389   2HG   PRO  47          1HG       PRO  47  83.410   9.019  13.854
  390   1HD   PRO  47          2HD       PRO  47  84.778   7.236  15.457
  391   2HD   PRO  47          1HD       PRO  47  83.429   8.259  15.992
  392    H    LYS  48           H        LYS  48  80.968   4.198  12.827
  393    HA   LYS  48           HA       LYS  48  83.546   2.956  11.934
  394   1HB   LYS  48          2HB       LYS  48  80.892   1.670  12.632
  395   2HB   LYS  48          1HB       LYS  48  82.216   0.814  11.838
  396   1HG   LYS  48          2HG       LYS  48  83.596   1.849  13.880
  397   2HG   LYS  48          1HG       LYS  48  82.007   1.796  14.643
  398   1HD   LYS  48          2HD       LYS  48  81.801  -0.588  14.057
  399   2HD   LYS  48          1HD       LYS  48  83.393  -0.537  13.300
  400   1HE   LYS  48          2HE       LYS  48  83.879  -1.365  15.460
  401   2HE   LYS  48          1HE       LYS  48  84.171   0.375  15.651
  402   1HZ   LYS  48          1HZ       LYS  48  81.831   0.618  16.323
  403   2HZ   LYS  48          2HZ       LYS  48  82.703  -0.373  17.392
  404   3HZ   LYS  48          3HZ       LYS  48  81.644  -1.067  16.259
  405    H    GLU  49           H        GLU  49  83.584   2.307   9.729
  406    HA   GLU  49           HA       GLU  49  81.251   3.162   8.051
  407   1HB   GLU  49          2HB       GLU  49  84.187   3.833   7.664
  408   2HB   GLU  49          1HB       GLU  49  82.888   4.283   6.560
  409   1HG   GLU  49          2HG       GLU  49  83.044   6.217   7.834
  410   2HG   GLU  49          1HG       GLU  49  81.823   5.330   8.744
  411    H    GLY  50           H        GLY  50  81.462   2.339   5.782
  412   1HA   GLY  50          2HA       GLY  50  83.364   0.190   5.246
  413   2HA   GLY  50          1HA       GLY  50  81.701  -0.370   5.421
  414    H    THR  51           H        THR  51  83.699   0.082   3.040
  415    HA   THR  51           HA       THR  51  81.684   1.434   1.264
  416    HB   THR  51           HB       THR  51  84.661   1.307   0.761
  417    HG1  THR  51           HG1      THR  51  84.621   2.337   2.666
  418   1HG2  THR  51          1HG2      THR  51  82.625   2.119  -0.827
  419   2HG2  THR  51          2HG2      THR  51  84.240   2.827  -0.895
  420   3HG2  THR  51          3HG2      THR  51  82.965   3.628   0.023
  421    H    PHE  52           H        PHE  52  81.107   0.260  -0.571
  422    HA   PHE  52           HA       PHE  52  82.872  -1.848  -1.596
  423   1HB   PHE  52          2HB       PHE  52  81.429  -3.705  -1.120
  424   2HB   PHE  52          1HB       PHE  52  81.586  -2.808   0.384
  425    HD1  PHE  52           HD1      PHE  52  79.305  -4.223  -2.006
  426    HD2  PHE  52           HD2      PHE  52  79.697  -1.016   0.915
  427    HE1  PHE  52           HE1      PHE  52  76.807  -3.993  -1.926
  428    HE2  PHE  52           HE2      PHE  52  77.190  -0.787   0.994
  429    HZ   PHE  52           HZ       PHE  52  75.747  -2.277  -0.436
  430    H    THR  53           H        THR  53  81.735  -2.985  -3.525
  431    HA   THR  53           HA       THR  53  80.029  -1.011  -5.008
  432    HB   THR  53           HB       THR  53  81.771  -3.293  -6.005
  433    HG1  THR  53           HG1      THR  53  83.303  -1.908  -5.744
  434   1HG2  THR  53          1HG2      THR  53  80.089  -2.897  -7.630
  435   2HG2  THR  53          2HG2      THR  53  81.478  -1.962  -8.187
  436   3HG2  THR  53          3HG2      THR  53  80.140  -1.153  -7.371
  437    H    ALA  54           H        ALA  54  78.028  -1.744  -5.767
  438    HA   ALA  54           HA       ALA  54  77.291  -4.596  -5.262
  439   1HB   ALA  54          1HB       ALA  54  76.750  -2.505  -3.556
  440   2HB   ALA  54          2HB       ALA  54  75.799  -3.987  -3.645
  441   3HB   ALA  54          3HB       ALA  54  75.286  -2.556  -4.536
  442    H    ARG  55           H        ARG  55  75.691  -5.400  -6.638
  443    HA   ARG  55           HA       ARG  55  74.948  -3.711  -8.975
  444   1HB   ARG  55          2HB       ARG  55  75.914  -6.086  -9.085
  445   2HB   ARG  55          1HB       ARG  55  74.360  -6.633  -8.455
  446   1HG   ARG  55          2HG       ARG  55  73.236  -5.454 -10.360
  447   2HG   ARG  55          1HG       ARG  55  74.831  -5.095 -11.022
  448   1HD   ARG  55          2HD       ARG  55  75.297  -7.602 -10.971
  449   2HD   ARG  55          1HD       ARG  55  73.572  -7.822 -10.623
  450    HE   ARG  55           HE       ARG  55  74.097  -6.051 -12.895
  451   1HH1  ARG  55          1HH1      ARG  55  73.553  -9.369 -11.885
  452   2HH1  ARG  55          2HH1      ARG  55  73.007  -9.853 -13.452
  453   1HH2  ARG  55          1HH2      ARG  55  73.385  -6.736 -14.894
  454   2HH2  ARG  55          2HH2      ARG  55  72.912  -8.384 -15.135
  455    H    VAL  56           H        VAL  56  72.774  -3.238  -9.418
  456    HA   VAL  56           HA       VAL  56  70.926  -3.240  -7.150
  457    HB   VAL  56           HB       VAL  56  70.699  -2.391 -10.058
  458   1HG1  VAL  56          1HG1      VAL  56  68.562  -1.735  -9.698
  459   2HG1  VAL  56          2HG1      VAL  56  68.936  -1.080  -8.103
  460   3HG1  VAL  56          3HG1      VAL  56  68.589  -2.796  -8.289
  461   1HG2  VAL  56          1HG2      VAL  56  72.329  -1.333  -8.203
  462   2HG2  VAL  56          2HG2      VAL  56  70.847  -0.484  -7.772
  463   3HG2  VAL  56          3HG2      VAL  56  71.506  -0.335  -9.401
  464    H    GLY  57           H        GLY  57  69.539  -4.843  -6.707
  465   1HA   GLY  57          2HA       GLY  57  68.934  -6.872  -8.808
  466   2HA   GLY  57          1HA       GLY  57  68.807  -7.152  -7.072
  467    H    GLU  58           H        GLU  58  66.637  -7.931  -7.730
  468    HA   GLU  58           HA       GLU  58  64.587  -6.262  -8.808
  469   1HB   GLU  58          2HB       GLU  58  64.628  -8.784  -8.447
  470   2HB   GLU  58          1HB       GLU  58  64.279  -8.467  -6.747
  471   1HG   GLU  58          2HG       GLU  58  62.158  -8.851  -7.768
  472   2HG   GLU  58          1HG       GLU  58  62.274  -7.105  -7.562
  473    H    GLN  59           H        GLN  59  62.920  -5.081  -7.723
  474    HA   GLN  59           HA       GLN  59  62.100  -3.539  -6.147
  475   1HB   GLN  59          2HB       GLN  59  63.186  -5.781  -4.425
  476   2HB   GLN  59          1HB       GLN  59  62.219  -4.455  -3.779
  477   1HG   GLN  59          2HG       GLN  59  60.397  -5.026  -5.356
  478   2HG   GLN  59          1HG       GLN  59  61.356  -6.375  -5.960
  479   1HE2  GLN  59          1HE2      GLN  59  61.303  -8.324  -4.774
  480   2HE2  GLN  59          2HE2      GLN  59  60.502  -8.504  -3.288
  481    H    GLY  60           H        GLY  60  65.160  -3.448  -6.925
  482   1HA   GLY  60          2HA       GLY  60  66.762  -1.785  -6.495
  483   2HA   GLY  60          1HA       GLY  60  65.619  -1.084  -5.353
  484    H    SER  61           H        SER  61  66.517  -4.401  -4.845
  485    HA   SER  61           HA       SER  61  67.546  -3.746  -2.205
  486   1HB   SER  61          2HB       SER  61  67.553  -6.131  -1.934
  487   2HB   SER  61          1HB       SER  61  66.169  -5.764  -2.959
  488    HG   SER  61           HG       SER  61  67.504  -7.491  -3.750
  489    H    VAL  62           H        VAL  62  69.676  -3.977  -1.459
  490    HA   VAL  62           HA       VAL  62  71.801  -4.738  -3.404
  491    HB   VAL  62           HB       VAL  62  71.556  -2.282  -3.444
  492   1HG1  VAL  62          1HG1      VAL  62  72.019  -0.979  -1.379
  493   2HG1  VAL  62          2HG1      VAL  62  72.056  -2.483  -0.460
  494   3HG1  VAL  62          3HG1      VAL  62  70.559  -1.959  -1.231
  495   1HG2  VAL  62          1HG2      VAL  62  73.865  -3.609  -3.278
  496   2HG2  VAL  62          2HG2      VAL  62  74.009  -2.681  -1.786
  497   3HG2  VAL  62          3HG2      VAL  62  73.822  -1.846  -3.328
  498    H    ILE  63           H        ILE  63  73.597  -5.750  -2.371
  499    HA   ILE  63           HA       ILE  63  73.105  -6.487   0.491
  500    HB   ILE  63           HB       ILE  63  74.685  -7.874  -1.703
  501   1HG1  ILE  63          2HG1      ILE  63  72.283  -7.799  -2.252
  502   2HG1  ILE  63          1HG1      ILE  63  72.758  -9.437  -1.813
  503   1HG2  ILE  63          1HG2      ILE  63  75.547  -8.844   0.191
  504   2HG2  ILE  63          2HG2      ILE  63  74.087  -9.822   0.042
  505   3HG2  ILE  63          3HG2      ILE  63  74.127  -8.462   1.164
  506   1HD1  ILE  63          1HD1      ILE  63  71.416  -7.442   0.038
  507   2HD1  ILE  63          2HD1      ILE  63  71.880  -9.088   0.468
  508   3HD1  ILE  63          3HD1      ILE  63  70.621  -8.811  -0.738
  509    H    ILE  64           H        ILE  64  74.508  -5.673   1.964
  510    HA   ILE  64           HA       ILE  64  77.114  -4.502   1.215
  511    HB   ILE  64           HB       ILE  64  75.758  -5.073   3.878
  512   1HG1  ILE  64          2HG1      ILE  64  76.017  -2.443   2.392
  513   2HG1  ILE  64          1HG1      ILE  64  74.594  -3.479   2.275
  514   1HG2  ILE  64          1HG2      ILE  64  77.369  -3.534   4.844
  515   2HG2  ILE  64          2HG2      ILE  64  78.064  -3.204   3.256
  516   3HG2  ILE  64          3HG2      ILE  64  78.252  -4.798   3.987
  517   1HD1  ILE  64          1HD1      ILE  64  74.749  -3.395   4.930
  518   2HD1  ILE  64          2HD1      ILE  64  73.937  -2.117   4.026
  519   3HD1  ILE  64          3HD1      ILE  64  75.588  -1.881   4.598
  520    HA   PRO  65           HA       PRO  65  79.334  -8.342   1.597
  521   1HB   PRO  65          2HB       PRO  65  81.784  -7.426   2.403
  522   2HB   PRO  65          1HB       PRO  65  81.189  -7.236   0.738
  523   1HG   PRO  65          2HG       PRO  65  81.049  -5.286   3.010
  524   2HG   PRO  65          1HG       PRO  65  81.649  -5.024   1.360
  525   1HD   PRO  65          2HD       PRO  65  79.201  -4.255   1.991
  526   2HD   PRO  65          1HD       PRO  65  79.488  -5.086   0.440
  527    H    LYS  66           H        LYS  66  79.379  -9.817   3.250
  528    HA   LYS  66           HA       LYS  66  78.581  -9.279   5.909
  529   1HB   LYS  66          2HB       LYS  66  78.573 -11.475   4.713
  530   2HB   LYS  66          1HB       LYS  66  80.328 -11.541   4.884
  531   1HG   LYS  66          2HG       LYS  66  80.072 -11.418   7.352
  532   2HG   LYS  66          1HG       LYS  66  78.319 -11.426   7.153
  533   1HD   LYS  66          2HD       LYS  66  78.524 -13.615   5.942
  534   2HD   LYS  66          1HD       LYS  66  80.243 -13.621   6.340
  535   1HE   LYS  66          2HE       LYS  66  79.201 -13.154   8.807
  536   2HE   LYS  66          1HE       LYS  66  77.907 -14.139   8.096
  537   1HZ   LYS  66          1HZ       LYS  66  79.703 -15.491   9.093
  538   2HZ   LYS  66          2HZ       LYS  66  80.796 -14.823   7.976
  539   3HZ   LYS  66          3HZ       LYS  66  79.501 -15.781   7.435
  540    H    ALA  67           H        ALA  67  81.820  -9.379   4.501
  541    HA   ALA  67           HA       ALA  67  83.394  -9.454   6.867
  542   1HB   ALA  67          1HB       ALA  67  84.729  -9.659   5.023
  543   2HB   ALA  67          2HB       ALA  67  84.837  -7.902   5.122
  544   3HB   ALA  67          3HB       ALA  67  83.670  -8.654   4.034
  545    H    LEU  68           H        LEU  68  81.895  -6.708   5.187
  546    HA   LEU  68           HA       LEU  68  83.047  -4.703   6.974
  547   1HB   LEU  68          2HB       LEU  68  80.833  -4.686   4.903
  548   2HB   LEU  68          1HB       LEU  68  81.375  -3.239   5.750
  549    HG   LEU  68           HG       LEU  68  83.122  -5.031   4.028
  550   1HD1  LEU  68          1HD1      LEU  68  82.882  -3.501   2.319
  551   2HD1  LEU  68          2HD1      LEU  68  82.597  -2.155   3.423
  552   3HD1  LEU  68          3HD1      LEU  68  81.303  -3.304   3.081
  553   1HD2  LEU  68          1HD2      LEU  68  84.647  -2.912   4.320
  554   2HD2  LEU  68          2HD2      LEU  68  84.601  -4.114   5.608
  555   3HD2  LEU  68          3HD2      LEU  68  83.669  -2.626   5.759
  556    H    ARG  69           H        ARG  69  80.004  -6.542   6.829
  557    HA   ARG  69           HA       ARG  69  78.450  -5.058   8.717
  558   1HB   ARG  69          2HB       ARG  69  78.655  -8.077   8.397
  559   2HB   ARG  69          1HB       ARG  69  77.287  -7.197   9.063
  560   1HG   ARG  69          2HG       ARG  69  77.050  -6.065   6.804
  561   2HG   ARG  69          1HG       ARG  69  78.245  -7.213   6.194
  562   1HD   ARG  69          2HD       ARG  69  76.651  -8.979   7.408
  563   2HD   ARG  69          1HD       ARG  69  75.440  -7.724   7.099
  564    HE   ARG  69           HE       ARG  69  76.688  -7.865   4.681
  565   1HH1  ARG  69          1HH1      ARG  69  75.402 -10.376   6.777
  566   2HH1  ARG  69          2HH1      ARG  69  75.117 -11.454   5.459
  567   1HH2  ARG  69          1HH2      ARG  69  76.284  -9.304   3.027
  568   2HH2  ARG  69          2HH2      ARG  69  75.606 -10.859   3.365
  569    H    ASP  70           H        ASP  70  80.763  -7.721   9.198
  570    HA   ASP  70           HA       ASP  70  80.413  -7.922  12.040
  571   1HB   ASP  70          2HB       ASP  70  82.687  -8.729  10.193
  572   2HB   ASP  70          1HB       ASP  70  82.500  -9.296  11.852
  573    H    VAL  71           H        VAL  71  82.962  -6.348  10.079
  574    HA   VAL  71           HA       VAL  71  84.570  -5.409  12.247
  575    HB   VAL  71           HB       VAL  71  84.039  -4.293   9.467
  576   1HG1  VAL  71          1HG1      VAL  71  85.121  -2.606  10.886
  577   2HG1  VAL  71          2HG1      VAL  71  86.265  -3.226   9.694
  578   3HG1  VAL  71          3HG1      VAL  71  86.348  -3.778  11.367
  579   1HG2  VAL  71          1HG2      VAL  71  85.758  -5.699   8.712
  580   2HG2  VAL  71          2HG2      VAL  71  84.922  -6.719   9.883
  581   3HG2  VAL  71          3HG2      VAL  71  86.425  -5.913  10.331
  582    H    ILE  72           H        ILE  72  81.780  -3.946  10.616
  583    HA   ILE  72           HA       ILE  72  81.967  -1.454  12.128
  584    HB   ILE  72           HB       ILE  72  79.843  -2.589  10.276
  585   1HG1  ILE  72          2HG1      ILE  72  82.072  -0.612   9.699
  586   2HG1  ILE  72          1HG1      ILE  72  82.155  -2.330   9.305
  587   1HG2  ILE  72          1HG2      ILE  72  79.099  -0.270  10.040
  588   2HG2  ILE  72          2HG2      ILE  72  80.381   0.280  11.121
  589   3HG2  ILE  72          3HG2      ILE  72  79.067  -0.715  11.747
  590   1HD1  ILE  72          1HD1      ILE  72  80.369  -0.209   8.144
  591   2HD1  ILE  72          2HD1      ILE  72  79.864  -1.904   8.114
  592   3HD1  ILE  72          3HD1      ILE  72  81.355  -1.410   7.308
  593    H    GLY  73           H        GLY  73  80.485  -4.540  12.742
  594   1HA   GLY  73          2HA       GLY  73  79.343  -5.219  14.687
  595   2HA   GLY  73          1HA       GLY  73  79.486  -3.568  15.286
  596    H    ILE  74           H        ILE  74  77.977  -4.486  12.220
  597    HA   ILE  74           HA       ILE  74  75.597  -2.928  12.966
  598    HB   ILE  74           HB       ILE  74  76.365  -4.427  10.439
  599   1HG1  ILE  74          2HG1      ILE  74  78.018  -2.704  11.037
  600   2HG1  ILE  74          1HG1      ILE  74  77.102  -2.209   9.618
  601   1HG2  ILE  74          1HG2      ILE  74  74.123  -4.010  10.092
  602   2HG2  ILE  74          2HG2      ILE  74  74.789  -2.467   9.555
  603   3HG2  ILE  74          3HG2      ILE  74  74.105  -2.617  11.174
  604   1HD1  ILE  74          1HD1      ILE  74  76.831  -0.261  10.773
  605   2HD1  ILE  74          2HD1      ILE  74  77.180  -1.020  12.326
  606   3HD1  ILE  74          3HD1      ILE  74  75.569  -1.151  11.623
  607    H    LYS  75           H        LYS  75  73.544  -3.745  13.307
  608    HA   LYS  75           HA       LYS  75  73.162  -6.717  13.152
  609   1HB   LYS  75          2HB       LYS  75  72.513  -4.732  15.349
  610   2HB   LYS  75          1HB       LYS  75  71.854  -6.369  15.314
  611   1HG   LYS  75          2HG       LYS  75  73.877  -7.344  15.799
  612   2HG   LYS  75          1HG       LYS  75  74.797  -6.103  14.947
  613   1HD   LYS  75          2HD       LYS  75  74.491  -4.534  16.757
  614   2HD   LYS  75          1HD       LYS  75  73.365  -5.620  17.573
  615   1HE   LYS  75          2HE       LYS  75  76.065  -6.729  16.948
  616   2HE   LYS  75          1HE       LYS  75  75.965  -5.528  18.253
  617   1HZ   LYS  75          1HZ       LYS  75  74.361  -8.014  17.984
  618   2HZ   LYS  75          2HZ       LYS  75  74.043  -6.801  19.130
  619   3HZ   LYS  75          3HZ       LYS  75  75.505  -7.665  19.188
  620    HA   PRO  76           HA       PRO  76  69.357  -5.964  11.077
  621   1HB   PRO  76          2HB       PRO  76  67.544  -7.504  12.543
  622   2HB   PRO  76          1HB       PRO  76  68.581  -8.108  11.237
  623   1HG   PRO  76          2HG       PRO  76  68.927  -8.306  14.174
  624   2HG   PRO  76          1HG       PRO  76  69.381  -9.448  12.899
  625   1HD   PRO  76          2HD       PRO  76  71.184  -7.887  14.172
  626   2HD   PRO  76          1HD       PRO  76  71.375  -8.389  12.476
  627    H    GLY  77           H        GLY  77  67.892  -4.302  11.187
  628   1HA   GLY  77          2HA       GLY  77  66.134  -3.012  12.151
  629   2HA   GLY  77          1HA       GLY  77  66.533  -3.687  13.727
  630    H    GLU  78           H        GLU  78  69.440  -2.675  12.398
  631    HA   GLU  78           HA       GLU  78  69.356  -0.162  13.988
  632   1HB   GLU  78          2HB       GLU  78  71.388  -2.140  13.082
  633   2HB   GLU  78          1HB       GLU  78  71.932  -0.472  13.263
  634   1HG   GLU  78          2HG       GLU  78  70.928  -0.452  15.561
  635   2HG   GLU  78          1HG       GLU  78  70.577  -2.170  15.375
  636    H    VAL  79           H        VAL  79  69.443   1.814  13.019
  637    HA   VAL  79           HA       VAL  79  69.265   1.896  10.078
  638    HB   VAL  79           HB       VAL  79  67.640   3.018  11.559
  639   1HG1  VAL  79          1HG1      VAL  79  69.914   3.749  13.034
  640   2HG1  VAL  79          2HG1      VAL  79  68.258   4.269  13.332
  641   3HG1  VAL  79          3HG1      VAL  79  69.328   5.263  12.347
  642   1HG2  VAL  79          1HG2      VAL  79  67.424   4.912  10.228
  643   2HG2  VAL  79          2HG2      VAL  79  68.537   3.954   9.250
  644   3HG2  VAL  79          3HG2      VAL  79  69.153   5.261  10.262
  645    H    ILE  80           H        ILE  80  70.820   2.654   8.756
  646    HA   ILE  80           HA       ILE  80  73.147   4.146   9.909
  647    HB   ILE  80           HB       ILE  80  74.516   2.962   8.199
  648   1HG1  ILE  80          2HG1      ILE  80  71.975   1.409   7.612
  649   2HG1  ILE  80          1HG1      ILE  80  72.643   2.666   6.569
  650   1HG2  ILE  80          1HG2      ILE  80  72.919   0.856   9.649
  651   2HG2  ILE  80          2HG2      ILE  80  73.925   1.995  10.544
  652   3HG2  ILE  80          3HG2      ILE  80  74.657   0.918   9.355
  653   1HD1  ILE  80          1HD1      ILE  80  74.493   1.381   5.975
  654   2HD1  ILE  80          2HD1      ILE  80  73.253   0.137   6.128
  655   3HD1  ILE  80          3HD1      ILE  80  74.406   0.398   7.437
  656    H    GLU  81           H        GLU  81  74.098   5.669   8.355
  657    HA   GLU  81           HA       GLU  81  72.144   6.782   6.399
  658   1HB   GLU  81          2HB       GLU  81  73.141   8.245   8.151
  659   2HB   GLU  81          1HB       GLU  81  74.750   7.851   7.546
  660   1HG   GLU  81          2HG       GLU  81  74.097   8.782   5.321
  661   2HG   GLU  81          1HG       GLU  81  72.553   9.273   6.015
  662    H    VAL  82           H        VAL  82  72.537   6.495   4.250
  663    HA   VAL  82           HA       VAL  82  75.075   5.120   3.482
  664    HB   VAL  82           HB       VAL  82  72.250   5.044   2.362
  665   1HG1  VAL  82          1HG1      VAL  82  73.766   4.585   0.560
  666   2HG1  VAL  82          2HG1      VAL  82  73.170   3.024   1.125
  667   3HG1  VAL  82          3HG1      VAL  82  74.781   3.573   1.588
  668   1HG2  VAL  82          1HG2      VAL  82  72.591   2.585   3.221
  669   2HG2  VAL  82          2HG2      VAL  82  72.165   3.850   4.375
  670   3HG2  VAL  82          3HG2      VAL  82  73.839   3.310   4.236
  671    H    LEU  83           H        LEU  83  76.365   6.132   2.054
  672    HA   LEU  83           HA       LEU  83  75.306   8.454   0.476
  673   1HB   LEU  83          2HB       LEU  83  78.166   7.822   1.306
  674   2HB   LEU  83          1HB       LEU  83  77.569   9.340   0.649
  675    HG   LEU  83           HG       LEU  83  76.777   8.153   3.326
  676   1HD1  LEU  83          1HD1      LEU  83  78.145   9.863   4.311
  677   2HD1  LEU  83          2HD1      LEU  83  78.417  10.631   2.746
  678   3HD1  LEU  83          3HD1      LEU  83  79.136   9.056   3.094
  679   1HD2  LEU  83          1HD2      LEU  83  76.155  10.871   2.133
  680   2HD2  LEU  83          2HD2      LEU  83  75.572  10.231   3.670
  681   3HD2  LEU  83          3HD2      LEU  83  75.028   9.514   2.153
  682    H    LEU  84           H        LEU  84  75.357   8.145  -1.751
  683    HA   LEU  84           HA       LEU  84  76.710   5.804  -2.932
  684   1HB   LEU  84          2HB       LEU  84  74.929   8.043  -3.832
  685   2HB   LEU  84          1HB       LEU  84  75.860   7.152  -5.041
  686    HG   LEU  84           HG       LEU  84  74.393   5.562  -2.987
  687   1HD1  LEU  84          1HD1      LEU  84  73.066   7.495  -4.671
  688   2HD1  LEU  84          2HD1      LEU  84  72.358   6.361  -3.528
  689   3HD1  LEU  84          3HD1      LEU  84  72.628   5.871  -5.197
  690   1HD2  LEU  84          1HD2      LEU  84  75.478   4.139  -4.432
  691   2HD2  LEU  84          2HD2      LEU  84  75.446   5.296  -5.763
  692   3HD2  LEU  84          3HD2      LEU  84  74.002   4.362  -5.371
  693    H    LEU  85           H        LEU  85  78.635   5.893  -4.082
  694    HA   LEU  85           HA       LEU  85  80.160   8.454  -3.886
  695   1HB   LEU  85          2HB       LEU  85  80.738   5.541  -3.601
  696   2HB   LEU  85          1HB       LEU  85  82.037   6.563  -4.225
  697    HG   LEU  85           HG       LEU  85  80.489   7.354  -1.762
  698   1HD1  LEU  85          1HD1      LEU  85  83.001   5.655  -1.847
  699   2HD1  LEU  85          2HD1      LEU  85  81.397   5.061  -1.417
  700   3HD1  LEU  85          3HD1      LEU  85  82.198   6.255  -0.396
  701   1HD2  LEU  85          1HD2      LEU  85  83.133   8.048  -3.040
  702   2HD2  LEU  85          2HD2      LEU  85  82.844   8.372  -1.331
  703   3HD2  LEU  85          3HD2      LEU  85  81.827   9.130  -2.555
  704    H    GLY  86           H        GLY  86  79.241   5.832  -6.099
  705   1HA   GLY  86          2HA       GLY  86  79.800   7.501  -8.437
  706   2HA   GLY  86          1HA       GLY  86  81.003   6.237  -8.223
  707    H    HIS  87           H        HIS  87  79.867   5.856 -10.488
  708    HA   HIS  87           HA       HIS  87  77.840   3.696 -10.095
  709   1HB   HIS  87          2HB       HIS  87  76.472   4.736 -11.898
  710   2HB   HIS  87          1HB       HIS  87  76.645   5.810 -10.516
  711    HD1  HIS  87           HD1      HIS  87  77.835   5.345 -14.061
  712    HD2  HIS  87           HD2      HIS  87  78.108   8.179 -11.017
  713    HE1  HIS  87           HE1      HIS  87  78.831   7.425 -15.107
  714    H    TYR  88           H        TYR  88  77.824   2.137 -11.827
  715    HA   TYR  88           HA       TYR  88  79.818   2.521 -14.016
  716   1HB   TYR  88          2HB       TYR  88  79.491   0.127 -12.178
  717   2HB   TYR  88          1HB       TYR  88  80.498   0.129 -13.627
  718    HD1  TYR  88           HD1      TYR  88  80.145   1.355 -10.151
  719    HD2  TYR  88           HD2      TYR  88  82.548   1.544 -13.779
  720    HE1  TYR  88           HE1      TYR  88  82.022   2.413  -8.854
  721    HE2  TYR  88           HE2      TYR  88  84.425   2.601 -12.480
  722    HH   TYR  88           HH       TYR  88  84.713   3.909 -10.370
  723    H    LYS  89           H        LYS  89  79.066   1.739 -15.995
  724    HA   LYS  89           HA       LYS  89  76.429   0.303 -15.974
  725   1HB   LYS  89          2HB       LYS  89  75.943   1.624 -18.029
  726   2HB   LYS  89          1HB       LYS  89  76.253   2.664 -16.640
  727   1HG   LYS  89          2HG       LYS  89  78.440   3.210 -17.401
  728   2HG   LYS  89          1HG       LYS  89  78.448   1.889 -18.569
  729   1HD   LYS  89          2HD       LYS  89  76.308   3.179 -19.498
  730   2HD   LYS  89          1HD       LYS  89  77.105   4.553 -18.729
  731   1HE   LYS  89          2HE       LYS  89  78.438   2.689 -20.728
  732   2HE   LYS  89          1HE       LYS  89  77.818   4.310 -21.103
  733   1HZ   LYS  89          1HZ       LYS  89  80.113   4.526 -20.533
  734   2HZ   LYS  89          2HZ       LYS  89  79.914   3.606 -19.118
  735   3HZ   LYS  89          3HZ       LYS  89  79.208   5.148 -19.241
  736    HA   PRO  90           HA       PRO  90  78.241  -2.922 -18.446
  737   1HB   PRO  90          2HB       PRO  90  75.802  -2.597 -20.165
  738   2HB   PRO  90          1HB       PRO  90  76.479  -4.074 -19.441
  739   1HG   PRO  90          2HG       PRO  90  74.356  -3.019 -18.358
  740   2HG   PRO  90          1HG       PRO  90  75.692  -3.530 -17.305
  741   1HD   PRO  90          2HD       PRO  90  74.981  -0.763 -18.231
  742   2HD   PRO  90          1HD       PRO  90  75.428  -1.326 -16.600
  743    H    ARG  91           H        ARG  91  79.349  -3.158 -20.476
  744    HA   ARG  91           HA       ARG  91  79.342  -0.715 -22.224
  745   1HB   ARG  91          2HB       ARG  91  81.369  -1.134 -20.804
  746   2HB   ARG  91          1HB       ARG  91  81.582  -2.677 -21.631
  747   1HG   ARG  91          2HG       ARG  91  81.761  -1.489 -23.794
  748   2HG   ARG  91          1HG       ARG  91  81.577   0.052 -22.954
  749   1HD   ARG  91          2HD       ARG  91  83.954  -0.309 -23.289
  750   2HD   ARG  91          1HD       ARG  91  83.623  -0.593 -21.568
  751    HE   ARG  91           HE       ARG  91  83.341  -2.987 -23.234
  752   1HH1  ARG  91          1HH1      ARG  91  85.550  -1.051 -21.312
  753   2HH1  ARG  91          2HH1      ARG  91  86.620  -2.380 -21.038
  754   1HH2  ARG  91          1HH2      ARG  91  84.760  -4.663 -22.845
  755   2HH2  ARG  91          2HH2      ARG  91  86.182  -4.398 -21.893
  756    H    ASN  92           H        ASN  92  79.217  -1.067 -24.451
  757    HA   ASN  92           HA       ASN  92  79.115  -3.908 -25.409
  758   1HB   ASN  92          2HB       ASN  92  77.253  -1.596 -26.053
  759   2HB   ASN  92          1HB       ASN  92  77.167  -3.196 -26.791
  760   1HD2  ASN  92          1HD2      ASN  92  77.574  -4.877 -24.583
  761   2HD2  ASN  92          2HD2      ASN  92  76.325  -4.654 -23.456
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1  82.401  13.590   1.067
    2   2H    MET   1          2H        MET   1  82.631  15.255   0.822
    3   3H    MET   1          3H        MET   1  83.945  14.268   1.252
    4    HA   MET   1           HA       MET   1  84.110  14.730  -1.085
    5   1HB   MET   1          2HB       MET   1  83.196  11.991  -0.188
    6   2HB   MET   1          1HB       MET   1  83.809  12.273  -1.819
    7   1HG   MET   1          2HG       MET   1  85.891  13.214  -0.850
    8   2HG   MET   1          1HG       MET   1  85.287  12.844   0.765
    9   1HE   MET   1          1HE       MET   1  88.151  10.320   0.143
   10   2HE   MET   1          2HE       MET   1  87.310  11.097   1.482
   11   3HE   MET   1          3HE       MET   1  87.877  12.067   0.125
   12    H    ASP   2           H        ASP   2  83.004  13.640  -3.212
   13    HA   ASP   2           HA       ASP   2  80.418  14.973  -3.521
   14   1HB   ASP   2          2HB       ASP   2  82.094  13.181  -5.309
   15   2HB   ASP   2          1HB       ASP   2  80.670  14.069  -5.848
   16    H    VAL   3           H        VAL   3  78.399  13.986  -3.576
   17    HA   VAL   3           HA       VAL   3  78.299  11.014  -3.387
   18    HB   VAL   3           HB       VAL   3  78.013  12.422  -1.235
   19   1HG1  VAL   3          1HG1      VAL   3  75.222  12.840  -2.328
   20   2HG1  VAL   3          2HG1      VAL   3  76.454  14.105  -2.304
   21   3HG1  VAL   3          3HG1      VAL   3  75.869  13.417  -0.788
   22   1HG2  VAL   3          1HG2      VAL   3  75.828  10.490  -2.055
   23   2HG2  VAL   3          2HG2      VAL   3  76.255  10.909  -0.396
   24   3HG2  VAL   3          3HG2      VAL   3  77.407  10.042  -1.413
   25    H    LEU   4           H        LEU   4  76.812  10.095  -4.773
   26    HA   LEU   4           HA       LEU   4  75.471  11.837  -6.716
   27   1HB   LEU   4          2HB       LEU   4  75.376   8.821  -6.392
   28   2HB   LEU   4          1HB       LEU   4  75.021   9.733  -7.854
   29    HG   LEU   4           HG       LEU   4  77.721   9.431  -6.493
   30   1HD1  LEU   4          1HD1      LEU   4  78.231   8.611  -8.912
   31   2HD1  LEU   4          2HD1      LEU   4  76.481   8.436  -9.046
   32   3HD1  LEU   4          3HD1      LEU   4  77.365   7.532  -7.817
   33   1HD2  LEU   4          1HD2      LEU   4  78.446  10.738  -8.656
   34   2HD2  LEU   4          2HD2      LEU   4  77.846  11.648  -7.265
   35   3HD2  LEU   4          3HD2      LEU   4  76.783  11.329  -8.640
   36    H    ALA   5           H        ALA   5  74.588  10.190  -3.775
   37    HA   ALA   5           HA       ALA   5  72.001  11.449  -3.698
   38   1HB   ALA   5          1HB       ALA   5  72.049   9.242  -5.309
   39   2HB   ALA   5          2HB       ALA   5  70.615   9.772  -4.432
   40   3HB   ALA   5          3HB       ALA   5  71.640   8.504  -3.761
   41    H    LYS   6           H        LYS   6  71.013  11.113  -1.601
   42    HA   LYS   6           HA       LYS   6  72.684   9.561   0.356
   43   1HB   LYS   6          2HB       LYS   6  73.165  12.031   0.224
   44   2HB   LYS   6          1HB       LYS   6  71.494  12.332   0.700
   45   1HG   LYS   6          2HG       LYS   6  71.843  11.114   2.797
   46   2HG   LYS   6          1HG       LYS   6  73.498  10.742   2.319
   47   1HD   LYS   6          2HD       LYS   6  73.732  13.337   2.054
   48   2HD   LYS   6          1HD       LYS   6  72.314  13.389   3.104
   49   1HE   LYS   6          2HE       LYS   6  73.858  11.582   4.449
   50   2HE   LYS   6          1HE       LYS   6  75.102  12.642   3.757
   51   1HZ   LYS   6          1HZ       LYS   6  74.304  13.562   5.834
   52   2HZ   LYS   6          2HZ       LYS   6  72.700  13.517   5.276
   53   3HZ   LYS   6          3HZ       LYS   6  73.828  14.558   4.548
   54    H    PHE   7           H        PHE   7  71.401   8.178   1.539
   55    HA   PHE   7           HA       PHE   7  68.655   9.004   2.298
   56   1HB   PHE   7          2HB       PHE   7  67.683   6.995   1.254
   57   2HB   PHE   7          1HB       PHE   7  68.512   7.979   0.053
   58    HD1  PHE   7           HD1      PHE   7  68.208   4.690   1.489
   59    HD2  PHE   7           HD2      PHE   7  71.023   7.365  -0.486
   60    HE1  PHE   7           HE1      PHE   7  69.639   2.721   0.856
   61    HE2  PHE   7           HE2      PHE   7  72.455   5.394  -1.111
   62    HZ   PHE   7           HZ       PHE   7  71.762   3.068  -0.434
   63    H    HIS   8           H        HIS   8  67.695   7.456   3.892
   64    HA   HIS   8           HA       HIS   8  69.850   6.178   5.551
   65   1HB   HIS   8          2HB       HIS   8  67.167   7.432   6.231
   66   2HB   HIS   8          1HB       HIS   8  68.257   6.707   7.412
   67    HD1  HIS   8           HD1      HIS   8  67.890   9.682   5.150
   68    HD2  HIS   8           HD2      HIS   8  70.589   8.240   7.982
   69    HE1  HIS   8           HE1      HIS   8  69.488  11.583   5.651
   70    H    THR   9           H        THR   9  69.584   4.051   6.166
   71    HA   THR   9           HA       THR   9  66.956   2.719   5.949
   72    HB   THR   9           HB       THR   9  68.047   2.650   3.676
   73    HG1  THR   9           HG1      THR   9  67.886   0.139   4.975
   74   1HG2  THR   9          1HG2      THR   9  70.001   1.160   3.373
   75   2HG2  THR   9          2HG2      THR   9  70.111   0.969   5.124
   76   3HG2  THR   9          3HG2      THR   9  70.396   2.547   4.389
   77    H    THR  10           H        THR  10  67.067   0.497   6.973
   78    HA   THR  10           HA       THR  10  69.338   0.327   8.917
   79    HB   THR  10           HB       THR  10  66.945   0.719   9.750
   80    HG1  THR  10           HG1      THR  10  68.235  -1.645  10.606
   81   1HG2  THR  10          1HG2      THR  10  66.299  -1.393   8.076
   82   2HG2  THR  10          2HG2      THR  10  65.276  -0.760   9.368
   83   3HG2  THR  10          3HG2      THR  10  66.335  -2.140   9.676
   84    H    VAL  11           H        VAL  11  70.099  -1.867   9.416
   85    HA   VAL  11           HA       VAL  11  70.424  -3.443   6.983
   86    HB   VAL  11           HB       VAL  11  71.309  -3.909   9.854
   87   1HG1  VAL  11          1HG1      VAL  11  72.912  -5.459   8.960
   88   2HG1  VAL  11          2HG1      VAL  11  72.523  -5.002   7.301
   89   3HG1  VAL  11          3HG1      VAL  11  71.352  -5.902   8.267
   90   1HG2  VAL  11          1HG2      VAL  11  73.507  -3.096   8.359
   91   2HG2  VAL  11          2HG2      VAL  11  72.584  -2.072   9.458
   92   3HG2  VAL  11          3HG2      VAL  11  72.210  -2.079   7.734
   93    H    HIS  12           H        HIS  12  69.423  -5.333   6.459
   94    HA   HIS  12           HA       HIS  12  67.542  -6.556   8.448
   95   1HB   HIS  12          2HB       HIS  12  67.431  -6.077   5.491
   96   2HB   HIS  12          1HB       HIS  12  66.587  -7.480   6.154
   97    HD1  HIS  12           HD1      HIS  12  66.913  -3.787   7.118
   98    HD2  HIS  12           HD2      HIS  12  64.028  -6.787   6.886
   99    HE1  HIS  12           HE1      HIS  12  64.730  -2.738   7.855
  100    H    ARG  13           H        ARG  13  67.227  -8.961   7.924
  101    HA   ARG  13           HA       ARG  13  69.466 -10.466   8.508
  102   1HB   ARG  13          2HB       ARG  13  67.013 -11.111   6.861
  103   2HB   ARG  13          1HB       ARG  13  68.122 -12.356   7.445
  104   1HG   ARG  13          2HG       ARG  13  67.757 -11.526   9.774
  105   2HG   ARG  13          1HG       ARG  13  66.562 -10.389   9.149
  106   1HD   ARG  13          2HD       ARG  13  65.305 -12.361   8.181
  107   2HD   ARG  13          1HD       ARG  13  66.421 -13.420   9.065
  108    HE   ARG  13           HE       ARG  13  65.232 -11.314  10.721
  109   1HH1  ARG  13          1HH1      ARG  13  64.875 -14.598   9.530
  110   2HH1  ARG  13          2HH1      ARG  13  63.846 -15.058  10.839
  111   1HH2  ARG  13          1HH2      ARG  13  63.899 -11.967  12.384
  112   2HH2  ARG  13          2HH2      ARG  13  63.298 -13.591  12.434
  113    H    ILE  14           H        ILE  14  70.935 -11.779   7.315
  114    HA   ILE  14           HA       ILE  14  72.458 -12.292   5.602
  115    HB   ILE  14           HB       ILE  14  70.288 -11.233   3.761
  116   1HG1  ILE  14          2HG1      ILE  14  70.756 -14.108   4.590
  117   2HG1  ILE  14          1HG1      ILE  14  69.582 -13.072   5.402
  118   1HG2  ILE  14          1HG2      ILE  14  71.471 -13.181   2.380
  119   2HG2  ILE  14          2HG2      ILE  14  72.835 -12.747   3.410
  120   3HG2  ILE  14          3HG2      ILE  14  72.096 -11.532   2.366
  121   1HD1  ILE  14          1HD1      ILE  14  68.782 -12.589   2.921
  122   2HD1  ILE  14          2HD1      ILE  14  68.230 -14.030   3.777
  123   3HD1  ILE  14          3HD1      ILE  14  69.544 -14.150   2.608
  124    H    GLY  15           H        GLY  15  71.758  -9.193   6.506
  125   1HA   GLY  15          2HA       GLY  15  73.076  -7.257   6.273
  126   2HA   GLY  15          1HA       GLY  15  74.086  -8.134   5.128
  127    H    ARG  16           H        ARG  16  70.706  -8.236   4.409
  128    HA   ARG  16           HA       ARG  16  71.180  -6.714   1.945
  129   1HB   ARG  16          2HB       ARG  16  69.950  -8.863   2.053
  130   2HB   ARG  16          1HB       ARG  16  68.740  -8.113   3.091
  131   1HG   ARG  16          2HG       ARG  16  68.234  -6.483   1.281
  132   2HG   ARG  16          1HG       ARG  16  69.385  -7.317   0.237
  133   1HD   ARG  16          2HD       ARG  16  66.950  -8.627   1.508
  134   2HD   ARG  16          1HD       ARG  16  67.055  -8.097  -0.182
  135    HE   ARG  16           HE       ARG  16  69.328  -9.727   0.364
  136   1HH1  ARG  16          1HH1      ARG  16  65.844 -10.046   0.066
  137   2HH1  ARG  16          2HH1      ARG  16  65.949 -11.694  -0.445
  138   1HH2  ARG  16          1HH2      ARG  16  69.398 -11.853  -0.298
  139   2HH2  ARG  16          2HH2      ARG  16  67.932 -12.705  -0.649
  140    H    ILE  17           H        ILE  17  70.220  -4.736   1.425
  141    HA   ILE  17           HA       ILE  17  68.343  -3.522   3.402
  142    HB   ILE  17           HB       ILE  17  69.523  -1.359   3.119
  143   1HG1  ILE  17          2HG1      ILE  17  71.658  -2.908   1.626
  144   2HG1  ILE  17          1HG1      ILE  17  70.405  -1.981   0.802
  145   1HG2  ILE  17          1HG2      ILE  17  71.140  -1.836   4.685
  146   2HG2  ILE  17          2HG2      ILE  17  71.739  -3.236   3.796
  147   3HG2  ILE  17          3HG2      ILE  17  70.256  -3.362   4.740
  148   1HD1  ILE  17          1HD1      ILE  17  71.778  -0.503   2.958
  149   2HD1  ILE  17          2HD1      ILE  17  71.366   0.017   1.322
  150   3HD1  ILE  17          3HD1      ILE  17  72.817  -0.947   1.604
  151    H    ILE  18           H        ILE  18  66.831  -2.018   2.391
  152    HA   ILE  18           HA       ILE  18  66.717  -2.246  -0.603
  153    HB   ILE  18           HB       ILE  18  64.457  -1.865   1.393
  154   1HG1  ILE  18          2HG1      ILE  18  65.432  -4.111   1.627
  155   2HG1  ILE  18          1HG1      ILE  18  63.859  -4.217   0.842
  156   1HG2  ILE  18          1HG2      ILE  18  64.622  -2.098  -1.602
  157   2HG2  ILE  18          2HG2      ILE  18  63.673  -0.978  -0.620
  158   3HG2  ILE  18          3HG2      ILE  18  63.179  -2.668  -0.757
  159   1HD1  ILE  18          1HD1      ILE  18  65.425  -3.967  -1.346
  160   2HD1  ILE  18          2HD1      ILE  18  65.027  -5.531  -0.634
  161   3HD1  ILE  18          3HD1      ILE  18  66.567  -4.758  -0.259
  162    H    ILE  19           H        ILE  19  66.892  -0.324  -1.666
  163    HA   ILE  19           HA       ILE  19  66.956   2.221  -0.179
  164    HB   ILE  19           HB       ILE  19  67.086   1.564  -3.159
  165   1HG1  ILE  19          2HG1      ILE  19  69.230   1.945  -1.023
  166   2HG1  ILE  19          1HG1      ILE  19  68.896   0.473  -1.923
  167   1HG2  ILE  19          1HG2      ILE  19  67.983   3.814  -3.409
  168   2HG2  ILE  19          2HG2      ILE  19  67.976   4.063  -1.664
  169   3HG2  ILE  19          3HG2      ILE  19  66.452   3.932  -2.542
  170   1HD1  ILE  19          1HD1      ILE  19  70.576   2.719  -2.645
  171   2HD1  ILE  19          2HD1      ILE  19  69.349   2.437  -3.882
  172   3HD1  ILE  19          3HD1      ILE  19  70.446   1.137  -3.414
  173    HA   PRO  20           HA       PRO  20  62.612   3.140  -0.816
  174   1HB   PRO  20          2HB       PRO  20  62.765   5.875  -0.921
  175   2HB   PRO  20          1HB       PRO  20  62.853   4.970   0.601
  176   1HG   PRO  20          2HG       PRO  20  65.100   5.980  -1.110
  177   2HG   PRO  20          1HG       PRO  20  64.861   6.181   0.637
  178   1HD   PRO  20          2HD       PRO  20  66.505   4.309  -0.234
  179   2HD   PRO  20          1HD       PRO  20  65.367   3.926   1.084
  180    H    ALA  21           H        ALA  21  61.377   3.510  -2.668
  181    HA   ALA  21           HA       ALA  21  62.564   3.367  -5.232
  182   1HB   ALA  21          1HB       ALA  21  60.368   3.301  -5.930
  183   2HB   ALA  21          2HB       ALA  21  59.906   4.689  -4.945
  184   3HB   ALA  21          3HB       ALA  21  60.082   3.099  -4.202
  185    H    GLY  22           H        GLY  22  61.809   6.165  -3.234
  186   1HA   GLY  22          2HA       GLY  22  61.833   8.163  -5.297
  187   2HA   GLY  22          1HA       GLY  22  62.154   8.468  -3.589
  188    H    THR  23           H        THR  23  64.433   6.899  -3.211
  189    HA   THR  23           HA       THR  23  66.492   8.621  -4.284
  190    HB   THR  23           HB       THR  23  66.662   5.903  -2.939
  191    HG1  THR  23           HG1      THR  23  66.773   8.517  -1.847
  192   1HG2  THR  23          1HG2      THR  23  68.848   6.198  -3.537
  193   2HG2  THR  23          2HG2      THR  23  68.857   7.282  -2.146
  194   3HG2  THR  23          3HG2      THR  23  68.656   7.936  -3.772
  195    H    ARG  24           H        ARG  24  65.319   5.374  -5.146
  196    HA   ARG  24           HA       ARG  24  67.349   4.595  -6.990
  197   1HB   ARG  24          2HB       ARG  24  64.374   4.126  -7.352
  198   2HB   ARG  24          1HB       ARG  24  65.692   3.093  -7.893
  199   1HG   ARG  24          2HG       ARG  24  66.251   3.038  -5.290
  200   2HG   ARG  24          1HG       ARG  24  64.538   3.416  -5.162
  201   1HD   ARG  24          2HD       ARG  24  64.337   1.452  -6.961
  202   2HD   ARG  24          1HD       ARG  24  65.849   0.944  -6.175
  203    HE   ARG  24           HE       ARG  24  64.308   1.540  -4.019
  204   1HH1  ARG  24          1HH1      ARG  24  63.597  -0.380  -6.869
  205   2HH1  ARG  24          2HH1      ARG  24  62.484  -1.389  -6.017
  206   1HH2  ARG  24          1HH2      ARG  24  62.885   0.203  -2.978
  207   2HH2  ARG  24          2HH2      ARG  24  62.080  -1.066  -3.840
  208    H    LYS  25           H        LYS  25  64.421   6.567  -7.474
  209    HA   LYS  25           HA       LYS  25  64.681   6.896 -10.321
  210   1HB   LYS  25          2HB       LYS  25  63.406   8.584  -8.148
  211   2HB   LYS  25          1HB       LYS  25  63.131   8.826  -9.874
  212   1HG   LYS  25          2HG       LYS  25  62.251   6.550 -10.074
  213   2HG   LYS  25          1HG       LYS  25  62.566   6.262  -8.363
  214   1HD   LYS  25          2HD       LYS  25  61.059   8.179  -7.814
  215   2HD   LYS  25          1HD       LYS  25  60.661   8.308  -9.528
  216   1HE   LYS  25          2HE       LYS  25  60.354   5.652  -8.139
  217   2HE   LYS  25          1HE       LYS  25  59.085   6.882  -7.986
  218   1HZ   LYS  25          1HZ       LYS  25  60.228   5.815 -10.514
  219   2HZ   LYS  25          2HZ       LYS  25  59.148   7.124 -10.429
  220   3HZ   LYS  25          3HZ       LYS  25  58.650   5.576  -9.938
  221    H    PHE  26           H        PHE  26  65.586   9.057  -7.630
  222    HA   PHE  26           HA       PHE  26  66.691  11.191  -9.131
  223   1HB   PHE  26          2HB       PHE  26  66.211  11.133  -6.682
  224   2HB   PHE  26          1HB       PHE  26  67.606  10.076  -6.458
  225    HD1  PHE  26           HD1      PHE  26  69.871  10.933  -6.444
  226    HD2  PHE  26           HD2      PHE  26  66.531  13.498  -7.558
  227    HE1  PHE  26           HE1      PHE  26  71.383  12.940  -6.354
  228    HE2  PHE  26           HE2      PHE  26  68.042  15.506  -7.467
  229    HZ   PHE  26           HZ       PHE  26  70.468  15.227  -6.865
  230    H    TYR  27           H        TYR  27  68.206   8.169  -8.061
  231    HA   TYR  27           HA       TYR  27  70.841   8.929  -9.155
  232   1HB   TYR  27          2HB       TYR  27  70.446   7.684  -7.027
  233   2HB   TYR  27          1HB       TYR  27  69.784   6.351  -7.956
  234    HD1  TYR  27           HD1      TYR  27  72.779   7.862  -6.622
  235    HD2  TYR  27           HD2      TYR  27  71.323   5.265  -9.797
  236    HE1  TYR  27           HE1      TYR  27  75.092   6.922  -6.923
  237    HE2  TYR  27           HE2      TYR  27  73.631   4.324 -10.091
  238    HH   TYR  27           HH       TYR  27  76.171   4.921  -7.807
  239    H    GLY  28           H        GLY  28  67.988   7.343 -10.369
  240   1HA   GLY  28          2HA       GLY  28  67.593   6.499 -12.528
  241   2HA   GLY  28          1HA       GLY  28  69.261   6.901 -12.936
  242    H    ILE  29           H        ILE  29  68.059   4.754 -10.350
  243    HA   ILE  29           HA       ILE  29  70.000   2.698 -11.170
  244    HB   ILE  29           HB       ILE  29  67.952   2.820  -8.924
  245   1HG1  ILE  29          2HG1      ILE  29  70.932   3.393  -8.909
  246   2HG1  ILE  29          1HG1      ILE  29  69.672   4.623  -8.897
  247   1HG2  ILE  29          1HG2      ILE  29  68.488   0.589  -8.877
  248   2HG2  ILE  29          2HG2      ILE  29  69.904   1.188  -8.014
  249   3HG2  ILE  29          3HG2      ILE  29  70.009   0.827  -9.736
  250   1HD1  ILE  29          1HD1      ILE  29  68.921   2.952  -6.815
  251   2HD1  ILE  29          2HD1      ILE  29  69.775   4.485  -6.641
  252   3HD1  ILE  29          3HD1      ILE  29  70.683   2.971  -6.697
  253    H    GLU  30           H        GLU  30  69.511   1.009 -12.443
  254    HA   GLU  30           HA       GLU  30  66.708  -0.041 -12.465
  255   1HB   GLU  30          2HB       GLU  30  68.641   0.221 -14.797
  256   2HB   GLU  30          1HB       GLU  30  67.057  -0.550 -14.877
  257   1HG   GLU  30          2HG       GLU  30  66.005   1.595 -14.178
  258   2HG   GLU  30          1HG       GLU  30  67.595   2.356 -14.191
  259    H    GLN  31           H        GLN  31  66.673  -2.411 -12.850
  260    HA   GLN  31           HA       GLN  31  68.559  -3.869 -11.322
  261   1HB   GLN  31          2HB       GLN  31  66.649  -4.667 -13.536
  262   2HB   GLN  31          1HB       GLN  31  67.506  -5.842 -12.538
  263   1HG   GLN  31          2HG       GLN  31  66.517  -4.813 -10.506
  264   2HG   GLN  31          1HG       GLN  31  65.615  -3.695 -11.532
  265   1HE2  GLN  31          1HE2      GLN  31  63.689  -4.467 -12.518
  266   2HE2  GLN  31          2HE2      GLN  31  63.120  -6.055 -12.344
  267    H    GLY  32           H        GLY  32  70.494  -4.855 -11.802
  268   1HA   GLY  32          2HA       GLY  32  72.110  -5.910 -13.230
  269   2HA   GLY  32          1HA       GLY  32  71.323  -5.175 -14.625
  270    H    ASP  33           H        ASP  33  71.412  -2.529 -12.834
  271    HA   ASP  33           HA       ASP  33  73.907  -1.524 -13.997
  272   1HB   ASP  33          2HB       ASP  33  71.842  -0.407 -12.076
  273   2HB   ASP  33          1HB       ASP  33  73.185   0.536 -12.721
  274    H    PHE  34           H        PHE  34  75.699  -0.656 -12.693
  275    HA   PHE  34           HA       PHE  34  75.961  -1.972 -10.009
  276   1HB   PHE  34          2HB       PHE  34  77.955  -1.133 -12.130
  277   2HB   PHE  34          1HB       PHE  34  78.437  -1.611 -10.502
  278    HD1  PHE  34           HD1      PHE  34  76.903  -2.766 -13.699
  279    HD2  PHE  34           HD2      PHE  34  78.279  -3.936  -9.735
  280    HE1  PHE  34           HE1      PHE  34  76.761  -5.187 -14.365
  281    HE2  PHE  34           HE2      PHE  34  78.136  -6.357 -10.400
  282    HZ   PHE  34           HZ       PHE  34  77.378  -6.983 -12.715
  283    H    VAL  35           H        VAL  35  76.335  -0.620  -8.270
  284    HA   VAL  35           HA       VAL  35  77.008   2.237  -8.838
  285    HB   VAL  35           HB       VAL  35  75.408   2.870  -7.040
  286   1HG1  VAL  35          1HG1      VAL  35  74.093   1.117  -9.140
  287   2HG1  VAL  35          2HG1      VAL  35  74.712   2.738  -9.456
  288   3HG1  VAL  35          3HG1      VAL  35  73.380   2.508  -8.324
  289   1HG2  VAL  35          1HG2      VAL  35  74.845  -0.110  -7.041
  290   2HG2  VAL  35          2HG2      VAL  35  73.755   1.082  -6.328
  291   3HG2  VAL  35          3HG2      VAL  35  75.384   0.876  -5.681
  292    H    GLU  36           H        GLU  36  78.279   3.223  -7.129
  293    HA   GLU  36           HA       GLU  36  79.591   1.227  -5.310
  294   1HB   GLU  36          2HB       GLU  36  80.951   2.230  -7.175
  295   2HB   GLU  36          1HB       GLU  36  80.653   3.823  -6.483
  296   1HG   GLU  36          2HG       GLU  36  81.698   3.056  -4.352
  297   2HG   GLU  36          1HG       GLU  36  82.075   1.517  -5.120
  298    H    ILE  37           H        ILE  37  79.128   1.587  -3.204
  299    HA   ILE  37           HA       ILE  37  78.247   4.326  -2.387
  300    HB   ILE  37           HB       ILE  37  76.393   2.870  -3.118
  301   1HG1  ILE  37          2HG1      ILE  37  76.230   2.944  -0.115
  302   2HG1  ILE  37          1HG1      ILE  37  76.290   4.444  -1.040
  303   1HG2  ILE  37          1HG2      ILE  37  77.378   1.006  -0.935
  304   2HG2  ILE  37          2HG2      ILE  37  77.420   0.691  -2.670
  305   3HG2  ILE  37          3HG2      ILE  37  75.871   0.812  -1.833
  306   1HD1  ILE  37          1HD1      ILE  37  74.067   4.240  -1.353
  307   2HD1  ILE  37          2HD1      ILE  37  74.063   2.616  -0.667
  308   3HD1  ILE  37          3HD1      ILE  37  74.398   2.847  -2.383
  309    H    LYS  38           H        LYS  38  78.234   4.638  -0.033
  310    HA   LYS  38           HA       LYS  38  79.840   2.660   1.531
  311   1HB   LYS  38          2HB       LYS  38  81.174   4.630   0.673
  312   2HB   LYS  38          1HB       LYS  38  80.130   5.676   1.641
  313   1HG   LYS  38          2HG       LYS  38  80.779   4.502   3.679
  314   2HG   LYS  38          1HG       LYS  38  81.745   3.365   2.741
  315   1HD   LYS  38          2HD       LYS  38  83.193   5.079   3.731
  316   2HD   LYS  38          1HD       LYS  38  83.181   5.242   1.975
  317   1HE   LYS  38          2HE       LYS  38  82.145   7.282   2.056
  318   2HE   LYS  38          1HE       LYS  38  81.096   6.802   3.405
  319   1HZ   LYS  38          1HZ       LYS  38  83.106   6.826   4.835
  320   2HZ   LYS  38          2HZ       LYS  38  82.694   8.360   4.231
  321   3HZ   LYS  38          3HZ       LYS  38  83.983   7.492   3.544
  322    H    ILE  39           H        ILE  39  79.205   2.481   3.717
  323    HA   ILE  39           HA       ILE  39  76.798   4.090   4.527
  324    HB   ILE  39           HB       ILE  39  76.288   2.103   5.964
  325   1HG1  ILE  39          2HG1      ILE  39  78.455   0.668   4.418
  326   2HG1  ILE  39          1HG1      ILE  39  78.759   1.384   6.001
  327   1HG2  ILE  39          1HG2      ILE  39  75.158   1.100   4.270
  328   2HG2  ILE  39          2HG2      ILE  39  76.607   0.883   3.289
  329   3HG2  ILE  39          3HG2      ILE  39  75.785   2.443   3.315
  330   1HD1  ILE  39          1HD1      ILE  39  76.970  -0.915   5.276
  331   2HD1  ILE  39          2HD1      ILE  39  76.605   0.056   6.703
  332   3HD1  ILE  39          3HD1      ILE  39  78.148  -0.789   6.583
  333    H    VAL  40           H        VAL  40  76.750   4.862   6.688
  334    HA   VAL  40           HA       VAL  40  79.198   4.476   8.351
  335    HB   VAL  40           HB       VAL  40  77.896   7.131   7.640
  336   1HG1  VAL  40          1HG1      VAL  40  80.255   7.788   8.771
  337   2HG1  VAL  40          2HG1      VAL  40  79.939   6.288   9.644
  338   3HG1  VAL  40          3HG1      VAL  40  78.774   7.610   9.713
  339   1HG2  VAL  40          1HG2      VAL  40  80.602   5.971   6.865
  340   2HG2  VAL  40          2HG2      VAL  40  80.030   7.592   6.466
  341   3HG2  VAL  40          3HG2      VAL  40  79.228   6.181   5.779
  342    H    LYS  41           H        LYS  41  78.528   3.879  10.355
  343    HA   LYS  41           HA       LYS  41  75.985   5.017  11.455
  344   1HB   LYS  41          2HB       LYS  41  75.819   2.618  10.626
  345   2HB   LYS  41          1HB       LYS  41  77.004   2.191  11.860
  346   1HG   LYS  41          2HG       LYS  41  75.485   3.177  13.589
  347   2HG   LYS  41          1HG       LYS  41  74.277   3.427  12.328
  348   1HD   LYS  41          2HD       LYS  41  73.677   1.353  13.302
  349   2HD   LYS  41          1HD       LYS  41  74.544   0.907  11.832
  350   1HE   LYS  41          2HE       LYS  41  75.509  -0.477  13.511
  351   2HE   LYS  41          1HE       LYS  41  76.661   0.865  13.358
  352   1HZ   LYS  41          1HZ       LYS  41  74.377   0.875  15.253
  353   2HZ   LYS  41          2HZ       LYS  41  75.663   1.983  15.181
  354   3HZ   LYS  41          3HZ       LYS  41  75.940   0.385  15.689
  355    H    TYR  42           H        TYR  42  76.141   5.559  13.664
  356    HA   TYR  42           HA       TYR  42  78.898   5.445  14.818
  357   1HB   TYR  42          2HB       TYR  42  77.635   7.615  14.384
  358   2HB   TYR  42          1HB       TYR  42  76.523   7.125  15.663
  359    HD1  TYR  42           HD1      TYR  42  80.121   7.880  14.904
  360    HD2  TYR  42           HD2      TYR  42  77.102   7.340  17.997
  361    HE1  TYR  42           HE1      TYR  42  81.737   8.734  16.627
  362    HE2  TYR  42           HE2      TYR  42  78.720   8.196  19.724
  363    HH   TYR  42           HH       TYR  42  81.467   9.896  19.009
  364    H    GLU  43           H        GLU  43  79.263   4.145  16.577
  365    HA   GLU  43           HA       GLU  43  76.934   3.388  18.300
  366   1HB   GLU  43          2HB       GLU  43  77.857   1.078  18.344
  367   2HB   GLU  43          1HB       GLU  43  77.419   1.570  16.711
  368   1HG   GLU  43          2HG       GLU  43  79.799   2.188  16.292
  369   2HG   GLU  43          1HG       GLU  43  80.211   1.587  17.899
  370    H    GLY  44           H        GLY  44  77.384   3.731  20.433
  371   1HA   GLY  44          2HA       GLY  44  78.579   4.259  22.381
  372   2HA   GLY  44          1HA       GLY  44  79.895   3.284  21.725
  373    H    GLU  45           H        GLU  45  81.717   4.497  21.740
  374    HA   GLU  45           HA       GLU  45  81.537   7.394  21.033
  375   1HB   GLU  45          2HB       GLU  45  83.654   7.585  22.239
  376   2HB   GLU  45          1HB       GLU  45  82.489   6.721  23.235
  377   1HG   GLU  45          2HG       GLU  45  83.504   4.569  22.565
  378   2HG   GLU  45          1HG       GLU  45  84.662   5.429  21.551
  379    H    GLU  46           H        GLU  46  81.878   4.761  19.233
  380    HA   GLU  46           HA       GLU  46  84.124   5.894  17.612
  381   1HB   GLU  46          2HB       GLU  46  84.810   3.565  17.175
  382   2HB   GLU  46          1HB       GLU  46  84.799   3.908  18.903
  383   1HG   GLU  46          2HG       GLU  46  82.204   3.006  18.396
  384   2HG   GLU  46          1HG       GLU  46  83.206   1.980  17.377
  385    HA   PRO  47           HA       PRO  47  80.916   5.485  14.437
  386   1HB   PRO  47          2HB       PRO  47  82.771   6.615  12.518
  387   2HB   PRO  47          1HB       PRO  47  81.324   7.360  13.215
  388   1HG   PRO  47          2HG       PRO  47  83.903   8.159  13.723
  389   2HG   PRO  47          1HG       PRO  47  82.510   8.496  14.759
  390   1HD   PRO  47          2HD       PRO  47  84.666   6.479  15.091
  391   2HD   PRO  47          1HD       PRO  47  83.752   7.381  16.322
  392    H    LYS  48           H        LYS  48  80.633   3.738  13.078
  393    HA   LYS  48           HA       LYS  48  83.057   2.253  12.120
  394   1HB   LYS  48          2HB       LYS  48  80.213   1.325  12.650
  395   2HB   LYS  48          1HB       LYS  48  81.523   0.301  12.065
  396   1HG   LYS  48          2HG       LYS  48  81.607   1.832  14.678
  397   2HG   LYS  48          1HG       LYS  48  81.168   0.130  14.540
  398   1HD   LYS  48          2HD       LYS  48  83.379  -0.281  13.416
  399   2HD   LYS  48          1HD       LYS  48  83.816   1.388  13.783
  400   1HE   LYS  48          2HE       LYS  48  84.190   0.928  15.991
  401   2HE   LYS  48          1HE       LYS  48  82.788  -0.157  16.095
  402   1HZ   LYS  48          1HZ       LYS  48  85.393  -0.762  14.796
  403   2HZ   LYS  48          2HZ       LYS  48  84.032  -1.779  14.758
  404   3HZ   LYS  48          3HZ       LYS  48  84.808  -1.447  16.233
  405    H    GLU  49           H        GLU  49  83.245   2.012   9.896
  406    HA   GLU  49           HA       GLU  49  80.952   2.909   8.185
  407   1HB   GLU  49          2HB       GLU  49  83.882   3.683   8.022
  408   2HB   GLU  49          1HB       GLU  49  82.644   4.174   6.867
  409   1HG   GLU  49          2HG       GLU  49  81.386   5.262   8.723
  410   2HG   GLU  49          1HG       GLU  49  82.700   4.842   9.825
  411    H    GLY  50           H        GLY  50  81.244   2.232   5.883
  412   1HA   GLY  50          2HA       GLY  50  83.229   0.178   5.267
  413   2HA   GLY  50          1HA       GLY  50  81.576  -0.436   5.370
  414    H    THR  51           H        THR  51  83.620   0.207   3.077
  415    HA   THR  51           HA       THR  51  81.585   1.534   1.309
  416    HB   THR  51           HB       THR  51  84.571   1.577   0.853
  417    HG1  THR  51           HG1      THR  51  84.735   2.768   2.555
  418   1HG2  THR  51          1HG2      THR  51  84.058   2.988  -0.834
  419   2HG2  THR  51          2HG2      THR  51  82.979   3.935   0.189
  420   3HG2  THR  51          3HG2      THR  51  82.381   2.484  -0.619
  421    H    PHE  52           H        PHE  52  81.068   0.360  -0.532
  422    HA   PHE  52           HA       PHE  52  82.928  -1.671  -1.573
  423   1HB   PHE  52          2HB       PHE  52  81.527  -3.569  -1.114
  424   2HB   PHE  52          1HB       PHE  52  81.662  -2.675   0.394
  425    HD1  PHE  52           HD1      PHE  52  79.413  -4.192  -1.937
  426    HD2  PHE  52           HD2      PHE  52  79.733  -0.868   0.861
  427    HE1  PHE  52           HE1      PHE  52  76.908  -4.019  -1.860
  428    HE2  PHE  52           HE2      PHE  52  77.223  -0.696   0.939
  429    HZ   PHE  52           HZ       PHE  52  75.812  -2.272  -0.429
  430    H    THR  53           H        THR  53  81.828  -2.847  -3.506
  431    HA   THR  53           HA       THR  53  80.080  -0.921  -5.003
  432    HB   THR  53           HB       THR  53  81.877  -3.167  -5.984
  433    HG1  THR  53           HG1      THR  53  83.402  -1.742  -5.967
  434   1HG2  THR  53          1HG2      THR  53  80.213  -2.827  -7.629
  435   2HG2  THR  53          2HG2      THR  53  81.560  -1.824  -8.168
  436   3HG2  THR  53          3HG2      THR  53  80.180  -1.086  -7.356
  437    H    ALA  54           H        ALA  54  78.094  -1.697  -5.744
  438    HA   ALA  54           HA       ALA  54  77.424  -4.569  -5.259
  439   1HB   ALA  54          1HB       ALA  54  75.946  -4.012  -3.611
  440   2HB   ALA  54          2HB       ALA  54  75.378  -2.590  -4.486
  441   3HB   ALA  54          3HB       ALA  54  76.853  -2.503  -3.525
  442    H    ARG  55           H        ARG  55  75.812  -5.385  -6.630
  443    HA   ARG  55           HA       ARG  55  75.026  -3.670  -8.934
  444   1HB   ARG  55          2HB       ARG  55  76.023  -6.039  -9.083
  445   2HB   ARG  55          1HB       ARG  55  74.466  -6.607  -8.477
  446   1HG   ARG  55          2HG       ARG  55  73.311  -5.544 -10.354
  447   2HG   ARG  55          1HG       ARG  55  74.837  -4.890 -10.947
  448   1HD   ARG  55          2HD       ARG  55  74.398  -6.861 -12.250
  449   2HD   ARG  55          1HD       ARG  55  75.652  -7.329 -11.096
  450    HE   ARG  55           HE       ARG  55  72.793  -8.101 -10.979
  451   1HH1  ARG  55          1HH1      ARG  55  75.916  -8.095  -9.364
  452   2HH1  ARG  55          2HH1      ARG  55  75.460  -9.366  -8.294
  453   1HH2  ARG  55          1HH2      ARG  55  72.274  -9.732  -9.563
  454   2HH2  ARG  55          2HH2      ARG  55  73.432 -10.279  -8.397
  455    H    VAL  56           H        VAL  56  72.853  -3.213  -9.355
  456    HA   VAL  56           HA       VAL  56  71.027  -3.244  -7.073
  457    HB   VAL  56           HB       VAL  56  70.767  -2.373  -9.973
  458   1HG1  VAL  56          1HG1      VAL  56  69.038  -1.090  -7.959
  459   2HG1  VAL  56          2HG1      VAL  56  68.670  -2.793  -8.212
  460   3HG1  VAL  56          3HG1      VAL  56  68.646  -1.675  -9.576
  461   1HG2  VAL  56          1HG2      VAL  56  70.950  -0.481  -7.677
  462   2HG2  VAL  56          2HG2      VAL  56  71.585  -0.322  -9.314
  463   3HG2  VAL  56          3HG2      VAL  56  72.425  -1.329  -8.136
  464    H    GLY  57           H        GLY  57  69.581  -4.807  -6.645
  465   1HA   GLY  57          2HA       GLY  57  68.969  -6.838  -8.741
  466   2HA   GLY  57          1HA       GLY  57  68.779  -7.093  -7.005
  467    H    GLU  58           H        GLU  58  66.587  -7.804  -7.940
  468    HA   GLU  58           HA       GLU  58  64.669  -5.923  -8.928
  469   1HB   GLU  58          2HB       GLU  58  64.601  -8.481  -8.845
  470   2HB   GLU  58          1HB       GLU  58  64.128  -8.319  -7.153
  471   1HG   GLU  58          2HG       GLU  58  62.214  -6.876  -7.881
  472   2HG   GLU  58          1HG       GLU  58  62.651  -7.200  -9.553
  473    H    GLN  59           H        GLN  59  62.917  -4.901  -7.751
  474    HA   GLN  59           HA       GLN  59  62.075  -3.514  -6.050
  475   1HB   GLN  59          2HB       GLN  59  63.293  -5.758  -4.411
  476   2HB   GLN  59          1HB       GLN  59  62.187  -4.544  -3.770
  477   1HG   GLN  59          2HG       GLN  59  61.547  -6.415  -6.068
  478   2HG   GLN  59          1HG       GLN  59  61.020  -6.654  -4.403
  479   1HE2  GLN  59          1HE2      GLN  59  59.721  -5.713  -7.207
  480   2HE2  GLN  59          2HE2      GLN  59  58.671  -4.485  -6.690
  481    H    GLY  60           H        GLY  60  65.140  -3.343  -6.871
  482   1HA   GLY  60          2HA       GLY  60  66.729  -1.686  -6.387
  483   2HA   GLY  60          1HA       GLY  60  65.576  -1.030  -5.228
  484    H    SER  61           H        SER  61  66.501  -4.354  -4.810
  485    HA   SER  61           HA       SER  61  67.553  -3.751  -2.162
  486   1HB   SER  61          2HB       SER  61  66.162  -5.747  -2.871
  487   2HB   SER  61          1HB       SER  61  67.581  -6.354  -3.716
  488    HG   SER  61           HG       SER  61  68.408  -6.926  -1.870
  489    H    VAL  62           H        VAL  62  69.682  -3.938  -1.463
  490    HA   VAL  62           HA       VAL  62  71.782  -4.728  -3.425
  491    HB   VAL  62           HB       VAL  62  71.562  -2.270  -3.468
  492   1HG1  VAL  62          1HG1      VAL  62  71.970  -0.942  -1.449
  493   2HG1  VAL  62          2HG1      VAL  62  72.162  -2.415  -0.499
  494   3HG1  VAL  62          3HG1      VAL  62  70.593  -2.015  -1.196
  495   1HG2  VAL  62          1HG2      VAL  62  74.025  -2.920  -1.847
  496   2HG2  VAL  62          2HG2      VAL  62  73.857  -1.758  -3.163
  497   3HG2  VAL  62          3HG2      VAL  62  73.836  -3.488  -3.506
  498    H    ILE  63           H        ILE  63  73.568  -5.762  -2.416
  499    HA   ILE  63           HA       ILE  63  73.080  -6.526   0.438
  500    HB   ILE  63           HB       ILE  63  74.655  -7.894  -1.772
  501   1HG1  ILE  63          2HG1      ILE  63  72.261  -7.778  -2.350
  502   2HG1  ILE  63          1HG1      ILE  63  72.710  -9.429  -1.931
  503   1HG2  ILE  63          1HG2      ILE  63  75.481  -8.915   0.107
  504   2HG2  ILE  63          2HG2      ILE  63  74.004  -9.862  -0.066
  505   3HG2  ILE  63          3HG2      ILE  63  74.063  -8.520   1.078
  506   1HD1  ILE  63          1HD1      ILE  63  70.567  -8.779  -0.878
  507   2HD1  ILE  63          2HD1      ILE  63  71.379  -7.448  -0.056
  508   3HD1  ILE  63          3HD1      ILE  63  71.801  -9.115   0.336
  509    H    ILE  64           H        ILE  64  74.508  -5.770   1.928
  510    HA   ILE  64           HA       ILE  64  77.130  -4.629   1.183
  511    HB   ILE  64           HB       ILE  64  75.794  -5.233   3.849
  512   1HG1  ILE  64          2HG1      ILE  64  76.101  -2.542   2.507
  513   2HG1  ILE  64          1HG1      ILE  64  74.692  -3.563   2.218
  514   1HG2  ILE  64          1HG2      ILE  64  78.290  -5.005   3.938
  515   2HG2  ILE  64          2HG2      ILE  64  77.446  -3.731   4.818
  516   3HG2  ILE  64          3HG2      ILE  64  78.130  -3.400   3.225
  517   1HD1  ILE  64          1HD1      ILE  64  74.749  -1.763   4.204
  518   2HD1  ILE  64          2HD1      ILE  64  75.491  -3.117   5.056
  519   3HD1  ILE  64          3HD1      ILE  64  73.882  -3.290   4.355
  520    HA   PRO  65           HA       PRO  65  79.237  -8.539   1.445
  521   1HB   PRO  65          2HB       PRO  65  81.743  -7.706   2.149
  522   2HB   PRO  65          1HB       PRO  65  81.081  -7.470   0.515
  523   1HG   PRO  65          2HG       PRO  65  81.104  -5.556   2.821
  524   2HG   PRO  65          1HG       PRO  65  81.638  -5.284   1.150
  525   1HD   PRO  65          2HD       PRO  65  79.243  -4.455   1.911
  526   2HD   PRO  65          1HD       PRO  65  79.440  -5.251   0.329
  527    H    LYS  66           H        LYS  66  79.438 -10.045   3.079
  528    HA   LYS  66           HA       LYS  66  78.693  -9.558   5.764
  529   1HB   LYS  66          2HB       LYS  66  78.724 -11.745   4.569
  530   2HB   LYS  66          1HB       LYS  66  80.486 -11.740   4.649
  531   1HG   LYS  66          2HG       LYS  66  79.790 -13.061   6.501
  532   2HG   LYS  66          1HG       LYS  66  80.211 -11.493   7.190
  533   1HD   LYS  66          2HD       LYS  66  77.858 -10.829   7.204
  534   2HD   LYS  66          1HD       LYS  66  77.403 -12.345   6.425
  535   1HE   LYS  66          2HE       LYS  66  77.036 -12.980   8.619
  536   2HE   LYS  66          1HE       LYS  66  78.778 -13.322   8.555
  537   1HZ   LYS  66          1HZ       LYS  66  78.133 -11.835  10.418
  538   2HZ   LYS  66          2HZ       LYS  66  77.622 -10.682   9.280
  539   3HZ   LYS  66          3HZ       LYS  66  79.257 -11.137   9.357
  540    H    ALA  67           H        ALA  67  81.894  -9.538   4.267
  541    HA   ALA  67           HA       ALA  67  83.533  -9.554   6.592
  542   1HB   ALA  67          1HB       ALA  67  83.897  -9.470   3.900
  543   2HB   ALA  67          2HB       ALA  67  85.192  -9.151   5.054
  544   3HB   ALA  67          3HB       ALA  67  84.317  -7.808   4.318
  545    H    LEU  68           H        LEU  68  81.900  -6.863   4.944
  546    HA   LEU  68           HA       LEU  68  83.040  -4.818   6.688
  547   1HB   LEU  68          2HB       LEU  68  80.777  -4.882   4.674
  548   2HB   LEU  68          1HB       LEU  68  81.279  -3.413   5.507
  549    HG   LEU  68           HG       LEU  68  83.061  -5.140   3.755
  550   1HD1  LEU  68          1HD1      LEU  68  82.380  -2.290   3.161
  551   2HD1  LEU  68          2HD1      LEU  68  81.159  -3.516   2.821
  552   3HD1  LEU  68          3HD1      LEU  68  82.742  -3.611   2.050
  553   1HD2  LEU  68          1HD2      LEU  68  84.539  -3.013   4.003
  554   2HD2  LEU  68          2HD2      LEU  68  84.494  -4.143   5.356
  555   3HD2  LEU  68          3HD2      LEU  68  83.541  -2.660   5.414
  556    H    ARG  69           H        ARG  69  80.042  -6.736   6.647
  557    HA   ARG  69           HA       ARG  69  78.508  -5.267   8.560
  558   1HB   ARG  69          2HB       ARG  69  78.766  -8.279   8.226
  559   2HB   ARG  69          1HB       ARG  69  77.405  -7.436   8.953
  560   1HG   ARG  69          2HG       ARG  69  77.078  -6.272   6.717
  561   2HG   ARG  69          1HG       ARG  69  78.259  -7.404   6.053
  562   1HD   ARG  69          2HD       ARG  69  76.715  -9.193   7.302
  563   2HD   ARG  69          1HD       ARG  69  75.488  -7.939   7.050
  564    HE   ARG  69           HE       ARG  69  76.669  -8.053   4.590
  565   1HH1  ARG  69          1HH1      ARG  69  75.424 -10.573   6.698
  566   2HH1  ARG  69          2HH1      ARG  69  75.059 -11.624   5.376
  567   1HH2  ARG  69          1HH2      ARG  69  76.167  -9.453   2.932
  568   2HH2  ARG  69          2HH2      ARG  69  75.472 -11.002   3.272
  569    H    ASP  70           H        ASP  70  80.885  -7.878   9.007
  570    HA   ASP  70           HA       ASP  70  80.640  -8.021  11.871
  571   1HB   ASP  70          2HB       ASP  70  81.510  -9.786  10.308
  572   2HB   ASP  70          1HB       ASP  70  82.963  -8.811  10.082
  573    H    VAL  71           H        VAL  71  83.122  -6.505   9.779
  574    HA   VAL  71           HA       VAL  71  84.792  -5.499  11.860
  575    HB   VAL  71           HB       VAL  71  84.180  -4.483   9.060
  576   1HG1  VAL  71          1HG1      VAL  71  86.394  -3.390   9.173
  577   2HG1  VAL  71          2HG1      VAL  71  86.551  -3.889  10.857
  578   3HG1  VAL  71          3HG1      VAL  71  85.295  -2.741  10.391
  579   1HG2  VAL  71          1HG2      VAL  71  85.758  -5.984   8.290
  580   2HG2  VAL  71          2HG2      VAL  71  85.151  -6.894   9.674
  581   3HG2  VAL  71          3HG2      VAL  71  86.654  -5.982   9.809
  582    H    ILE  72           H        ILE  72  81.943  -4.095  10.298
  583    HA   ILE  72           HA       ILE  72  82.195  -1.535  11.676
  584    HB   ILE  72           HB       ILE  72  79.988  -2.785  10.000
  585   1HG1  ILE  72          2HG1      ILE  72  82.164  -0.814   9.231
  586   2HG1  ILE  72          1HG1      ILE  72  82.230  -2.543   8.894
  587   1HG2  ILE  72          1HG2      ILE  72  80.453   0.168  10.393
  588   2HG2  ILE  72          2HG2      ILE  72  79.459  -0.733  11.536
  589   3HG2  ILE  72          3HG2      ILE  72  78.997  -0.655   9.838
  590   1HD1  ILE  72          1HD1      ILE  72  79.884  -2.158   7.798
  591   2HD1  ILE  72          2HD1      ILE  72  81.334  -1.692   6.907
  592   3HD1  ILE  72          3HD1      ILE  72  80.386  -0.465   7.748
  593    H    GLY  73           H        GLY  73  80.699  -4.595  12.456
  594   1HA   GLY  73          2HA       GLY  73  79.663  -5.220  14.475
  595   2HA   GLY  73          1HA       GLY  73  79.897  -3.568  15.049
  596    H    ILE  74           H        ILE  74  78.194  -4.459  12.081
  597    HA   ILE  74           HA       ILE  74  75.895  -2.841  12.974
  598    HB   ILE  74           HB       ILE  74  76.508  -4.269  10.363
  599   1HG1  ILE  74          2HG1      ILE  74  78.243  -2.615  10.937
  600   2HG1  ILE  74          1HG1      ILE  74  77.273  -2.044   9.583
  601   1HG2  ILE  74          1HG2      ILE  74  74.274  -3.768  10.121
  602   2HG2  ILE  74          2HG2      ILE  74  74.956  -2.214   9.641
  603   3HG2  ILE  74          3HG2      ILE  74  74.337  -2.438  11.277
  604   1HD1  ILE  74          1HD1      ILE  74  75.853  -0.825  11.380
  605   2HD1  ILE  74          2HD1      ILE  74  77.439  -0.155  10.998
  606   3HD1  ILE  74          3HD1      ILE  74  77.218  -1.120  12.457
  607    H    LYS  75           H        LYS  75  73.821  -3.622  13.329
  608    HA   LYS  75           HA       LYS  75  73.402  -6.589  13.156
  609   1HB   LYS  75          2HB       LYS  75  72.861  -4.604  15.374
  610   2HB   LYS  75          1HB       LYS  75  72.112  -6.201  15.342
  611   1HG   LYS  75          2HG       LYS  75  74.083  -7.287  15.790
  612   2HG   LYS  75          1HG       LYS  75  75.055  -6.104  14.916
  613   1HD   LYS  75          2HD       LYS  75  74.838  -4.505  16.735
  614   2HD   LYS  75          1HD       LYS  75  73.730  -5.579  17.591
  615   1HE   LYS  75          2HE       LYS  75  75.475  -7.222  17.942
  616   2HE   LYS  75          1HE       LYS  75  76.592  -6.323  16.893
  617   1HZ   LYS  75          1HZ       LYS  75  76.449  -4.438  18.371
  618   2HZ   LYS  75          2HZ       LYS  75  76.938  -5.806  19.254
  619   3HZ   LYS  75          3HZ       LYS  75  75.337  -5.248  19.363
  620    HA   PRO  76           HA       PRO  76  69.567  -5.791  11.154
  621   1HB   PRO  76          2HB       PRO  76  67.772  -7.331  12.642
  622   2HB   PRO  76          1HB       PRO  76  68.779  -7.931  11.312
  623   1HG   PRO  76          2HG       PRO  76  69.181  -8.157  14.239
  624   2HG   PRO  76          1HG       PRO  76  69.604  -9.290  12.946
  625   1HD   PRO  76          2HD       PRO  76  71.440  -7.753  14.197
  626   2HD   PRO  76          1HD       PRO  76  71.595  -8.240  12.494
  627    H    GLY  77           H        GLY  77  68.095  -4.135  11.306
  628   1HA   GLY  77          2HA       GLY  77  66.365  -2.847  12.325
  629   2HA   GLY  77          1HA       GLY  77  66.814  -3.521  13.888
  630    H    GLU  78           H        GLU  78  69.688  -2.525  12.499
  631    HA   GLU  78           HA       GLU  78  69.647   0.000  14.070
  632   1HB   GLU  78          2HB       GLU  78  71.650  -1.980  13.113
  633   2HB   GLU  78          1HB       GLU  78  72.203  -0.309  13.239
  634   1HG   GLU  78          2HG       GLU  78  71.288  -0.249  15.577
  635   2HG   GLU  78          1HG       GLU  78  70.938  -1.971  15.437
  636    H    VAL  79           H        VAL  79  69.607   1.954  13.083
  637    HA   VAL  79           HA       VAL  79  69.371   1.999  10.150
  638    HB   VAL  79           HB       VAL  79  67.730   3.076  11.677
  639   1HG1  VAL  79          1HG1      VAL  79  70.062   4.894  12.357
  640   2HG1  VAL  79          2HG1      VAL  79  69.196   3.840  13.471
  641   3HG1  VAL  79          3HG1      VAL  79  68.384   5.234  12.766
  642   1HG2  VAL  79          1HG2      VAL  79  67.611   5.226  10.469
  643   2HG2  VAL  79          2HG2      VAL  79  68.006   3.901   9.376
  644   3HG2  VAL  79          3HG2      VAL  79  69.271   5.006   9.917
  645    H    ILE  80           H        ILE  80  70.803   2.892   8.769
  646    HA   ILE  80           HA       ILE  80  73.177   4.344   9.865
  647    HB   ILE  80           HB       ILE  80  74.486   3.138   8.123
  648   1HG1  ILE  80          2HG1      ILE  80  71.894   1.643   7.606
  649   2HG1  ILE  80          1HG1      ILE  80  72.583   2.864   6.536
  650   1HG2  ILE  80          1HG2      ILE  80  72.964   0.978   9.528
  651   2HG2  ILE  80          2HG2      ILE  80  73.788   2.189  10.510
  652   3HG2  ILE  80          3HG2      ILE  80  74.706   1.202   9.371
  653   1HD1  ILE  80          1HD1      ILE  80  74.741   1.236   6.881
  654   2HD1  ILE  80          2HD1      ILE  80  73.594   1.068   5.552
  655   3HD1  ILE  80          3HD1      ILE  80  73.429   0.063   6.992
  656    H    GLU  81           H        GLU  81  74.126   5.846   8.298
  657    HA   GLU  81           HA       GLU  81  72.149   6.984   6.372
  658   1HB   GLU  81          2HB       GLU  81  73.207   8.393   8.171
  659   2HB   GLU  81          1HB       GLU  81  74.780   8.063   7.446
  660   1HG   GLU  81          2HG       GLU  81  73.972   9.060   5.311
  661   2HG   GLU  81          1HG       GLU  81  72.451   9.467   6.107
  662    H    VAL  82           H        VAL  82  72.493   6.596   4.246
  663    HA   VAL  82           HA       VAL  82  75.029   5.237   3.467
  664    HB   VAL  82           HB       VAL  82  72.200   5.169   2.356
  665   1HG1  VAL  82          1HG1      VAL  82  73.110   3.118   1.153
  666   2HG1  VAL  82          2HG1      VAL  82  74.723   3.676   1.601
  667   3HG1  VAL  82          3HG1      VAL  82  73.704   4.669   0.559
  668   1HG2  VAL  82          1HG2      VAL  82  72.478   2.735   3.255
  669   2HG2  VAL  82          2HG2      VAL  82  72.140   4.023   4.412
  670   3HG2  VAL  82          3HG2      VAL  82  73.785   3.415   4.224
  671    H    LEU  83           H        LEU  83  76.311   6.206   2.005
  672    HA   LEU  83           HA       LEU  83  75.258   8.537   0.426
  673   1HB   LEU  83          2HB       LEU  83  78.135   7.918   1.209
  674   2HB   LEU  83          1HB       LEU  83  77.498   9.447   0.618
  675    HG   LEU  83           HG       LEU  83  76.793   8.164   3.276
  676   1HD1  LEU  83          1HD1      LEU  83  78.407  10.669   2.738
  677   2HD1  LEU  83          2HD1      LEU  83  79.138   9.088   3.028
  678   3HD1  LEU  83          3HD1      LEU  83  78.168   9.857   4.286
  679   1HD2  LEU  83          1HD2      LEU  83  74.929   9.444   2.797
  680   2HD2  LEU  83          2HD2      LEU  83  75.828  10.572   1.783
  681   3HD2  LEU  83          3HD2      LEU  83  75.955  10.672   3.539
  682    H    LEU  84           H        LEU  84  75.281   8.174  -1.800
  683    HA   LEU  84           HA       LEU  84  76.684   5.839  -2.943
  684   1HB   LEU  84          2HB       LEU  84  74.822   7.997  -3.875
  685   2HB   LEU  84          1HB       LEU  84  75.782   7.127  -5.076
  686    HG   LEU  84           HG       LEU  84  74.383   5.509  -2.994
  687   1HD1  LEU  84          1HD1      LEU  84  72.597   5.714  -5.197
  688   2HD1  LEU  84          2HD1      LEU  84  72.981   7.363  -4.710
  689   3HD1  LEU  84          3HD1      LEU  84  72.320   6.232  -3.535
  690   1HD2  LEU  84          1HD2      LEU  84  74.026   4.269  -5.367
  691   2HD2  LEU  84          2HD2      LEU  84  75.504   4.099  -4.420
  692   3HD2  LEU  84          3HD2      LEU  84  75.445   5.239  -5.765
  693    H    LEU  85           H        LEU  85  78.596   5.962  -4.117
  694    HA   LEU  85           HA       LEU  85  80.049   8.568  -3.951
  695   1HB   LEU  85          2HB       LEU  85  80.699   5.684  -3.556
  696   2HB   LEU  85          1HB       LEU  85  81.986   6.723  -4.175
  697    HG   LEU  85           HG       LEU  85  80.340   7.488  -1.759
  698   1HD1  LEU  85          1HD1      LEU  85  81.741   6.328  -0.331
  699   2HD1  LEU  85          2HD1      LEU  85  83.081   6.326  -1.477
  700   3HD1  LEU  85          3HD1      LEU  85  81.729   5.215  -1.699
  701   1HD2  LEU  85          1HD2      LEU  85  82.721   8.627  -1.389
  702   2HD2  LEU  85          2HD2      LEU  85  81.507   9.379  -2.424
  703   3HD2  LEU  85          3HD2      LEU  85  82.820   8.444  -3.140
  704    H    GLY  86           H        GLY  86  79.205   5.893  -6.114
  705   1HA   GLY  86          2HA       GLY  86  79.834   7.506  -8.473
  706   2HA   GLY  86          1HA       GLY  86  81.021   6.234  -8.204
  707    H    HIS  87           H        HIS  87  79.913   5.832 -10.491
  708    HA   HIS  87           HA       HIS  87  77.875   3.684 -10.090
  709   1HB   HIS  87          2HB       HIS  87  76.534   4.699 -11.927
  710   2HB   HIS  87          1HB       HIS  87  76.694   5.796 -10.561
  711    HD1  HIS  87           HD1      HIS  87  77.772   5.323 -14.118
  712    HD2  HIS  87           HD2      HIS  87  78.323   8.093 -11.053
  713    HE1  HIS  87           HE1      HIS  87  78.827   7.366 -15.180
  714    H    TYR  88           H        TYR  88  77.846   2.123 -11.843
  715    HA   TYR  88           HA       TYR  88  79.899   2.456 -13.981
  716   1HB   TYR  88          2HB       TYR  88  79.577   0.123 -12.066
  717   2HB   TYR  88          1HB       TYR  88  80.595   0.077 -13.507
  718    HD1  TYR  88           HD1      TYR  88  80.261   1.308 -10.054
  719    HD2  TYR  88           HD2      TYR  88  82.578   1.630 -13.728
  720    HE1  TYR  88           HE1      TYR  88  82.120   2.430  -8.784
  721    HE2  TYR  88           HE2      TYR  88  84.436   2.751 -12.458
  722    HH   TYR  88           HH       TYR  88  85.022   2.603  -9.514
  723    H    LYS  89           H        LYS  89  79.282   1.471 -15.935
  724    HA   LYS  89           HA       LYS  89  76.600   0.117 -15.959
  725   1HB   LYS  89          2HB       LYS  89  76.967   2.469 -16.982
  726   2HB   LYS  89          1HB       LYS  89  77.879   1.632 -18.240
  727   1HG   LYS  89          2HG       LYS  89  76.006   0.530 -19.058
  728   2HG   LYS  89          1HG       LYS  89  75.157   0.610 -17.515
  729   1HD   LYS  89          2HD       LYS  89  75.791   3.206 -18.824
  730   2HD   LYS  89          1HD       LYS  89  74.539   2.222 -19.582
  731   1HE   LYS  89          2HE       LYS  89  73.395   2.047 -17.350
  732   2HE   LYS  89          1HE       LYS  89  74.589   3.191 -16.703
  733   1HZ   LYS  89          1HZ       LYS  89  73.976   4.785 -18.371
  734   2HZ   LYS  89          2HZ       LYS  89  72.569   4.302 -17.549
  735   3HZ   LYS  89          3HZ       LYS  89  72.905   3.691 -19.100
  736    HA   PRO  90           HA       PRO  90  78.523  -3.515 -17.654
  737   1HB   PRO  90          2HB       PRO  90  76.248  -3.459 -19.615
  738   2HB   PRO  90          1HB       PRO  90  76.818  -4.797 -18.590
  739   1HG   PRO  90          2HG       PRO  90  74.644  -3.536 -17.895
  740   2HG   PRO  90          1HG       PRO  90  75.871  -3.875 -16.658
  741   1HD   PRO  90          2HD       PRO  90  75.323  -1.302 -18.103
  742   2HD   PRO  90          1HD       PRO  90  75.618  -1.579 -16.368
  743    H    ARG  91           H        ARG  91  79.992  -3.936 -19.325
  744    HA   ARG  91           HA       ARG  91  79.866  -2.232 -21.782
  745   1HB   ARG  91          2HB       ARG  91  82.300  -1.826 -21.508
  746   2HB   ARG  91          1HB       ARG  91  81.388  -1.217 -20.128
  747   1HG   ARG  91          2HG       ARG  91  81.886  -3.411 -18.957
  748   2HG   ARG  91          1HG       ARG  91  82.987  -3.787 -20.283
  749   1HD   ARG  91          2HD       ARG  91  84.220  -1.653 -19.806
  750   2HD   ARG  91          1HD       ARG  91  83.181  -1.420 -18.387
  751    HE   ARG  91           HE       ARG  91  84.317  -3.190 -17.309
  752   1HH1  ARG  91          1HH1      ARG  91  85.048  -3.221 -20.741
  753   2HH1  ARG  91          2HH1      ARG  91  86.254  -4.447 -20.567
  754   1HH2  ARG  91          1HH2      ARG  91  85.883  -4.772 -17.146
  755   2HH2  ARG  91          2HH2      ARG  91  86.721  -5.316 -18.560
  756    H    ASN  92           H        ASN  92  81.090  -3.168 -23.595
  757    HA   ASN  92           HA       ASN  92  81.137  -6.144 -23.498
  758   1HB   ASN  92          2HB       ASN  92  79.869  -4.699 -25.204
  759   2HB   ASN  92          1HB       ASN  92  81.449  -4.304 -25.880
  760   1HD2  ASN  92          1HD2      ASN  92  79.670  -5.679 -27.527
  761   2HD2  ASN  92          2HD2      ASN  92  80.175  -7.288 -27.719
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1  82.557  14.711   1.224
    2   2H    MET   1          2H        MET   1  83.875  13.693   1.561
    3   3H    MET   1          3H        MET   1  82.339  13.029   1.265
    4    HA   MET   1           HA       MET   1  84.066  14.442  -0.704
    5   1HB   MET   1          2HB       MET   1  83.218  11.593  -0.153
    6   2HB   MET   1          1HB       MET   1  83.865  12.082  -1.719
    7   1HG   MET   1          2HG       MET   1  85.880  12.982  -0.561
    8   2HG   MET   1          1HG       MET   1  85.251  12.352   0.962
    9   1HE   MET   1          1HE       MET   1  85.118   8.593   0.523
   10   2HE   MET   1          2HE       MET   1  83.827   9.563  -0.179
   11   3HE   MET   1          3HE       MET   1  84.545  10.045   1.355
   12    H    ASP   2           H        ASP   2  83.003  13.441  -2.947
   13    HA   ASP   2           HA       ASP   2  80.460  14.839  -3.242
   14   1HB   ASP   2          2HB       ASP   2  82.077  13.016  -5.055
   15   2HB   ASP   2          1HB       ASP   2  80.695  13.973  -5.586
   16    H    VAL   3           H        VAL   3  78.402  13.925  -3.416
   17    HA   VAL   3           HA       VAL   3  78.196  10.958  -3.217
   18    HB   VAL   3           HB       VAL   3  77.870  12.406  -1.083
   19   1HG1  VAL   3          1HG1      VAL   3  75.124  12.836  -2.283
   20   2HG1  VAL   3          2HG1      VAL   3  76.364  14.094  -2.215
   21   3HG1  VAL   3          3HG1      VAL   3  75.713  13.416  -0.722
   22   1HG2  VAL   3          1HG2      VAL   3  75.637  10.531  -1.902
   23   2HG2  VAL   3          2HG2      VAL   3  76.151  10.896  -0.254
   24   3HG2  VAL   3          3HG2      VAL   3  77.226  10.011  -1.339
   25    H    LEU   4           H        LEU   4  76.772  10.092  -4.692
   26    HA   LEU   4           HA       LEU   4  75.478  11.875  -6.635
   27   1HB   LEU   4          2HB       LEU   4  75.366   8.854  -6.356
   28   2HB   LEU   4          1HB       LEU   4  75.027   9.789  -7.808
   29    HG   LEU   4           HG       LEU   4  77.714   9.455  -6.429
   30   1HD1  LEU   4          1HD1      LEU   4  76.477   8.488  -8.990
   31   2HD1  LEU   4          2HD1      LEU   4  77.393   7.583  -7.784
   32   3HD1  LEU   4          3HD1      LEU   4  78.225   8.689  -8.878
   33   1HD2  LEU   4          1HD2      LEU   4  78.464  10.793  -8.563
   34   2HD2  LEU   4          2HD2      LEU   4  77.853  11.684  -7.165
   35   3HD2  LEU   4          3HD2      LEU   4  76.804  11.390  -8.555
   36    H    ALA   5           H        ALA   5  74.554  10.162  -3.741
   37    HA   ALA   5           HA       ALA   5  71.978  11.448  -3.662
   38   1HB   ALA   5          1HB       ALA   5  72.023   9.266  -5.309
   39   2HB   ALA   5          2HB       ALA   5  70.585   9.794  -4.434
   40   3HB   ALA   5          3HB       ALA   5  71.595   8.507  -3.774
   41    H    LYS   6           H        LYS   6  70.968  11.081  -1.582
   42    HA   LYS   6           HA       LYS   6  72.632   9.516   0.373
   43   1HB   LYS   6          2HB       LYS   6  73.110  11.974   0.291
   44   2HB   LYS   6          1HB       LYS   6  71.421  12.285   0.690
   45   1HG   LYS   6          2HG       LYS   6  71.682  11.049   2.802
   46   2HG   LYS   6          1HG       LYS   6  73.367  10.720   2.405
   47   1HD   LYS   6          2HD       LYS   6  73.543  13.322   2.149
   48   2HD   LYS   6          1HD       LYS   6  72.077  13.334   3.132
   49   1HE   LYS   6          2HE       LYS   6  73.448  11.673   4.665
   50   2HE   LYS   6          1HE       LYS   6  74.844  12.431   3.874
   51   1HZ   LYS   6          1HZ       LYS   6  74.291  13.776   5.739
   52   2HZ   LYS   6          2HZ       LYS   6  72.641  13.785   5.335
   53   3HZ   LYS   6          3HZ       LYS   6  73.760  14.613   4.363
   54    H    PHE   7           H        PHE   7  71.347   8.105   1.527
   55    HA   PHE   7           HA       PHE   7  68.587   8.914   2.264
   56   1HB   PHE   7          2HB       PHE   7  67.641   6.895   1.219
   57   2HB   PHE   7          1HB       PHE   7  68.472   7.882   0.022
   58    HD1  PHE   7           HD1      PHE   7  68.185   4.595   1.467
   59    HD2  PHE   7           HD2      PHE   7  70.991   7.288  -0.497
   60    HE1  PHE   7           HE1      PHE   7  69.637   2.636   0.850
   61    HE2  PHE   7           HE2      PHE   7  72.443   5.327  -1.107
   62    HZ   PHE   7           HZ       PHE   7  71.766   2.998  -0.429
   63    H    HIS   8           H        HIS   8  67.624   7.381   3.855
   64    HA   HIS   8           HA       HIS   8  69.762   6.122   5.550
   65   1HB   HIS   8          2HB       HIS   8  67.038   7.316   6.189
   66   2HB   HIS   8          1HB       HIS   8  68.141   6.634   7.383
   67    HD1  HIS   8           HD1      HIS   8  70.408   7.923   7.785
   68    HD2  HIS   8           HD2      HIS   8  67.712   9.901   5.297
   69    HE1  HIS   8           HE1      HIS   8  71.227  10.313   7.596
   70    H    THR   9           H        THR   9  69.520   3.985   6.131
   71    HA   THR   9           HA       THR   9  66.904   2.636   5.908
   72    HB   THR   9           HB       THR   9  67.997   2.565   3.636
   73    HG1  THR   9           HG1      THR   9  67.746   0.114   5.033
   74   1HG2  THR   9          1HG2      THR   9  70.347   2.481   4.360
   75   2HG2  THR   9          2HG2      THR   9  69.965   1.095   3.337
   76   3HG2  THR   9          3HG2      THR   9  70.071   0.897   5.088
   77    H    THR  10           H        THR  10  67.029   0.418   6.943
   78    HA   THR  10           HA       THR  10  69.286   0.297   8.902
   79    HB   THR  10           HB       THR  10  66.880   0.664   9.708
   80    HG1  THR  10           HG1      THR  10  67.634  -0.157  11.448
   81   1HG2  THR  10          1HG2      THR  10  66.283  -1.483   8.061
   82   2HG2  THR  10          2HG2      THR  10  65.238  -0.846   9.333
   83   3HG2  THR  10          3HG2      THR  10  66.316  -2.204   9.673
   84    H    VAL  11           H        VAL  11  70.045  -1.888   9.462
   85    HA   VAL  11           HA       VAL  11  70.444  -3.503   7.064
   86    HB   VAL  11           HB       VAL  11  71.235  -3.929   9.969
   87   1HG1  VAL  11          1HG1      VAL  11  73.099  -5.276   8.845
   88   2HG1  VAL  11          2HG1      VAL  11  72.126  -5.211   7.376
   89   3HG1  VAL  11          3HG1      VAL  11  71.494  -6.007   8.817
   90   1HG2  VAL  11          1HG2      VAL  11  72.223  -2.146   7.841
   91   2HG2  VAL  11          2HG2      VAL  11  73.486  -3.142   8.561
   92   3HG2  VAL  11          3HG2      VAL  11  72.509  -2.087   9.581
   93    H    HIS  12           H        HIS  12  69.448  -5.396   6.539
   94    HA   HIS  12           HA       HIS  12  67.564  -6.626   8.521
   95   1HB   HIS  12          2HB       HIS  12  67.438  -6.164   5.561
   96   2HB   HIS  12          1HB       HIS  12  66.615  -7.573   6.236
   97    HD1  HIS  12           HD1      HIS  12  66.887  -3.860   7.139
   98    HD2  HIS  12           HD2      HIS  12  64.055  -6.915   6.995
   99    HE1  HIS  12           HE1      HIS  12  64.692  -2.836   7.877
  100    H    ARG  13           H        ARG  13  67.295  -9.041   8.002
  101    HA   ARG  13           HA       ARG  13  69.559 -10.494   8.602
  102   1HB   ARG  13          2HB       ARG  13  67.127 -11.191   6.947
  103   2HB   ARG  13          1HB       ARG  13  68.265 -12.415   7.523
  104   1HG   ARG  13          2HG       ARG  13  67.877 -11.641   9.854
  105   2HG   ARG  13          1HG       ARG  13  66.695 -10.478   9.253
  106   1HD   ARG  13          2HD       ARG  13  65.488 -12.457  10.008
  107   2HD   ARG  13          1HD       ARG  13  65.432 -12.437   8.234
  108    HE   ARG  13           HE       ARG  13  66.838 -14.330   8.216
  109   1HH1  ARG  13          1HH1      ARG  13  66.995 -12.783  11.363
  110   2HH1  ARG  13          2HH1      ARG  13  67.968 -14.044  12.036
  111   1HH2  ARG  13          1HH2      ARG  13  68.095 -15.926   9.140
  112   2HH2  ARG  13          2HH2      ARG  13  68.584 -15.800  10.797
  113    H    ILE  14           H        ILE  14  71.078 -11.764   7.431
  114    HA   ILE  14           HA       ILE  14  72.624 -12.253   5.733
  115    HB   ILE  14           HB       ILE  14  70.408 -11.319   3.878
  116   1HG1  ILE  14          2HG1      ILE  14  70.995 -14.151   4.779
  117   2HG1  ILE  14          1HG1      ILE  14  69.777 -13.140   5.561
  118   1HG2  ILE  14          1HG2      ILE  14  71.663 -13.258   2.539
  119   2HG2  ILE  14          2HG2      ILE  14  73.013 -12.732   3.544
  120   3HG2  ILE  14          3HG2      ILE  14  72.213 -11.584   2.472
  121   1HD1  ILE  14          1HD1      ILE  14  69.029 -12.770   3.010
  122   2HD1  ILE  14          2HD1      ILE  14  68.430 -14.122   3.973
  123   3HD1  ILE  14          3HD1      ILE  14  69.762 -14.366   2.843
  124    H    GLY  15           H        GLY  15  71.836  -9.164   6.575
  125   1HA   GLY  15          2HA       GLY  15  73.099  -7.195   6.286
  126   2HA   GLY  15          1HA       GLY  15  74.108  -8.061   5.130
  127    H    ARG  16           H        ARG  16  70.719  -8.272   4.492
  128    HA   ARG  16           HA       ARG  16  71.089  -6.819   1.974
  129   1HB   ARG  16          2HB       ARG  16  69.881  -8.964   2.181
  130   2HB   ARG  16          1HB       ARG  16  68.720  -8.211   3.271
  131   1HG   ARG  16          2HG       ARG  16  68.107  -6.615   1.439
  132   2HG   ARG  16          1HG       ARG  16  69.174  -7.515   0.355
  133   1HD   ARG  16          2HD       ARG  16  67.855  -9.582   0.797
  134   2HD   ARG  16          1HD       ARG  16  66.750  -8.635   1.810
  135    HE   ARG  16           HE       ARG  16  66.790  -7.173  -0.502
  136   1HH1  ARG  16          1HH1      ARG  16  66.288 -10.598   0.095
  137   2HH1  ARG  16          2HH1      ARG  16  65.266 -10.782  -1.286
  138   1HH2  ARG  16          1HH2      ARG  16  65.458  -7.477  -2.269
  139   2HH2  ARG  16          2HH2      ARG  16  64.802  -9.042  -2.607
  140    H    ILE  17           H        ILE  17  70.118  -4.855   1.423
  141    HA   ILE  17           HA       ILE  17  68.251  -3.602   3.379
  142    HB   ILE  17           HB       ILE  17  69.428  -1.444   3.098
  143   1HG1  ILE  17          2HG1      ILE  17  71.577  -2.979   1.610
  144   2HG1  ILE  17          1HG1      ILE  17  70.323  -2.057   0.782
  145   1HG2  ILE  17          1HG2      ILE  17  71.614  -3.372   3.787
  146   2HG2  ILE  17          2HG2      ILE  17  70.146  -3.374   4.763
  147   3HG2  ILE  17          3HG2      ILE  17  71.111  -1.903   4.624
  148   1HD1  ILE  17          1HD1      ILE  17  71.277  -0.277   2.707
  149   2HD1  ILE  17          2HD1      ILE  17  71.682  -0.261   0.991
  150   3HD1  ILE  17          3HD1      ILE  17  72.728  -1.100   2.136
  151    H    ILE  18           H        ILE  18  66.754  -2.100   2.332
  152    HA   ILE  18           HA       ILE  18  66.684  -2.348  -0.663
  153    HB   ILE  18           HB       ILE  18  64.383  -1.973   1.285
  154   1HG1  ILE  18          2HG1      ILE  18  65.369  -4.210   1.559
  155   2HG1  ILE  18          1HG1      ILE  18  63.812  -4.332   0.746
  156   1HG2  ILE  18          1HG2      ILE  18  64.623  -2.197  -1.700
  157   2HG2  ILE  18          2HG2      ILE  18  63.611  -1.117  -0.737
  158   3HG2  ILE  18          3HG2      ILE  18  63.176  -2.820  -0.904
  159   1HD1  ILE  18          1HD1      ILE  18  65.430  -4.087  -1.412
  160   2HD1  ILE  18          2HD1      ILE  18  65.007  -5.646  -0.704
  161   3HD1  ILE  18          3HD1      ILE  18  66.540  -4.879  -0.293
  162    H    ILE  19           H        ILE  19  66.877  -0.422  -1.720
  163    HA   ILE  19           HA       ILE  19  66.890   2.121  -0.229
  164    HB   ILE  19           HB       ILE  19  67.101   1.474  -3.206
  165   1HG1  ILE  19          2HG1      ILE  19  69.199   1.868  -1.029
  166   2HG1  ILE  19          1HG1      ILE  19  68.875   0.381  -1.907
  167   1HG2  ILE  19          1HG2      ILE  19  67.963   3.719  -3.447
  168   2HG2  ILE  19          2HG2      ILE  19  68.002   3.958  -1.701
  169   3HG2  ILE  19          3HG2      ILE  19  66.455   3.848  -2.542
  170   1HD1  ILE  19          1HD1      ILE  19  70.611   2.561  -2.628
  171   2HD1  ILE  19          2HD1      ILE  19  69.371   2.364  -3.867
  172   3HD1  ILE  19          3HD1      ILE  19  70.406   1.005  -3.432
  173    HA   PRO  20           HA       PRO  20  62.554   2.998  -0.973
  174   1HB   PRO  20          2HB       PRO  20  62.680   5.735  -1.014
  175   2HB   PRO  20          1HB       PRO  20  62.730   4.798   0.489
  176   1HG   PRO  20          2HG       PRO  20  65.018   5.867  -1.128
  177   2HG   PRO  20          1HG       PRO  20  64.724   6.028   0.615
  178   1HD   PRO  20          2HD       PRO  20  66.414   4.192  -0.246
  179   2HD   PRO  20          1HD       PRO  20  65.239   3.768   1.028
  180    H    ALA  21           H        ALA  21  61.372   3.393  -2.853
  181    HA   ALA  21           HA       ALA  21  62.643   3.320  -5.379
  182   1HB   ALA  21          1HB       ALA  21  59.889   4.081  -4.403
  183   2HB   ALA  21          2HB       ALA  21  60.396   2.599  -5.213
  184   3HB   ALA  21          3HB       ALA  21  60.276   4.106  -6.124
  185    H    GLY  22           H        GLY  22  61.786   6.065  -3.351
  186   1HA   GLY  22          2HA       GLY  22  61.842   8.109  -5.376
  187   2HA   GLY  22          1HA       GLY  22  62.106   8.380  -3.652
  188    H    THR  23           H        THR  23  64.396   6.816  -3.239
  189    HA   THR  23           HA       THR  23  66.464   8.588  -4.214
  190    HB   THR  23           HB       THR  23  66.642   5.853  -2.907
  191    HG1  THR  23           HG1      THR  23  66.681   8.441  -1.753
  192   1HG2  THR  23          1HG2      THR  23  68.871   6.378  -2.373
  193   2HG2  THR  23          2HG2      THR  23  68.637   8.098  -2.684
  194   3HG2  THR  23          3HG2      THR  23  68.715   6.961  -4.029
  195    H    ARG  24           H        ARG  24  65.406   5.309  -5.138
  196    HA   ARG  24           HA       ARG  24  67.463   4.653  -7.026
  197   1HB   ARG  24          2HB       ARG  24  64.518   4.086  -7.451
  198   2HB   ARG  24          1HB       ARG  24  65.888   3.099  -7.939
  199   1HG   ARG  24          2HG       ARG  24  66.335   2.993  -5.333
  200   2HG   ARG  24          1HG       ARG  24  64.621   3.383  -5.247
  201   1HD   ARG  24          2HD       ARG  24  64.455   1.447  -7.082
  202   2HD   ARG  24          1HD       ARG  24  65.940   0.914  -6.260
  203    HE   ARG  24           HE       ARG  24  64.355   1.485  -4.139
  204   1HH1  ARG  24          1HH1      ARG  24  63.682  -0.368  -7.041
  205   2HH1  ARG  24          2HH1      ARG  24  62.508  -1.353  -6.244
  206   1HH2  ARG  24          1HH2      ARG  24  62.853   0.181  -3.168
  207   2HH2  ARG  24          2HH2      ARG  24  62.041  -1.050  -4.076
  208    H    LYS  25           H        LYS  25  64.488   6.540  -7.362
  209    HA   LYS  25           HA       LYS  25  64.602   6.989 -10.187
  210   1HB   LYS  25          2HB       LYS  25  62.625   7.285  -8.707
  211   2HB   LYS  25          1HB       LYS  25  63.414   8.664  -7.944
  212   1HG   LYS  25          2HG       LYS  25  63.479   9.825 -10.120
  213   2HG   LYS  25          1HG       LYS  25  62.665   8.453 -10.872
  214   1HD   LYS  25          2HD       LYS  25  60.765   8.778  -9.266
  215   2HD   LYS  25          1HD       LYS  25  61.561  10.245  -8.692
  216   1HE   LYS  25          2HE       LYS  25  60.178  11.162 -10.326
  217   2HE   LYS  25          1HE       LYS  25  61.599  10.788 -11.324
  218   1HZ   LYS  25          1HZ       LYS  25  60.655   8.620 -11.807
  219   2HZ   LYS  25          2HZ       LYS  25  59.576   9.844 -12.283
  220   3HZ   LYS  25          3HZ       LYS  25  59.295   8.967 -10.855
  221    H    PHE  26           H        PHE  26  65.609   9.072  -7.466
  222    HA   PHE  26           HA       PHE  26  66.621  11.270  -8.953
  223   1HB   PHE  26          2HB       PHE  26  66.220  11.168  -6.502
  224   2HB   PHE  26          1HB       PHE  26  67.602  10.086  -6.333
  225    HD1  PHE  26           HD1      PHE  26  69.804  10.945  -6.065
  226    HD2  PHE  26           HD2      PHE  26  66.632  13.512  -7.591
  227    HE1  PHE  26           HE1      PHE  26  71.350  12.928  -5.950
  228    HE2  PHE  26           HE2      PHE  26  68.177  15.494  -7.475
  229    HZ   PHE  26           HZ       PHE  26  70.536  15.200  -6.653
  230    H    TYR  27           H        TYR  27  68.205   8.245  -8.003
  231    HA   TYR  27           HA       TYR  27  70.807   9.079  -9.106
  232   1HB   TYR  27          2HB       TYR  27  70.463   7.770  -7.017
  233   2HB   TYR  27          1HB       TYR  27  69.792   6.457  -7.967
  234    HD1  TYR  27           HD1      TYR  27  72.794   7.916  -6.611
  235    HD2  TYR  27           HD2      TYR  27  71.318   5.442  -9.874
  236    HE1  TYR  27           HE1      TYR  27  75.101   6.980  -6.957
  237    HE2  TYR  27           HE2      TYR  27  73.624   4.507 -10.212
  238    HH   TYR  27           HH       TYR  27  76.048   4.728  -7.963
  239    H    GLY  28           H        GLY  28  67.982   7.478 -10.359
  240   1HA   GLY  28          2HA       GLY  28  67.594   6.692 -12.541
  241   2HA   GLY  28          1HA       GLY  28  69.256   7.126 -12.942
  242    H    ILE  29           H        ILE  29  68.092   4.899 -10.406
  243    HA   ILE  29           HA       ILE  29  70.056   2.888 -11.285
  244    HB   ILE  29           HB       ILE  29  68.015   2.912  -9.028
  245   1HG1  ILE  29          2HG1      ILE  29  70.978   3.561  -9.006
  246   2HG1  ILE  29          1HG1      ILE  29  69.689   4.758  -8.954
  247   1HG2  ILE  29          1HG2      ILE  29  69.248   0.700  -9.936
  248   2HG2  ILE  29          2HG2      ILE  29  68.974   0.976  -8.218
  249   3HG2  ILE  29          3HG2      ILE  29  70.546   1.336  -8.928
  250   1HD1  ILE  29          1HD1      ILE  29  68.969   3.040  -6.918
  251   2HD1  ILE  29          2HD1      ILE  29  69.842   4.557  -6.699
  252   3HD1  ILE  29          3HD1      ILE  29  70.732   3.035  -6.812
  253    H    GLU  30           H        GLU  30  69.583   1.173 -12.547
  254    HA   GLU  30           HA       GLU  30  66.767   0.163 -12.647
  255   1HB   GLU  30          2HB       GLU  30  67.426   1.464 -14.697
  256   2HB   GLU  30          1HB       GLU  30  68.743   0.317 -14.950
  257   1HG   GLU  30          2HG       GLU  30  67.070  -1.532 -15.035
  258   2HG   GLU  30          1HG       GLU  30  65.782  -0.340 -14.891
  259    H    GLN  31           H        GLN  31  66.684  -2.187 -12.927
  260    HA   GLN  31           HA       GLN  31  68.551  -3.678 -11.427
  261   1HB   GLN  31          2HB       GLN  31  66.218  -4.308 -12.119
  262   2HB   GLN  31          1HB       GLN  31  66.847  -4.672 -13.725
  263   1HG   GLN  31          2HG       GLN  31  68.443  -6.291 -12.678
  264   2HG   GLN  31          1HG       GLN  31  67.657  -6.000 -11.125
  265   1HE2  GLN  31          1HE2      GLN  31  66.092  -7.542 -10.659
  266   2HE2  GLN  31          2HE2      GLN  31  65.148  -8.357 -11.810
  267    H    GLY  32           H        GLY  32  70.421  -4.759 -11.912
  268   1HA   GLY  32          2HA       GLY  32  72.027  -5.847 -13.325
  269   2HA   GLY  32          1HA       GLY  32  71.279  -5.080 -14.724
  270    H    ASP  33           H        ASP  33  71.417  -2.442 -12.939
  271    HA   ASP  33           HA       ASP  33  73.957  -1.509 -14.061
  272   1HB   ASP  33          2HB       ASP  33  71.910  -0.327 -12.159
  273   2HB   ASP  33          1HB       ASP  33  73.274   0.576 -12.816
  274    H    PHE  34           H        PHE  34  75.760  -0.698 -12.741
  275    HA   PHE  34           HA       PHE  34  75.948  -2.007 -10.046
  276   1HB   PHE  34          2HB       PHE  34  77.990  -1.216 -12.141
  277   2HB   PHE  34          1HB       PHE  34  78.441  -1.692 -10.505
  278    HD1  PHE  34           HD1      PHE  34  76.936  -2.840 -13.717
  279    HD2  PHE  34           HD2      PHE  34  78.222  -4.008  -9.722
  280    HE1  PHE  34           HE1      PHE  34  76.760  -5.263 -14.369
  281    HE2  PHE  34           HE2      PHE  34  78.044  -6.431 -10.373
  282    HZ   PHE  34           HZ       PHE  34  77.312  -7.059 -12.696
  283    H    VAL  35           H        VAL  35  76.329  -0.659  -8.303
  284    HA   VAL  35           HA       VAL  35  77.056   2.187  -8.871
  285    HB   VAL  35           HB       VAL  35  75.454   2.846  -7.083
  286   1HG1  VAL  35          1HG1      VAL  35  73.427   2.504  -8.383
  287   2HG1  VAL  35          2HG1      VAL  35  74.145   1.121  -9.210
  288   3HG1  VAL  35          3HG1      VAL  35  74.773   2.743  -9.498
  289   1HG2  VAL  35          1HG2      VAL  35  74.833  -0.123  -7.095
  290   2HG2  VAL  35          2HG2      VAL  35  73.765   1.090  -6.384
  291   3HG2  VAL  35          3HG2      VAL  35  75.387   0.847  -5.730
  292    H    GLU  36           H        GLU  36  78.290   3.170  -7.124
  293    HA   GLU  36           HA       GLU  36  79.579   1.158  -5.305
  294   1HB   GLU  36          2HB       GLU  36  80.976   2.137  -7.146
  295   2HB   GLU  36          1HB       GLU  36  80.667   3.742  -6.483
  296   1HG   GLU  36          2HG       GLU  36  81.675   3.003  -4.322
  297   2HG   GLU  36          1HG       GLU  36  82.072   1.457  -5.071
  298    H    ILE  37           H        ILE  37  79.104   1.521  -3.205
  299    HA   ILE  37           HA       ILE  37  78.209   4.264  -2.405
  300    HB   ILE  37           HB       ILE  37  76.370   2.787  -3.125
  301   1HG1  ILE  37          2HG1      ILE  37  76.211   2.881  -0.122
  302   2HG1  ILE  37          1HG1      ILE  37  76.247   4.372  -1.061
  303   1HG2  ILE  37          1HG2      ILE  37  77.385   0.944  -0.942
  304   2HG2  ILE  37          2HG2      ILE  37  77.400   0.618  -2.676
  305   3HG2  ILE  37          3HG2      ILE  37  75.865   0.734  -1.814
  306   1HD1  ILE  37          1HD1      ILE  37  74.372   2.741  -2.383
  307   2HD1  ILE  37          2HD1      ILE  37  74.023   4.132  -1.359
  308   3HD1  ILE  37          3HD1      ILE  37  74.050   2.513  -0.665
  309    H    LYS  38           H        LYS  38  78.213   4.614  -0.066
  310    HA   LYS  38           HA       LYS  38  79.860   2.682   1.518
  311   1HB   LYS  38          2HB       LYS  38  81.104   4.704   0.587
  312   2HB   LYS  38          1HB       LYS  38  80.080   5.703   1.627
  313   1HG   LYS  38          2HG       LYS  38  80.848   4.429   3.599
  314   2HG   LYS  38          1HG       LYS  38  81.885   3.453   2.557
  315   1HD   LYS  38          2HD       LYS  38  83.106   5.491   1.868
  316   2HD   LYS  38          1HD       LYS  38  82.075   6.460   2.923
  317   1HE   LYS  38          2HE       LYS  38  82.913   5.313   4.897
  318   2HE   LYS  38          1HE       LYS  38  83.833   4.179   3.891
  319   1HZ   LYS  38          1HZ       LYS  38  84.168   7.131   3.851
  320   2HZ   LYS  38          2HZ       LYS  38  85.083   6.000   2.975
  321   3HZ   LYS  38          3HZ       LYS  38  85.197   6.060   4.669
  322    H    ILE  39           H        ILE  39  79.247   2.521   3.709
  323    HA   ILE  39           HA       ILE  39  76.798   4.068   4.510
  324    HB   ILE  39           HB       ILE  39  76.357   2.087   5.978
  325   1HG1  ILE  39          2HG1      ILE  39  78.597   0.745   4.442
  326   2HG1  ILE  39          1HG1      ILE  39  78.817   1.419   6.057
  327   1HG2  ILE  39          1HG2      ILE  39  75.091   1.776   4.119
  328   2HG2  ILE  39          2HG2      ILE  39  76.231   0.465   3.808
  329   3HG2  ILE  39          3HG2      ILE  39  76.448   2.029   3.021
  330   1HD1  ILE  39          1HD1      ILE  39  77.215  -0.955   5.196
  331   2HD1  ILE  39          2HD1      ILE  39  76.646  -0.021   6.579
  332   3HD1  ILE  39          3HD1      ILE  39  78.250  -0.755   6.609
  333    H    VAL  40           H        VAL  40  76.725   4.862   6.660
  334    HA   VAL  40           HA       VAL  40  79.188   4.591   8.322
  335    HB   VAL  40           HB       VAL  40  77.777   7.178   7.569
  336   1HG1  VAL  40          1HG1      VAL  40  78.630   7.334   9.832
  337   2HG1  VAL  40          2HG1      VAL  40  79.738   8.214   8.780
  338   3HG1  VAL  40          3HG1      VAL  40  80.163   6.602   9.357
  339   1HG2  VAL  40          1HG2      VAL  40  79.172   6.250   5.746
  340   2HG2  VAL  40          2HG2      VAL  40  80.539   6.122   6.856
  341   3HG2  VAL  40          3HG2      VAL  40  79.904   7.708   6.417
  342    H    LYS  41           H        LYS  41  78.574   4.032  10.346
  343    HA   LYS  41           HA       LYS  41  76.032   5.109  11.472
  344   1HB   LYS  41          2HB       LYS  41  75.642   2.821  10.636
  345   2HB   LYS  41          1HB       LYS  41  77.017   2.238  11.571
  346   1HG   LYS  41          2HG       LYS  41  74.940   1.764  12.781
  347   2HG   LYS  41          1HG       LYS  41  75.878   2.972  13.660
  348   1HD   LYS  41          2HD       LYS  41  74.477   4.750  12.909
  349   2HD   LYS  41          1HD       LYS  41  73.710   3.731  11.697
  350   1HE   LYS  41          2HE       LYS  41  72.212   4.002  13.640
  351   2HE   LYS  41          1HE       LYS  41  72.765   2.318  13.544
  352   1HZ   LYS  41          1HZ       LYS  41  74.463   2.745  15.128
  353   2HZ   LYS  41          2HZ       LYS  41  73.024   3.361  15.786
  354   3HZ   LYS  41          3HZ       LYS  41  74.169   4.415  15.106
  355    H    TYR  42           H        TYR  42  76.152   5.459  13.733
  356    HA   TYR  42           HA       TYR  42  78.935   5.514  14.812
  357   1HB   TYR  42          2HB       TYR  42  77.144   7.461  14.616
  358   2HB   TYR  42          1HB       TYR  42  76.547   6.768  16.126
  359    HD1  TYR  42           HD1      TYR  42  79.889   7.583  14.536
  360    HD2  TYR  42           HD2      TYR  42  77.414   7.690  18.118
  361    HE1  TYR  42           HE1      TYR  42  81.751   8.722  15.783
  362    HE2  TYR  42           HE2      TYR  42  79.276   8.830  19.369
  363    HH   TYR  42           HH       TYR  42  82.491   9.058  18.106
  364    H    GLU  43           H        GLU  43  79.528   4.101  16.414
  365    HA   GLU  43           HA       GLU  43  77.389   2.880  18.118
  366   1HB   GLU  43          2HB       GLU  43  79.714   1.497  16.737
  367   2HB   GLU  43          1HB       GLU  43  78.599   0.717  17.859
  368   1HG   GLU  43          2HG       GLU  43  76.707   1.328  16.349
  369   2HG   GLU  43          1HG       GLU  43  77.871   1.993  15.205
  370    H    GLY  44           H        GLY  44  77.937   2.876  20.270
  371   1HA   GLY  44          2HA       GLY  44  79.169   3.275  22.224
  372   2HA   GLY  44          1HA       GLY  44  80.568   2.653  21.350
  373    H    GLU  45           H        GLU  45  82.178   4.126  21.498
  374    HA   GLU  45           HA       GLU  45  81.504   7.031  21.305
  375   1HB   GLU  45          2HB       GLU  45  83.643   7.371  22.433
  376   2HB   GLU  45          1HB       GLU  45  82.701   6.175  23.317
  377   1HG   GLU  45          2HG       GLU  45  83.988   4.358  22.236
  378   2HG   GLU  45          1HG       GLU  45  84.928   5.554  21.347
  379    H    GLU  46           H        GLU  46  82.297   4.696  19.134
  380    HA   GLU  46           HA       GLU  46  84.085   6.533  17.583
  381   1HB   GLU  46          2HB       GLU  46  85.260   4.472  16.830
  382   2HB   GLU  46          1HB       GLU  46  85.334   4.671  18.580
  383   1HG   GLU  46          2HG       GLU  46  83.455   3.096  18.846
  384   2HG   GLU  46          1HG       GLU  46  83.366   2.901  17.095
  385    HA   PRO  47           HA       PRO  47  81.038   5.748  14.381
  386   1HB   PRO  47          2HB       PRO  47  82.406   6.802  12.254
  387   2HB   PRO  47          1HB       PRO  47  81.549   7.794  13.447
  388   1HG   PRO  47          2HG       PRO  47  84.444   7.266  13.164
  389   2HG   PRO  47          1HG       PRO  47  83.609   8.712  13.743
  390   1HD   PRO  47          2HD       PRO  47  84.849   6.838  15.354
  391   2HD   PRO  47          1HD       PRO  47  83.602   7.983  15.891
  392    H    LYS  48           H        LYS  48  80.735   4.014  12.997
  393    HA   LYS  48           HA       LYS  48  83.146   2.505  12.040
  394   1HB   LYS  48          2HB       LYS  48  80.327   1.553  12.657
  395   2HB   LYS  48          1HB       LYS  48  81.636   0.536  12.056
  396   1HG   LYS  48          2HG       LYS  48  81.796   2.118  14.634
  397   2HG   LYS  48          1HG       LYS  48  81.313   0.422  14.554
  398   1HD   LYS  48          2HD       LYS  48  83.479  -0.058  13.361
  399   2HD   LYS  48          1HD       LYS  48  83.967   1.603  13.700
  400   1HE   LYS  48          2HE       LYS  48  83.653   1.167  16.143
  401   2HE   LYS  48          1HE       LYS  48  83.287  -0.528  15.760
  402   1HZ   LYS  48          1HZ       LYS  48  85.748   0.885  14.879
  403   2HZ   LYS  48          2HZ       LYS  48  85.400  -0.769  14.703
  404   3HZ   LYS  48          3HZ       LYS  48  85.675  -0.116  16.247
  405    H    GLU  49           H        GLU  49  83.271   2.254   9.810
  406    HA   GLU  49           HA       GLU  49  80.875   2.963   8.166
  407   1HB   GLU  49          2HB       GLU  49  82.373   4.370   6.768
  408   2HB   GLU  49          1HB       GLU  49  82.311   4.940   8.434
  409   1HG   GLU  49          2HG       GLU  49  84.415   3.670   8.899
  410   2HG   GLU  49          1HG       GLU  49  84.498   3.247   7.190
  411    H    GLY  50           H        GLY  50  81.251   2.337   5.818
  412   1HA   GLY  50          2HA       GLY  50  83.277   0.298   5.262
  413   2HA   GLY  50          1HA       GLY  50  81.634  -0.333   5.392
  414    H    THR  51           H        THR  51  83.660   0.239   3.066
  415    HA   THR  51           HA       THR  51  81.623   1.531   1.270
  416    HB   THR  51           HB       THR  51  84.595   1.457   0.739
  417    HG1  THR  51           HG1      THR  51  84.916   2.810   2.286
  418   1HG2  THR  51          1HG2      THR  51  82.511   2.292  -0.782
  419   2HG2  THR  51          2HG2      THR  51  84.124   3.003  -0.876
  420   3HG2  THR  51          3HG2      THR  51  82.873   3.782   0.092
  421    H    PHE  52           H        PHE  52  81.063   0.316  -0.541
  422    HA   PHE  52           HA       PHE  52  82.862  -1.788  -1.530
  423   1HB   PHE  52          2HB       PHE  52  81.434  -3.645  -1.019
  424   2HB   PHE  52          1HB       PHE  52  81.565  -2.712   0.465
  425    HD1  PHE  52           HD1      PHE  52  79.326  -4.198  -1.926
  426    HD2  PHE  52           HD2      PHE  52  79.650  -0.937   0.944
  427    HE1  PHE  52           HE1      PHE  52  76.823  -3.991  -1.882
  428    HE2  PHE  52           HE2      PHE  52  77.141  -0.732   0.989
  429    HZ   PHE  52           HZ       PHE  52  75.730  -2.261  -0.432
  430    H    THR  53           H        THR  53  81.741  -2.968  -3.446
  431    HA   THR  53           HA       THR  53  80.048  -1.021  -4.979
  432    HB   THR  53           HB       THR  53  81.800  -3.320  -5.916
  433    HG1  THR  53           HG1      THR  53  83.336  -1.933  -5.695
  434   1HG2  THR  53          1HG2      THR  53  80.103  -2.929  -7.548
  435   2HG2  THR  53          2HG2      THR  53  81.532  -2.072  -8.129
  436   3HG2  THR  53          3HG2      THR  53  80.224  -1.179  -7.353
  437    H    ALA  54           H        ALA  54  78.052  -1.757  -5.735
  438    HA   ALA  54           HA       ALA  54  77.313  -4.611  -5.254
  439   1HB   ALA  54          1HB       ALA  54  75.835  -4.026  -3.617
  440   2HB   ALA  54          2HB       ALA  54  75.289  -2.605  -4.506
  441   3HB   ALA  54          3HB       ALA  54  76.753  -2.524  -3.531
  442    H    ARG  55           H        ARG  55  75.732  -5.399  -6.668
  443    HA   ARG  55           HA       ARG  55  74.994  -3.651  -8.964
  444   1HB   ARG  55          2HB       ARG  55  75.971  -6.015  -9.151
  445   2HB   ARG  55          1HB       ARG  55  74.418  -6.591  -8.540
  446   1HG   ARG  55          2HG       ARG  55  73.251  -5.495 -10.394
  447   2HG   ARG  55          1HG       ARG  55  74.777  -4.853 -10.997
  448   1HD   ARG  55          2HD       ARG  55  74.315  -6.803 -12.313
  449   2HD   ARG  55          1HD       ARG  55  75.562  -7.303 -11.165
  450    HE   ARG  55           HE       ARG  55  72.689  -8.029 -11.053
  451   1HH1  ARG  55          1HH1      ARG  55  75.813  -8.092  -9.441
  452   2HH1  ARG  55          2HH1      ARG  55  75.340  -9.377  -8.395
  453   1HH2  ARG  55          1HH2      ARG  55  72.149  -9.677  -9.667
  454   2HH2  ARG  55          2HH2      ARG  55  73.300 -10.262  -8.512
  455    H    VAL  56           H        VAL  56  72.829  -3.185  -9.420
  456    HA   VAL  56           HA       VAL  56  70.968  -3.219  -7.167
  457    HB   VAL  56           HB       VAL  56  70.762  -2.332 -10.065
  458   1HG1  VAL  56          1HG1      VAL  56  68.992  -1.015  -8.133
  459   2HG1  VAL  56          2HG1      VAL  56  68.644  -2.735  -8.290
  460   3HG1  VAL  56          3HG1      VAL  56  68.620  -1.698  -9.716
  461   1HG2  VAL  56          1HG2      VAL  56  71.593  -0.299  -9.388
  462   2HG2  VAL  56          2HG2      VAL  56  72.380  -1.305  -8.172
  463   3HG2  VAL  56          3HG2      VAL  56  70.897  -0.439  -7.773
  464    H    GLY  57           H        GLY  57  69.540  -4.800  -6.760
  465   1HA   GLY  57          2HA       GLY  57  68.925  -6.790  -8.895
  466   2HA   GLY  57          1HA       GLY  57  68.730  -7.078  -7.164
  467    H    GLU  58           H        GLU  58  66.533  -7.760  -8.092
  468    HA   GLU  58           HA       GLU  58  64.624  -5.859  -9.059
  469   1HB   GLU  58          2HB       GLU  58  64.542  -8.419  -8.994
  470   2HB   GLU  58          1HB       GLU  58  64.071  -8.265  -7.301
  471   1HG   GLU  58          2HG       GLU  58  62.166  -6.803  -8.018
  472   2HG   GLU  58          1HG       GLU  58  62.600  -7.121  -9.693
  473    H    GLN  59           H        GLN  59  62.896  -4.818  -7.871
  474    HA   GLN  59           HA       GLN  59  62.078  -3.435  -6.154
  475   1HB   GLN  59          2HB       GLN  59  63.255  -5.716  -4.538
  476   2HB   GLN  59          1HB       GLN  59  62.165  -4.494  -3.887
  477   1HG   GLN  59          2HG       GLN  59  61.505  -6.335  -6.205
  478   2HG   GLN  59          1HG       GLN  59  60.966  -6.578  -4.545
  479   1HE2  GLN  59          1HE2      GLN  59  59.687  -5.610  -7.342
  480   2HE2  GLN  59          2HE2      GLN  59  58.656  -4.365  -6.823
  481    H    GLY  60           H        GLY  60  65.140  -3.302  -6.978
  482   1HA   GLY  60          2HA       GLY  60  66.757  -1.678  -6.471
  483   2HA   GLY  60          1HA       GLY  60  65.621  -1.025  -5.294
  484    H    SER  61           H        SER  61  66.492  -4.369  -4.943
  485    HA   SER  61           HA       SER  61  67.505  -3.842  -2.271
  486   1HB   SER  61          2HB       SER  61  67.496  -6.239  -2.114
  487   2HB   SER  61          1HB       SER  61  66.123  -5.810  -3.130
  488    HG   SER  61           HG       SER  61  67.023  -6.977  -4.614
  489    H    VAL  62           H        VAL  62  69.618  -4.077  -1.515
  490    HA   VAL  62           HA       VAL  62  71.761  -4.853  -3.425
  491    HB   VAL  62           HB       VAL  62  71.557  -2.393  -3.474
  492   1HG1  VAL  62          1HG1      VAL  62  72.119  -2.516  -0.497
  493   2HG1  VAL  62          2HG1      VAL  62  70.542  -2.163  -1.203
  494   3HG1  VAL  62          3HG1      VAL  62  71.891  -1.057  -1.464
  495   1HG2  VAL  62          1HG2      VAL  62  73.831  -3.698  -3.372
  496   2HG2  VAL  62          2HG2      VAL  62  73.979  -2.950  -1.782
  497   3HG2  VAL  62          3HG2      VAL  62  73.839  -1.941  -3.222
  498    H    ILE  63           H        ILE  63  73.515  -5.902  -2.358
  499    HA   ILE  63           HA       ILE  63  72.983  -6.581   0.512
  500    HB   ILE  63           HB       ILE  63  74.516  -8.057  -1.656
  501   1HG1  ILE  63          2HG1      ILE  63  72.114  -7.924  -2.189
  502   2HG1  ILE  63          1HG1      ILE  63  72.547  -9.566  -1.720
  503   1HG2  ILE  63          1HG2      ILE  63  75.354  -8.839   0.399
  504   2HG2  ILE  63          2HG2      ILE  63  74.070  -9.988   0.021
  505   3HG2  ILE  63          3HG2      ILE  63  73.786  -8.703   1.195
  506   1HD1  ILE  63          1HD1      ILE  63  71.727  -9.093   0.586
  507   2HD1  ILE  63          2HD1      ILE  63  70.455  -8.923  -0.622
  508   3HD1  ILE  63          3HD1      ILE  63  71.225  -7.488   0.056
  509    H    ILE  64           H        ILE  64  74.416  -5.791   1.976
  510    HA   ILE  64           HA       ILE  64  77.018  -4.647   1.193
  511    HB   ILE  64           HB       ILE  64  75.697  -5.198   3.878
  512   1HG1  ILE  64          2HG1      ILE  64  75.953  -2.549   2.438
  513   2HG1  ILE  64          1HG1      ILE  64  74.555  -3.603   2.211
  514   1HG2  ILE  64          1HG2      ILE  64  77.320  -3.649   4.808
  515   2HG2  ILE  64          2HG2      ILE  64  77.992  -3.332   3.209
  516   3HG2  ILE  64          3HG2      ILE  64  78.193  -4.919   3.950
  517   1HD1  ILE  64          1HD1      ILE  64  74.311  -1.815   4.017
  518   2HD1  ILE  64          2HD1      ILE  64  75.500  -2.726   4.948
  519   3HD1  ILE  64          3HD1      ILE  64  73.957  -3.467   4.521
  520    HA   PRO  65           HA       PRO  65  79.243  -8.482   1.576
  521   1HB   PRO  65          2HB       PRO  65  81.709  -7.556   2.310
  522   2HB   PRO  65          1HB       PRO  65  81.073  -7.382   0.659
  523   1HG   PRO  65          2HG       PRO  65  80.989  -5.410   2.915
  524   2HG   PRO  65          1HG       PRO  65  81.549  -5.164   1.247
  525   1HD   PRO  65          2HD       PRO  65  79.117  -4.391   1.936
  526   2HD   PRO  65          1HD       PRO  65  79.367  -5.228   0.382
  527    H    LYS  66           H        LYS  66  79.364  -9.940   3.246
  528    HA   LYS  66           HA       LYS  66  78.618  -9.379   5.917
  529   1HB   LYS  66          2HB       LYS  66  78.618 -11.591   4.749
  530   2HB   LYS  66          1HB       LYS  66  80.377 -11.626   4.878
  531   1HG   LYS  66          2HG       LYS  66  80.180 -11.475   7.350
  532   2HG   LYS  66          1HG       LYS  66  78.423 -11.514   7.196
  533   1HD   LYS  66          2HD       LYS  66  78.634 -13.715   6.011
  534   2HD   LYS  66          1HD       LYS  66  80.363 -13.688   6.359
  535   1HE   LYS  66          2HE       LYS  66  79.621 -13.334   8.843
  536   2HE   LYS  66          1HE       LYS  66  78.062 -13.973   8.285
  537   1HZ   LYS  66          1HZ       LYS  66  79.260 -15.843   7.279
  538   2HZ   LYS  66          2HZ       LYS  66  79.486 -15.787   8.962
  539   3HZ   LYS  66          3HZ       LYS  66  80.718 -15.258   7.918
  540    H    ALA  67           H        ALA  67  81.822  -9.447   4.429
  541    HA   ALA  67           HA       ALA  67  83.458  -9.462   6.755
  542   1HB   ALA  67          1HB       ALA  67  85.126  -8.420   5.219
  543   2HB   ALA  67          2HB       ALA  67  83.829  -8.095   4.068
  544   3HB   ALA  67          3HB       ALA  67  84.269  -9.759   4.454
  545    H    LEU  68           H        LEU  68  81.858  -6.769   5.086
  546    HA   LEU  68           HA       LEU  68  83.019  -4.717   6.813
  547   1HB   LEU  68          2HB       LEU  68  80.756  -4.782   4.799
  548   2HB   LEU  68          1HB       LEU  68  81.264  -3.311   5.624
  549    HG   LEU  68           HG       LEU  68  83.036  -5.056   3.878
  550   1HD1  LEU  68          1HD1      LEU  68  82.713  -3.544   2.166
  551   2HD1  LEU  68          2HD1      LEU  68  82.395  -2.204   3.268
  552   3HD1  LEU  68          3HD1      LEU  68  81.141  -3.404   2.953
  553   1HD2  LEU  68          1HD2      LEU  68  84.514  -2.915   4.119
  554   2HD2  LEU  68          2HD2      LEU  68  84.495  -4.071   5.451
  555   3HD2  LEU  68          3HD2      LEU  68  83.535  -2.594   5.552
  556    H    ARG  69           H        ARG  69  80.016  -6.622   6.778
  557    HA   ARG  69           HA       ARG  69  78.478  -5.149   8.683
  558   1HB   ARG  69          2HB       ARG  69  78.743  -8.164   8.378
  559   2HB   ARG  69          1HB       ARG  69  77.375  -7.314   9.082
  560   1HG   ARG  69          2HG       ARG  69  77.061  -6.182   6.827
  561   2HG   ARG  69          1HG       ARG  69  78.252  -7.319   6.187
  562   1HD   ARG  69          2HD       ARG  69  76.709  -9.098   7.448
  563   2HD   ARG  69          1HD       ARG  69  75.477  -7.854   7.170
  564    HE   ARG  69           HE       ARG  69  76.676  -7.993   4.721
  565   1HH1  ARG  69          1HH1      ARG  69  75.429 -10.492   6.852
  566   2HH1  ARG  69          2HH1      ARG  69  75.097 -11.569   5.544
  567   1HH2  ARG  69          1HH2      ARG  69  76.218  -9.430   3.079
  568   2HH2  ARG  69          2HH2      ARG  69  75.534 -10.979   3.437
  569    H    ASP  70           H        ASP  70  80.858  -7.753   9.147
  570    HA   ASP  70           HA       ASP  70  80.601  -7.889  12.010
  571   1HB   ASP  70          2HB       ASP  70  82.815  -8.720  10.104
  572   2HB   ASP  70          1HB       ASP  70  82.696  -9.244  11.783
  573    H    VAL  71           H        VAL  71  83.072  -6.353   9.921
  574    HA   VAL  71           HA       VAL  71  84.744  -5.347  12.002
  575    HB   VAL  71           HB       VAL  71  84.112  -4.317   9.211
  576   1HG1  VAL  71          1HG1      VAL  71  86.321  -3.211   9.324
  577   2HG1  VAL  71          2HG1      VAL  71  86.485  -3.719  11.006
  578   3HG1  VAL  71          3HG1      VAL  71  85.220  -2.577  10.549
  579   1HG2  VAL  71          1HG2      VAL  71  85.819  -5.731   8.445
  580   2HG2  VAL  71          2HG2      VAL  71  85.037  -6.719   9.678
  581   3HG2  VAL  71          3HG2      VAL  71  86.544  -5.880  10.045
  582    H    ILE  72           H        ILE  72  81.879  -3.953  10.456
  583    HA   ILE  72           HA       ILE  72  82.104  -1.405  11.865
  584    HB   ILE  72           HB       ILE  72  79.896  -2.659  10.189
  585   1HG1  ILE  72          2HG1      ILE  72  82.060  -0.670   9.420
  586   2HG1  ILE  72          1HG1      ILE  72  82.128  -2.396   9.064
  587   1HG2  ILE  72          1HG2      ILE  72  80.343   0.295  10.564
  588   2HG2  ILE  72          2HG2      ILE  72  79.411  -0.600  11.761
  589   3HG2  ILE  72          3HG2      ILE  72  78.874  -0.551  10.084
  590   1HD1  ILE  72          1HD1      ILE  72  80.290  -0.303   7.943
  591   2HD1  ILE  72          2HD1      ILE  72  79.758  -1.986   8.002
  592   3HD1  ILE  72          3HD1      ILE  72  81.206  -1.548   7.094
  593    H    GLY  73           H        GLY  73  80.646  -4.496  12.601
  594   1HA   GLY  73          2HA       GLY  73  79.639  -5.166  14.621
  595   2HA   GLY  73          1HA       GLY  73  79.859  -3.522  15.218
  596    H    ILE  74           H        ILE  74  78.132  -4.386  12.256
  597    HA   ILE  74           HA       ILE  74  75.824  -2.812  13.201
  598    HB   ILE  74           HB       ILE  74  76.412  -4.201  10.563
  599   1HG1  ILE  74          2HG1      ILE  74  78.142  -2.535  11.125
  600   2HG1  ILE  74          1HG1      ILE  74  77.139  -1.955   9.800
  601   1HG2  ILE  74          1HG2      ILE  74  74.139  -3.727  10.454
  602   2HG2  ILE  74          2HG2      ILE  74  74.823  -2.226   9.832
  603   3HG2  ILE  74          3HG2      ILE  74  74.276  -2.319  11.506
  604   1HD1  ILE  74          1HD1      ILE  74  77.490  -0.852  12.498
  605   2HD1  ILE  74          2HD1      ILE  74  75.796  -1.017  12.033
  606   3HD1  ILE  74          3HD1      ILE  74  76.896  -0.068  11.034
  607    H    LYS  75           H        LYS  75  73.735  -3.617  13.490
  608    HA   LYS  75           HA       LYS  75  73.336  -6.576  13.239
  609   1HB   LYS  75          2HB       LYS  75  72.256  -6.537  15.449
  610   2HB   LYS  75          1HB       LYS  75  73.904  -5.926  15.562
  611   1HG   LYS  75          2HG       LYS  75  72.866  -4.243  16.726
  612   2HG   LYS  75          1HG       LYS  75  72.611  -3.600  15.107
  613   1HD   LYS  75          2HD       LYS  75  70.376  -4.045  15.128
  614   2HD   LYS  75          1HD       LYS  75  70.581  -5.551  16.023
  615   1HE   LYS  75          2HE       LYS  75  71.000  -4.229  18.102
  616   2HE   LYS  75          1HE       LYS  75  70.673  -2.744  17.187
  617   1HZ   LYS  75          1HZ       LYS  75  68.529  -3.728  16.519
  618   2HZ   LYS  75          2HZ       LYS  75  68.639  -3.492  18.198
  619   3HZ   LYS  75          3HZ       LYS  75  68.828  -5.048  17.540
  620    HA   PRO  76           HA       PRO  76  69.486  -5.811  11.234
  621   1HB   PRO  76          2HB       PRO  76  68.082  -7.430  13.289
  622   2HB   PRO  76          1HB       PRO  76  68.136  -7.642  11.530
  623   1HG   PRO  76          2HG       PRO  76  69.490  -9.223  13.239
  624   2HG   PRO  76          1HG       PRO  76  70.051  -8.863  11.601
  625   1HD   PRO  76          2HD       PRO  76  71.094  -7.906  14.189
  626   2HD   PRO  76          1HD       PRO  76  71.910  -8.066  12.621
  627    H    GLY  77           H        GLY  77  68.049  -4.125  11.375
  628   1HA   GLY  77          2HA       GLY  77  66.322  -2.825  12.382
  629   2HA   GLY  77          1HA       GLY  77  66.783  -3.470  13.954
  630    H    GLU  78           H        GLU  78  69.645  -2.488  12.544
  631    HA   GLU  78           HA       GLU  78  69.617   0.064  14.068
  632   1HB   GLU  78          2HB       GLU  78  71.585  -1.944  13.141
  633   2HB   GLU  78          1HB       GLU  78  72.152  -0.274  13.086
  634   1HG   GLU  78          2HG       GLU  78  71.323  -0.030  15.476
  635   2HG   GLU  78          1HG       GLU  78  71.082  -1.776  15.487
  636    H    VAL  79           H        VAL  79  69.455   1.998  13.028
  637    HA   VAL  79           HA       VAL  79  69.238   1.992  10.088
  638    HB   VAL  79           HB       VAL  79  67.558   3.051  11.558
  639   1HG1  VAL  79          1HG1      VAL  79  68.114   4.373  13.299
  640   2HG1  VAL  79          2HG1      VAL  79  69.105   5.414  12.280
  641   3HG1  VAL  79          3HG1      VAL  79  69.799   3.959  12.990
  642   1HG2  VAL  79          1HG2      VAL  79  67.385   5.161  10.363
  643   2HG2  VAL  79          2HG2      VAL  79  68.019   3.941   9.259
  644   3HG2  VAL  79          3HG2      VAL  79  69.106   5.128   9.979
  645    H    ILE  80           H        ILE  80  70.817   2.682   8.765
  646    HA   ILE  80           HA       ILE  80  73.090   4.284   9.882
  647    HB   ILE  80           HB       ILE  80  74.464   3.084   8.192
  648   1HG1  ILE  80          2HG1      ILE  80  71.932   1.524   7.590
  649   2HG1  ILE  80          1HG1      ILE  80  72.602   2.781   6.548
  650   1HG2  ILE  80          1HG2      ILE  80  74.638   1.096   9.394
  651   2HG2  ILE  80          2HG2      ILE  80  72.892   0.935   9.582
  652   3HG2  ILE  80          3HG2      ILE  80  73.778   2.117  10.545
  653   1HD1  ILE  80          1HD1      ILE  80  73.688   1.018   5.579
  654   2HD1  ILE  80          2HD1      ILE  80  73.553   0.012   7.022
  655   3HD1  ILE  80          3HD1      ILE  80  74.809   1.245   6.921
  656    H    GLU  81           H        GLU  81  74.044   5.792   8.317
  657    HA   GLU  81           HA       GLU  81  72.087   6.894   6.356
  658   1HB   GLU  81          2HB       GLU  81  73.080   8.360   8.105
  659   2HB   GLU  81          1HB       GLU  81  74.691   7.964   7.507
  660   1HG   GLU  81          2HG       GLU  81  74.055   8.898   5.283
  661   2HG   GLU  81          1HG       GLU  81  72.501   9.381   5.962
  662    H    VAL  82           H        VAL  82  72.462   6.557   4.219
  663    HA   VAL  82           HA       VAL  82  75.008   5.200   3.456
  664    HB   VAL  82           HB       VAL  82  72.181   5.089   2.344
  665   1HG1  VAL  82          1HG1      VAL  82  73.117   3.053   1.142
  666   2HG1  VAL  82          2HG1      VAL  82  74.722   3.626   1.594
  667   3HG1  VAL  82          3HG1      VAL  82  73.697   4.610   0.550
  668   1HG2  VAL  82          1HG2      VAL  82  72.084   3.914   4.360
  669   2HG2  VAL  82          2HG2      VAL  82  73.773   3.415   4.264
  670   3HG2  VAL  82          3HG2      VAL  82  72.564   2.637   3.241
  671    H    LEU  83           H        LEU  83  76.277   6.178   1.988
  672    HA   LEU  83           HA       LEU  83  75.196   8.479   0.389
  673   1HB   LEU  83          2HB       LEU  83  78.071   7.883   1.203
  674   2HB   LEU  83          1HB       LEU  83  77.449   9.392   0.548
  675    HG   LEU  83           HG       LEU  83  76.706   8.204   3.240
  676   1HD1  LEU  83          1HD1      LEU  83  78.051   9.964   4.196
  677   2HD1  LEU  83          2HD1      LEU  83  78.328  10.684   2.610
  678   3HD1  LEU  83          3HD1      LEU  83  79.045   9.119   3.007
  679   1HD2  LEU  83          1HD2      LEU  83  74.930   9.545   2.072
  680   2HD2  LEU  83          2HD2      LEU  83  76.040  10.918   2.062
  681   3HD2  LEU  83          3HD2      LEU  83  75.469  10.253   3.595
  682    H    LEU  84           H        LEU  84  75.251   8.133  -1.839
  683    HA   LEU  84           HA       LEU  84  76.632   5.780  -2.971
  684   1HB   LEU  84          2HB       LEU  84  74.813   7.966  -3.913
  685   2HB   LEU  84          1HB       LEU  84  75.784   7.099  -5.107
  686    HG   LEU  84           HG       LEU  84  74.337   5.471  -3.068
  687   1HD1  LEU  84          1HD1      LEU  84  72.961   7.380  -4.702
  688   2HD1  LEU  84          2HD1      LEU  84  72.271   6.140  -3.660
  689   3HD1  LEU  84          3HD1      LEU  84  72.620   5.776  -5.347
  690   1HD2  LEU  84          1HD2      LEU  84  75.503   4.095  -4.504
  691   2HD2  LEU  84          2HD2      LEU  84  75.407   5.237  -5.845
  692   3HD2  LEU  84          3HD2      LEU  84  74.010   4.240  -5.433
  693    H    LEU  85           H        LEU  85  78.574   5.867  -4.080
  694    HA   LEU  85           HA       LEU  85  80.070   8.442  -3.901
  695   1HB   LEU  85          2HB       LEU  85  80.667   5.532  -3.629
  696   2HB   LEU  85          1HB       LEU  85  81.961   6.566  -4.241
  697    HG   LEU  85           HG       LEU  85  80.398   7.334  -1.781
  698   1HD1  LEU  85          1HD1      LEU  85  82.062   6.220  -0.403
  699   2HD1  LEU  85          2HD1      LEU  85  82.941   5.683  -1.835
  700   3HD1  LEU  85          3HD1      LEU  85  81.341   5.029  -1.485
  701   1HD2  LEU  85          1HD2      LEU  85  82.807   8.313  -1.361
  702   2HD2  LEU  85          2HD2      LEU  85  81.717   9.134  -2.478
  703   3HD2  LEU  85          3HD2      LEU  85  82.992   8.087  -3.100
  704    H    GLY  86           H        GLY  86  79.215   5.804  -6.127
  705   1HA   GLY  86          2HA       GLY  86  79.764   7.486  -8.462
  706   2HA   GLY  86          1HA       GLY  86  80.992   6.247  -8.227
  707    H    HIS  87           H        HIS  87  79.946   5.791 -10.494
  708    HA   HIS  87           HA       HIS  87  77.899   3.642 -10.132
  709   1HB   HIS  87          2HB       HIS  87  76.640   4.622 -12.047
  710   2HB   HIS  87          1HB       HIS  87  76.741   5.744 -10.696
  711    HD1  HIS  87           HD1      HIS  87  78.128   5.145 -14.149
  712    HD2  HIS  87           HD2      HIS  87  78.241   8.089 -11.200
  713    HE1  HIS  87           HE1      HIS  87  79.193   7.183 -15.212
  714    H    TYR  88           H        TYR  88  77.931   2.051 -11.861
  715    HA   TYR  88           HA       TYR  88  80.088   2.335 -13.902
  716   1HB   TYR  88          2HB       TYR  88  79.627   0.049 -11.964
  717   2HB   TYR  88          1HB       TYR  88  80.670  -0.080 -13.381
  718    HD1  TYR  88           HD1      TYR  88  80.280   1.363  -9.998
  719    HD2  TYR  88           HD2      TYR  88  82.757   1.287 -13.581
  720    HE1  TYR  88           HE1      TYR  88  82.157   2.450  -8.724
  721    HE2  TYR  88           HE2      TYR  88  84.634   2.373 -12.307
  722    HH   TYR  88           HH       TYR  88  84.348   4.016  -9.627
  723    H    LYS  89           H        LYS  89  79.477   1.512 -15.892
  724    HA   LYS  89           HA       LYS  89  76.692   0.644 -16.256
  725   1HB   LYS  89          2HB       LYS  89  77.350   0.726 -18.655
  726   2HB   LYS  89          1HB       LYS  89  77.794   2.203 -17.806
  727   1HG   LYS  89          2HG       LYS  89  80.062   1.734 -17.888
  728   2HG   LYS  89          1HG       LYS  89  79.812  -0.009 -17.941
  729   1HD   LYS  89          2HD       LYS  89  78.668   0.560 -20.266
  730   2HD   LYS  89          1HD       LYS  89  79.698   1.989 -20.166
  731   1HE   LYS  89          2HE       LYS  89  80.871  -0.741 -19.648
  732   2HE   LYS  89          1HE       LYS  89  80.677  -0.148 -21.309
  733   1HZ   LYS  89          1HZ       LYS  89  81.992   1.362 -19.112
  734   2HZ   LYS  89          2HZ       LYS  89  81.855   1.855 -20.732
  735   3HZ   LYS  89          3HZ       LYS  89  82.820   0.517 -20.327
  736    HA   PRO  90           HA       PRO  90  77.281  -3.758 -16.170
  737   1HB   PRO  90          2HB       PRO  90  75.744  -3.742 -18.752
  738   2HB   PRO  90          1HB       PRO  90  75.467  -4.707 -17.284
  739   1HG   PRO  90          2HG       PRO  90  73.900  -2.677 -17.751
  740   2HG   PRO  90          1HG       PRO  90  74.563  -2.890 -16.118
  741   1HD   PRO  90          2HD       PRO  90  75.457  -1.004 -18.274
  742   2HD   PRO  90          1HD       PRO  90  75.211  -0.694 -16.537
  743    H    ARG  91           H        ARG  91  78.787  -5.211 -17.050
  744    HA   ARG  91           HA       ARG  91  79.960  -4.573 -19.727
  745   1HB   ARG  91          2HB       ARG  91  82.202  -4.875 -18.705
  746   2HB   ARG  91          1HB       ARG  91  81.319  -3.556 -17.939
  747   1HG   ARG  91          2HG       ARG  91  80.579  -5.203 -16.165
  748   2HG   ARG  91          1HG       ARG  91  81.694  -6.370 -16.876
  749   1HD   ARG  91          2HD       ARG  91  83.561  -4.728 -16.536
  750   2HD   ARG  91          1HD       ARG  91  82.419  -3.668 -15.688
  751    HE   ARG  91           HE       ARG  91  82.029  -6.052 -14.405
  752   1HH1  ARG  91          1HH1      ARG  91  84.951  -4.267 -15.178
  753   2HH1  ARG  91          2HH1      ARG  91  85.804  -4.893 -13.811
  754   1HH2  ARG  91          1HH2      ARG  91  83.180  -6.824 -12.659
  755   2HH2  ARG  91          2HH2      ARG  91  84.818  -6.321 -12.403
  756    H    ASN  92           H        ASN  92  81.071  -6.427 -20.704
  757    HA   ASN  92           HA       ASN  92  80.369  -9.083 -19.501
  758   1HB   ASN  92          2HB       ASN  92  78.742  -8.332 -21.242
  759   2HB   ASN  92          1HB       ASN  92  80.072  -8.214 -22.395
  760   1HD2  ASN  92          1HD2      ASN  92  78.467 -10.595 -20.222
  761   2HD2  ASN  92          2HD2      ASN  92  78.809 -11.941 -21.199
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1  83.878  13.686   1.585
    2   2H    MET   1          2H        MET   1  82.323  13.066   1.296
    3   3H    MET   1          3H        MET   1  82.586  14.744   1.284
    4    HA   MET   1           HA       MET   1  84.045  14.487  -0.673
    5   1HB   MET   1          2HB       MET   1  83.193  11.634  -0.149
    6   2HB   MET   1          1HB       MET   1  83.818  12.142  -1.718
    7   1HG   MET   1          2HG       MET   1  85.854  13.020  -0.572
    8   2HG   MET   1          1HG       MET   1  85.244  12.361   0.947
    9   1HE   MET   1          1HE       MET   1  86.802  11.793  -2.458
   10   2HE   MET   1          2HE       MET   1  85.204  11.125  -2.780
   11   3HE   MET   1          3HE       MET   1  86.612  10.065  -2.785
   12    H    ASP   2           H        ASP   2  82.955  13.537  -2.915
   13    HA   ASP   2           HA       ASP   2  80.397  14.922  -3.155
   14   1HB   ASP   2          2HB       ASP   2  82.001  13.136  -5.017
   15   2HB   ASP   2          1HB       ASP   2  80.605  14.092  -5.515
   16    H    VAL   3           H        VAL   3  78.343  13.984  -3.355
   17    HA   VAL   3           HA       VAL   3  78.170  11.017  -3.151
   18    HB   VAL   3           HB       VAL   3  77.830  12.466  -1.020
   19   1HG1  VAL   3          1HG1      VAL   3  76.300  14.130  -2.147
   20   2HG1  VAL   3          2HG1      VAL   3  75.657  13.440  -0.656
   21   3HG1  VAL   3          3HG1      VAL   3  75.079  12.855  -2.220
   22   1HG2  VAL   3          1HG2      VAL   3  75.607  10.570  -1.811
   23   2HG2  VAL   3          2HG2      VAL   3  76.165  10.922  -0.175
   24   3HG2  VAL   3          3HG2      VAL   3  77.214  10.054  -1.298
   25    H    LEU   4           H        LEU   4  76.770  10.132  -4.630
   26    HA   LEU   4           HA       LEU   4  75.454  11.885  -6.580
   27   1HB   LEU   4          2HB       LEU   4  75.348   8.867  -6.274
   28   2HB   LEU   4          1HB       LEU   4  75.019   9.789  -7.735
   29    HG   LEU   4           HG       LEU   4  77.697   9.464  -6.338
   30   1HD1  LEU   4          1HD1      LEU   4  77.307   8.907  -9.228
   31   2HD1  LEU   4          2HD1      LEU   4  76.519   7.796  -8.106
   32   3HD1  LEU   4          3HD1      LEU   4  78.263   8.039  -8.027
   33   1HD2  LEU   4          1HD2      LEU   4  77.833  11.693  -7.084
   34   2HD2  LEU   4          2HD2      LEU   4  76.808  11.384  -8.489
   35   3HD2  LEU   4          3HD2      LEU   4  78.469  10.792  -8.465
   36    H    ALA   5           H        ALA   5  74.545  10.175  -3.677
   37    HA   ALA   5           HA       ALA   5  71.969  11.461  -3.585
   38   1HB   ALA   5          1HB       ALA   5  71.624   8.508  -3.716
   39   2HB   ALA   5          2HB       ALA   5  71.984   9.309  -5.245
   40   3HB   ALA   5          3HB       ALA   5  70.565   9.786  -4.312
   41    H    LYS   6           H        LYS   6  71.001  11.127  -1.486
   42    HA   LYS   6           HA       LYS   6  72.663   9.531   0.444
   43   1HB   LYS   6          2HB       LYS   6  73.171  11.981   0.378
   44   2HB   LYS   6          1HB       LYS   6  71.487  12.313   0.780
   45   1HG   LYS   6          2HG       LYS   6  71.728  11.081   2.890
   46   2HG   LYS   6          1HG       LYS   6  73.401  10.700   2.488
   47   1HD   LYS   6          2HD       LYS   6  73.681  13.282   2.247
   48   2HD   LYS   6          1HD       LYS   6  72.195  13.363   3.194
   49   1HE   LYS   6          2HE       LYS   6  73.303  11.869   4.910
   50   2HE   LYS   6          1HE       LYS   6  74.818  12.074   4.007
   51   1HZ   LYS   6          1HZ       LYS   6  74.525  14.482   4.168
   52   2HZ   LYS   6          2HZ       LYS   6  74.628  13.773   5.708
   53   3HZ   LYS   6          3HZ       LYS   6  73.122  14.261   5.094
   54    H    PHE   7           H        PHE   7  71.378   8.118   1.585
   55    HA   PHE   7           HA       PHE   7  68.626   8.936   2.353
   56   1HB   PHE   7          2HB       PHE   7  67.665   6.935   1.288
   57   2HB   PHE   7          1HB       PHE   7  68.495   7.934   0.099
   58    HD1  PHE   7           HD1      PHE   7  68.192   4.628   1.493
   59    HD2  PHE   7           HD2      PHE   7  71.015   7.334  -0.430
   60    HE1  PHE   7           HE1      PHE   7  69.632   2.669   0.844
   61    HE2  PHE   7           HE2      PHE   7  72.455   5.373  -1.071
   62    HZ   PHE   7           HZ       PHE   7  71.761   3.038  -0.429
   63    H    HIS   8           H        HIS   8  67.664   7.391   3.931
   64    HA   HIS   8           HA       HIS   8  69.804   6.103   5.602
   65   1HB   HIS   8          2HB       HIS   8  67.084   7.292   6.261
   66   2HB   HIS   8          1HB       HIS   8  68.188   6.592   7.445
   67    HD1  HIS   8           HD1      HIS   8  70.474   7.864   7.838
   68    HD2  HIS   8           HD2      HIS   8  67.747   9.895   5.426
   69    HE1  HIS   8           HE1      HIS   8  71.294  10.255   7.686
   70    H    THR   9           H        THR   9  69.557   3.959   6.168
   71    HA   THR   9           HA       THR   9  66.936   2.617   5.920
   72    HB   THR   9           HB       THR   9  68.040   2.566   3.654
   73    HG1  THR   9           HG1      THR   9  67.846   0.255   3.469
   74   1HG2  THR   9          1HG2      THR   9  70.386   2.474   4.386
   75   2HG2  THR   9          2HG2      THR   9  70.008   1.096   3.352
   76   3HG2  THR   9          3HG2      THR   9  70.106   0.885   5.100
   77    H    THR  10           H        THR  10  67.050   0.391   6.931
   78    HA   THR  10           HA       THR  10  69.295   0.240   8.905
   79    HB   THR  10           HB       THR  10  66.883   0.629   9.692
   80    HG1  THR  10           HG1      THR  10  68.340  -1.628  10.559
   81   1HG2  THR  10          1HG2      THR  10  66.281  -1.512   8.039
   82   2HG2  THR  10          2HG2      THR  10  65.234  -0.871   9.308
   83   3HG2  THR  10          3HG2      THR  10  66.302  -2.236   9.651
   84    H    VAL  11           H        VAL  11  70.060  -1.939   9.437
   85    HA   VAL  11           HA       VAL  11  70.433  -3.541   7.027
   86    HB   VAL  11           HB       VAL  11  71.270  -3.973   9.918
   87   1HG1  VAL  11          1HG1      VAL  11  72.274  -5.179   7.319
   88   2HG1  VAL  11          2HG1      VAL  11  71.444  -6.034   8.618
   89   3HG1  VAL  11          3HG1      VAL  11  73.060  -5.381   8.885
   90   1HG2  VAL  11          1HG2      VAL  11  73.497  -3.170   8.498
   91   2HG2  VAL  11          2HG2      VAL  11  72.512  -2.111   9.504
   92   3HG2  VAL  11          3HG2      VAL  11  72.223  -2.193   7.766
   93    H    HIS  12           H        HIS  12  69.411  -5.407   6.487
   94    HA   HIS  12           HA       HIS  12  67.579  -6.683   8.490
   95   1HB   HIS  12          2HB       HIS  12  67.410  -6.206   5.532
   96   2HB   HIS  12          1HB       HIS  12  66.601  -7.617   6.220
   97    HD1  HIS  12           HD1      HIS  12  66.872  -3.902   7.112
   98    HD2  HIS  12           HD2      HIS  12  64.053  -6.973   7.029
   99    HE1  HIS  12           HE1      HIS  12  64.684  -2.887   7.885
  100    H    ARG  13           H        ARG  13  67.320  -9.092   7.953
  101    HA   ARG  13           HA       ARG  13  69.615 -10.523   8.505
  102   1HB   ARG  13          2HB       ARG  13  67.161 -11.210   8.418
  103   2HB   ARG  13          1HB       ARG  13  67.401 -11.517   6.700
  104   1HG   ARG  13          2HG       ARG  13  69.248 -13.092   7.270
  105   2HG   ARG  13          1HG       ARG  13  68.912 -12.828   8.981
  106   1HD   ARG  13          2HD       ARG  13  66.574 -13.639   8.614
  107   2HD   ARG  13          1HD       ARG  13  67.006 -14.016   6.935
  108    HE   ARG  13           HE       ARG  13  69.008 -15.263   8.324
  109   1HH1  ARG  13          1HH1      ARG  13  65.516 -15.333   8.685
  110   2HH1  ARG  13          2HH1      ARG  13  65.523 -16.938   9.325
  111   1HH2  ARG  13          1HH2      ARG  13  68.952 -17.332   9.155
  112   2HH2  ARG  13          2HH2      ARG  13  67.441 -18.057   9.589
  113    H    ILE  14           H        ILE  14  71.109 -11.790   7.280
  114    HA   ILE  14           HA       ILE  14  72.625 -12.235   5.541
  115    HB   ILE  14           HB       ILE  14  70.389 -11.248   3.738
  116   1HG1  ILE  14          2HG1      ILE  14  70.995 -14.099   4.570
  117   2HG1  ILE  14          1HG1      ILE  14  69.756 -13.115   5.348
  118   1HG2  ILE  14          1HG2      ILE  14  72.185 -11.460   2.312
  119   2HG2  ILE  14          2HG2      ILE  14  71.636 -13.136   2.324
  120   3HG2  ILE  14          3HG2      ILE  14  72.994 -12.646   3.337
  121   1HD1  ILE  14          1HD1      ILE  14  69.043 -12.707   2.794
  122   2HD1  ILE  14          2HD1      ILE  14  68.443 -14.081   3.725
  123   3HD1  ILE  14          3HD1      ILE  14  69.793 -14.293   2.612
  124    H    GLY  15           H        GLY  15  71.823  -9.170   6.481
  125   1HA   GLY  15          2HA       GLY  15  73.067  -7.185   6.239
  126   2HA   GLY  15          1HA       GLY  15  74.086  -8.015   5.068
  127    H    ARG  16           H        ARG  16  70.699  -8.235   4.413
  128    HA   ARG  16           HA       ARG  16  71.074  -6.720   1.934
  129   1HB   ARG  16          2HB       ARG  16  69.886  -8.876   2.063
  130   2HB   ARG  16          1HB       ARG  16  68.714  -8.176   3.176
  131   1HG   ARG  16          2HG       ARG  16  68.058  -6.542   1.408
  132   2HG   ARG  16          1HG       ARG  16  69.166  -7.346   0.294
  133   1HD   ARG  16          2HD       ARG  16  67.919  -9.462   0.555
  134   2HD   ARG  16          1HD       ARG  16  66.806  -8.668   1.686
  135    HE   ARG  16           HE       ARG  16  66.714  -6.998  -0.488
  136   1HH1  ARG  16          1HH1      ARG  16  66.370 -10.480  -0.187
  137   2HH1  ARG  16          2HH1      ARG  16  65.281 -10.582  -1.525
  138   1HH2  ARG  16          1HH2      ARG  16  65.292  -7.195  -2.202
  139   2HH2  ARG  16          2HH2      ARG  16  64.679  -8.751  -2.652
  140    H    ILE  17           H        ILE  17  70.104  -4.756   1.424
  141    HA   ILE  17           HA       ILE  17  68.213  -3.548   3.387
  142    HB   ILE  17           HB       ILE  17  69.378  -1.375   3.108
  143   1HG1  ILE  17          2HG1      ILE  17  71.537  -2.917   1.642
  144   2HG1  ILE  17          1HG1      ILE  17  70.292  -1.992   0.804
  145   1HG2  ILE  17          1HG2      ILE  17  71.171  -1.841   4.567
  146   2HG2  ILE  17          2HG2      ILE  17  71.471  -3.420   3.840
  147   3HG2  ILE  17          3HG2      ILE  17  70.047  -3.170   4.850
  148   1HD1  ILE  17          1HD1      ILE  17  71.638  -0.513   2.974
  149   2HD1  ILE  17          2HD1      ILE  17  71.243   0.006   1.334
  150   3HD1  ILE  17          3HD1      ILE  17  72.692  -0.954   1.631
  151    H    ILE  18           H        ILE  18  66.705  -2.044   2.344
  152    HA   ILE  18           HA       ILE  18  66.635  -2.296  -0.650
  153    HB   ILE  18           HB       ILE  18  64.339  -1.899   1.298
  154   1HG1  ILE  18          2HG1      ILE  18  65.314  -4.140   1.585
  155   2HG1  ILE  18          1HG1      ILE  18  63.755  -4.259   0.774
  156   1HG2  ILE  18          1HG2      ILE  18  64.576  -2.130  -1.684
  157   2HG2  ILE  18          2HG2      ILE  18  63.558  -1.057  -0.721
  158   3HG2  ILE  18          3HG2      ILE  18  63.132  -2.761  -0.890
  159   1HD1  ILE  18          1HD1      ILE  18  64.937  -5.584  -0.673
  160   2HD1  ILE  18          2HD1      ILE  18  66.478  -4.829  -0.264
  161   3HD1  ILE  18          3HD1      ILE  18  65.376  -4.031  -1.386
  162    H    ILE  19           H        ILE  19  66.832  -0.381  -1.721
  163    HA   ILE  19           HA       ILE  19  66.851   2.174  -0.249
  164    HB   ILE  19           HB       ILE  19  67.073   1.494  -3.218
  165   1HG1  ILE  19          2HG1      ILE  19  69.159   1.936  -1.038
  166   2HG1  ILE  19          1HG1      ILE  19  68.844   0.430  -1.887
  167   1HG2  ILE  19          1HG2      ILE  19  67.992   4.001  -1.770
  168   2HG2  ILE  19          2HG2      ILE  19  66.414   3.882  -2.550
  169   3HG2  ILE  19          3HG2      ILE  19  67.885   3.735  -3.511
  170   1HD1  ILE  19          1HD1      ILE  19  70.599   2.568  -2.633
  171   2HD1  ILE  19          2HD1      ILE  19  69.346   2.416  -3.865
  172   3HD1  ILE  19          3HD1      ILE  19  70.347   1.025  -3.449
  173    HA   PRO  20           HA       PRO  20  62.519   3.059  -1.005
  174   1HB   PRO  20          2HB       PRO  20  62.652   5.795  -1.076
  175   2HB   PRO  20          1HB       PRO  20  62.701   4.875   0.438
  176   1HG   PRO  20          2HG       PRO  20  64.991   5.920  -1.192
  177   2HG   PRO  20          1HG       PRO  20  64.699   6.101   0.549
  178   1HD   PRO  20          2HD       PRO  20  66.383   4.250  -0.293
  179   2HD   PRO  20          1HD       PRO  20  65.209   3.844   0.987
  180    H    ALA  21           H        ALA  21  61.338   3.437  -2.890
  181    HA   ALA  21           HA       ALA  21  62.611   3.335  -5.414
  182   1HB   ALA  21          1HB       ALA  21  59.870   4.505  -4.873
  183   2HB   ALA  21          2HB       ALA  21  60.206   2.781  -4.709
  184   3HB   ALA  21          3HB       ALA  21  60.389   3.570  -6.275
  185    H    GLY  22           H        GLY  22  61.754   6.102  -3.415
  186   1HA   GLY  22          2HA       GLY  22  61.826   8.127  -5.461
  187   2HA   GLY  22          1HA       GLY  22  62.083   8.413  -3.738
  188    H    THR  23           H        THR  23  64.366   6.838  -3.303
  189    HA   THR  23           HA       THR  23  66.448   8.592  -4.286
  190    HB   THR  23           HB       THR  23  66.586   5.867  -2.950
  191    HG1  THR  23           HG1      THR  23  66.661   7.072  -1.064
  192   1HG2  THR  23          1HG2      THR  23  68.754   7.296  -2.099
  193   2HG2  THR  23          2HG2      THR  23  68.611   7.866  -3.763
  194   3HG2  THR  23          3HG2      THR  23  68.795   6.142  -3.431
  195    H    ARG  24           H        ARG  24  65.376   5.310  -5.185
  196    HA   ARG  24           HA       ARG  24  67.436   4.630  -7.056
  197   1HB   ARG  24          2HB       ARG  24  64.490   4.065  -7.488
  198   2HB   ARG  24          1HB       ARG  24  65.859   3.070  -7.962
  199   1HG   ARG  24          2HG       ARG  24  66.302   2.989  -5.355
  200   2HG   ARG  24          1HG       ARG  24  64.588   3.384  -5.277
  201   1HD   ARG  24          2HD       ARG  24  64.421   1.430  -7.091
  202   2HD   ARG  24          1HD       ARG  24  65.903   0.902  -6.261
  203    HE   ARG  24           HE       ARG  24  64.313   1.502  -4.148
  204   1HH1  ARG  24          1HH1      ARG  24  63.648  -0.386  -7.030
  205   2HH1  ARG  24          2HH1      ARG  24  62.478  -1.367  -6.224
  206   1HH2  ARG  24          1HH2      ARG  24  62.816   0.205  -3.165
  207   2HH2  ARG  24          2HH2      ARG  24  62.006  -1.040  -4.059
  208    H    LYS  25           H        LYS  25  64.479   6.534  -7.420
  209    HA   LYS  25           HA       LYS  25  64.601   6.953 -10.250
  210   1HB   LYS  25          2HB       LYS  25  62.624   7.282  -8.778
  211   2HB   LYS  25          1HB       LYS  25  63.425   8.661  -8.027
  212   1HG   LYS  25          2HG       LYS  25  63.507   9.800 -10.213
  213   2HG   LYS  25          1HG       LYS  25  62.682   8.429 -10.954
  214   1HD   LYS  25          2HD       LYS  25  60.780   8.788  -9.356
  215   2HD   LYS  25          1HD       LYS  25  61.590  10.251  -8.793
  216   1HE   LYS  25          2HE       LYS  25  61.530  11.163 -11.109
  217   2HE   LYS  25          1HE       LYS  25  60.648   9.714 -11.633
  218   1HZ   LYS  25          1HZ       LYS  25  59.007  10.186  -9.867
  219   2HZ   LYS  25          2HZ       LYS  25  59.062  11.401 -11.055
  220   3HZ   LYS  25          3HZ       LYS  25  59.800  11.650  -9.545
  221    H    PHE  26           H        PHE  26  65.622   9.057  -7.548
  222    HA   PHE  26           HA       PHE  26  66.660  11.221  -9.070
  223   1HB   PHE  26          2HB       PHE  26  66.239  11.152  -6.613
  224   2HB   PHE  26          1HB       PHE  26  67.637  10.094  -6.425
  225    HD1  PHE  26           HD1      PHE  26  69.861  10.974  -6.292
  226    HD2  PHE  26           HD2      PHE  26  66.578  13.495  -7.650
  227    HE1  PHE  26           HE1      PHE  26  71.376  12.982  -6.228
  228    HE2  PHE  26           HE2      PHE  26  68.093  15.503  -7.585
  229    HZ   PHE  26           HZ       PHE  26  70.492  15.246  -6.874
  230    H    TYR  27           H        TYR  27  68.218   8.208  -8.032
  231    HA   TYR  27           HA       TYR  27  70.836   8.997  -9.119
  232   1HB   TYR  27          2HB       TYR  27  70.435   7.694  -7.029
  233   2HB   TYR  27          1HB       TYR  27  69.794   6.379  -7.999
  234    HD1  TYR  27           HD1      TYR  27  72.773   7.918  -6.633
  235    HD2  TYR  27           HD2      TYR  27  71.348   5.320  -9.823
  236    HE1  TYR  27           HE1      TYR  27  75.096   7.009  -6.942
  237    HE2  TYR  27           HE2      TYR  27  73.669   4.410 -10.121
  238    HH   TYR  27           HH       TYR  27  76.208   5.048  -7.832
  239    H    GLY  28           H        GLY  28  68.014   7.424 -10.408
  240   1HA   GLY  28          2HA       GLY  28  67.654   6.626 -12.590
  241   2HA   GLY  28          1HA       GLY  28  69.329   7.032 -12.965
  242    H    ILE  29           H        ILE  29  68.074   4.840 -10.441
  243    HA   ILE  29           HA       ILE  29  70.021   2.791 -11.270
  244    HB   ILE  29           HB       ILE  29  67.943   2.882  -9.051
  245   1HG1  ILE  29          2HG1      ILE  29  70.926   3.431  -8.989
  246   2HG1  ILE  29          1HG1      ILE  29  69.677   4.669  -8.964
  247   1HG2  ILE  29          1HG2      ILE  29  68.460   0.646  -9.037
  248   2HG2  ILE  29          2HG2      ILE  29  69.875   1.216  -8.152
  249   3HG2  ILE  29          3HG2      ILE  29  69.990   0.886  -9.881
  250   1HD1  ILE  29          1HD1      ILE  29  70.655   2.972  -6.787
  251   2HD1  ILE  29          2HD1      ILE  29  68.894   2.951  -6.926
  252   3HD1  ILE  29          3HD1      ILE  29  69.744   4.482  -6.711
  253    H    GLU  30           H        GLU  30  69.549   1.094 -12.536
  254    HA   GLU  30           HA       GLU  30  66.736   0.081 -12.647
  255   1HB   GLU  30          2HB       GLU  30  67.391   1.364 -14.710
  256   2HB   GLU  30          1HB       GLU  30  68.714   0.223 -14.948
  257   1HG   GLU  30          2HG       GLU  30  67.052  -1.636 -15.018
  258   2HG   GLU  30          1HG       GLU  30  65.757  -0.451 -14.888
  259    H    GLN  31           H        GLN  31  66.666  -2.274 -12.878
  260    HA   GLN  31           HA       GLN  31  68.564  -3.730 -11.381
  261   1HB   GLN  31          2HB       GLN  31  66.223  -4.384 -12.030
  262   2HB   GLN  31          1HB       GLN  31  66.835  -4.773 -13.637
  263   1HG   GLN  31          2HG       GLN  31  68.385  -6.417 -12.668
  264   2HG   GLN  31          1HG       GLN  31  67.809  -6.018 -11.050
  265   1HE2  GLN  31          1HE2      GLN  31  67.544  -8.667 -11.854
  266   2HE2  GLN  31          2HE2      GLN  31  65.918  -9.027 -12.173
  267    H    GLY  32           H        GLY  32  70.429  -4.832 -11.885
  268   1HA   GLY  32          2HA       GLY  32  72.024  -5.900 -13.329
  269   2HA   GLY  32          1HA       GLY  32  71.259  -5.124 -14.712
  270    H    ASP  33           H        ASP  33  71.391  -2.507 -12.899
  271    HA   ASP  33           HA       ASP  33  73.918  -1.546 -14.031
  272   1HB   ASP  33          2HB       ASP  33  71.852  -0.390 -12.134
  273   2HB   ASP  33          1HB       ASP  33  73.215   0.528 -12.772
  274    H    PHE  34           H        PHE  34  75.701  -0.697 -12.703
  275    HA   PHE  34           HA       PHE  34  75.908  -2.003 -10.009
  276   1HB   PHE  34          2HB       PHE  34  77.949  -1.212 -12.107
  277   2HB   PHE  34          1HB       PHE  34  78.398  -1.700 -10.472
  278    HD1  PHE  34           HD1      PHE  34  76.875  -2.826 -13.687
  279    HD2  PHE  34           HD2      PHE  34  78.190  -4.019  -9.708
  280    HE1  PHE  34           HE1      PHE  34  76.695  -5.244 -14.354
  281    HE2  PHE  34           HE2      PHE  34  78.007  -6.438 -10.375
  282    HZ   PHE  34           HZ       PHE  34  77.259  -7.050 -12.698
  283    H    VAL  35           H        VAL  35  76.302  -0.639  -8.275
  284    HA   VAL  35           HA       VAL  35  77.020   2.202  -8.870
  285    HB   VAL  35           HB       VAL  35  75.422   2.875  -7.082
  286   1HG1  VAL  35          1HG1      VAL  35  74.729   2.772  -9.485
  287   2HG1  VAL  35          2HG1      VAL  35  73.385   2.504  -8.373
  288   3HG1  VAL  35          3HG1      VAL  35  74.124   1.138  -9.208
  289   1HG2  VAL  35          1HG2      VAL  35  73.735   1.120  -6.369
  290   2HG2  VAL  35          2HG2      VAL  35  75.358   0.888  -5.713
  291   3HG2  VAL  35          3HG2      VAL  35  74.806  -0.095  -7.069
  292    H    GLU  36           H        GLU  36  78.250   3.203  -7.125
  293    HA   GLU  36           HA       GLU  36  79.565   1.205  -5.310
  294   1HB   GLU  36          2HB       GLU  36  80.925   2.213  -7.174
  295   2HB   GLU  36          1HB       GLU  36  80.626   3.805  -6.476
  296   1HG   GLU  36          2HG       GLU  36  81.669   3.029  -4.346
  297   2HG   GLU  36          1HG       GLU  36  82.047   1.493  -5.120
  298    H    ILE  37           H        ILE  37  79.112   1.564  -3.205
  299    HA   ILE  37           HA       ILE  37  78.207   4.297  -2.387
  300    HB   ILE  37           HB       ILE  37  76.371   2.814  -3.103
  301   1HG1  ILE  37          2HG1      ILE  37  76.182   2.857  -0.108
  302   2HG1  ILE  37          1HG1      ILE  37  76.296   4.378  -0.991
  303   1HG2  ILE  37          1HG2      ILE  37  77.407   0.647  -2.669
  304   2HG2  ILE  37          2HG2      ILE  37  75.884   0.757  -1.785
  305   3HG2  ILE  37          3HG2      ILE  37  77.414   0.969  -0.934
  306   1HD1  ILE  37          1HD1      ILE  37  74.391   2.861  -2.410
  307   2HD1  ILE  37          2HD1      ILE  37  74.075   4.239  -1.359
  308   3HD1  ILE  37          3HD1      ILE  37  74.017   2.604  -0.705
  309    H    LYS  38           H        LYS  38  78.292   4.677  -0.070
  310    HA   LYS  38           HA       LYS  38  79.910   2.712   1.509
  311   1HB   LYS  38          2HB       LYS  38  81.195   4.702   0.587
  312   2HB   LYS  38          1HB       LYS  38  80.181   5.730   1.608
  313   1HG   LYS  38          2HG       LYS  38  80.913   4.500   3.600
  314   2HG   LYS  38          1HG       LYS  38  81.896   3.435   2.596
  315   1HD   LYS  38          2HD       LYS  38  83.189   5.428   1.819
  316   2HD   LYS  38          1HD       LYS  38  82.255   6.430   2.930
  317   1HE   LYS  38          2HE       LYS  38  83.096   4.432   4.614
  318   2HE   LYS  38          1HE       LYS  38  84.478   4.574   3.510
  319   1HZ   LYS  38          1HZ       LYS  38  83.123   6.856   4.846
  320   2HZ   LYS  38          2HZ       LYS  38  84.477   6.953   3.825
  321   3HZ   LYS  38          3HZ       LYS  38  84.602   6.188   5.336
  322    H    ILE  39           H        ILE  39  79.327   2.561   3.702
  323    HA   ILE  39           HA       ILE  39  76.879   4.098   4.524
  324    HB   ILE  39           HB       ILE  39  76.454   2.104   5.978
  325   1HG1  ILE  39          2HG1      ILE  39  78.686   0.763   4.435
  326   2HG1  ILE  39          1HG1      ILE  39  78.942   1.475   6.028
  327   1HG2  ILE  39          1HG2      ILE  39  76.560   2.054   3.019
  328   2HG2  ILE  39          2HG2      ILE  39  75.197   1.795   4.110
  329   3HG2  ILE  39          3HG2      ILE  39  76.344   0.490   3.805
  330   1HD1  ILE  39          1HD1      ILE  39  76.743   0.026   6.568
  331   2HD1  ILE  39          2HD1      ILE  39  78.370  -0.639   6.708
  332   3HD1  ILE  39          3HD1      ILE  39  77.409  -0.958   5.264
  333    H    VAL  40           H        VAL  40  76.803   4.881   6.678
  334    HA   VAL  40           HA       VAL  40  79.265   4.601   8.343
  335    HB   VAL  40           HB       VAL  40  77.818   7.191   7.675
  336   1HG1  VAL  40          1HG1      VAL  40  80.027   6.460   9.583
  337   2HG1  VAL  40          2HG1      VAL  40  78.662   7.551   9.825
  338   3HG1  VAL  40          3HG1      VAL  40  80.029   8.056   8.833
  339   1HG2  VAL  40          1HG2      VAL  40  80.429   5.978   6.747
  340   2HG2  VAL  40          2HG2      VAL  40  80.154   7.719   6.693
  341   3HG2  VAL  40          3HG2      VAL  40  79.118   6.634   5.766
  342    H    LYS  41           H        LYS  41  78.654   4.005  10.362
  343    HA   LYS  41           HA       LYS  41  76.094   5.035  11.493
  344   1HB   LYS  41          2HB       LYS  41  75.715   2.764  10.618
  345   2HB   LYS  41          1HB       LYS  41  77.091   2.168  11.543
  346   1HG   LYS  41          2HG       LYS  41  75.009   1.663  12.736
  347   2HG   LYS  41          1HG       LYS  41  75.946   2.848  13.644
  348   1HD   LYS  41          2HD       LYS  41  74.546   4.646  12.937
  349   2HD   LYS  41          1HD       LYS  41  73.779   3.656  11.698
  350   1HE   LYS  41          2HE       LYS  41  72.421   2.555  13.227
  351   2HE   LYS  41          1HE       LYS  41  73.594   2.736  14.547
  352   1HZ   LYS  41          1HZ       LYS  41  73.193   5.175  14.403
  353   2HZ   LYS  41          2HZ       LYS  41  71.845   4.286  14.933
  354   3HZ   LYS  41          3HZ       LYS  41  71.912   4.863  13.336
  355    H    TYR  42           H        TYR  42  76.215   5.401  13.730
  356    HA   TYR  42           HA       TYR  42  78.987   5.343  14.854
  357   1HB   TYR  42          2HB       TYR  42  77.615   7.472  14.518
  358   2HB   TYR  42          1HB       TYR  42  76.563   6.888  15.808
  359    HD1  TYR  42           HD1      TYR  42  80.080   7.882  14.974
  360    HD2  TYR  42           HD2      TYR  42  77.222   6.997  18.139
  361    HE1  TYR  42           HE1      TYR  42  81.707   8.748  16.681
  362    HE2  TYR  42           HE2      TYR  42  78.849   7.864  19.850
  363    HH   TYR  42           HH       TYR  42  81.240   9.802  19.320
  364    H    GLU  43           H        GLU  43  79.428   4.035  16.596
  365    HA   GLU  43           HA       GLU  43  77.159   3.138  18.320
  366   1HB   GLU  43          2HB       GLU  43  78.117   0.845  18.263
  367   2HB   GLU  43          1HB       GLU  43  77.630   1.384  16.657
  368   1HG   GLU  43          2HG       GLU  43  79.975   2.030  16.174
  369   2HG   GLU  43          1HG       GLU  43  80.453   1.443  17.768
  370    H    GLY  44           H        GLY  44  77.671   3.240  20.476
  371   1HA   GLY  44          2HA       GLY  44  78.903   3.684  22.420
  372   2HA   GLY  44          1HA       GLY  44  80.257   2.877  21.629
  373    H    GLU  45           H        GLU  45  81.985   4.216  21.699
  374    HA   GLU  45           HA       GLU  45  81.564   7.146  21.307
  375   1HB   GLU  45          2HB       GLU  45  83.699   7.377  22.465
  376   2HB   GLU  45          1HB       GLU  45  82.648   6.310  23.391
  377   1HG   GLU  45          2HG       GLU  45  83.808   4.340  22.428
  378   2HG   GLU  45          1HG       GLU  45  84.864   5.416  21.516
  379    H    GLU  46           H        GLU  46  82.141   4.673  19.262
  380    HA   GLU  46           HA       GLU  46  84.127   6.245  17.671
  381   1HB   GLU  46          2HB       GLU  46  85.110   4.066  17.009
  382   2HB   GLU  46          1HB       GLU  46  85.169   4.306  18.753
  383   1HG   GLU  46          2HG       GLU  46  83.063   2.955  18.955
  384   2HG   GLU  46          1HG       GLU  46  83.162   2.621  17.226
  385    HA   PRO  47           HA       PRO  47  81.002   5.592  14.481
  386   1HB   PRO  47          2HB       PRO  47  82.775   6.711  12.495
  387   2HB   PRO  47          1HB       PRO  47  81.349   7.459  13.232
  388   1HG   PRO  47          2HG       PRO  47  83.964   8.257  13.625
  389   2HG   PRO  47          1HG       PRO  47  82.591   8.669  14.660
  390   1HD   PRO  47          2HD       PRO  47  84.745   6.682  15.091
  391   2HD   PRO  47          1HD       PRO  47  83.801   7.615  16.273
  392    H    LYS  48           H        LYS  48  80.770   4.010  12.859
  393    HA   LYS  48           HA       LYS  48  83.223   2.493  12.040
  394   1HB   LYS  48          2HB       LYS  48  80.392   1.504  12.530
  395   2HB   LYS  48          1HB       LYS  48  81.732   0.509  11.964
  396   1HG   LYS  48          2HG       LYS  48  81.747   2.039  14.578
  397   2HG   LYS  48          1HG       LYS  48  81.345   0.328  14.432
  398   1HD   LYS  48          2HD       LYS  48  83.577  -0.039  13.342
  399   2HD   LYS  48          1HD       LYS  48  83.977   1.640  13.709
  400   1HE   LYS  48          2HE       LYS  48  84.072   1.254  16.015
  401   2HE   LYS  48          1HE       LYS  48  83.017  -0.169  15.919
  402   1HZ   LYS  48          1HZ       LYS  48  85.260  -0.926  16.165
  403   2HZ   LYS  48          2HZ       LYS  48  85.797   0.066  14.894
  404   3HZ   LYS  48          3HZ       LYS  48  84.774  -1.252  14.574
  405    H    GLU  49           H        GLU  49  83.435   2.233   9.814
  406    HA   GLU  49           HA       GLU  49  81.152   3.113   8.081
  407   1HB   GLU  49          2HB       GLU  49  84.084   3.886   7.940
  408   2HB   GLU  49          1HB       GLU  49  82.859   4.367   6.767
  409   1HG   GLU  49          2HG       GLU  49  81.579   5.473   8.594
  410   2HG   GLU  49          1HG       GLU  49  82.864   5.050   9.723
  411    H    GLY  50           H        GLY  50  81.409   2.387   5.809
  412   1HA   GLY  50          2HA       GLY  50  83.391   0.320   5.203
  413   2HA   GLY  50          1HA       GLY  50  81.742  -0.288   5.355
  414    H    THR  51           H        THR  51  83.738   0.277   3.005
  415    HA   THR  51           HA       THR  51  81.682   1.582   1.242
  416    HB   THR  51           HB       THR  51  84.665   1.519   0.743
  417    HG1  THR  51           HG1      THR  51  84.768   2.722   2.466
  418   1HG2  THR  51          1HG2      THR  51  84.219   2.986  -0.954
  419   2HG2  THR  51          2HG2      THR  51  82.913   3.772  -0.068
  420   3HG2  THR  51          3HG2      THR  51  82.624   2.234  -0.883
  421    H    PHE  52           H        PHE  52  81.098   0.365  -0.561
  422    HA   PHE  52           HA       PHE  52  82.891  -1.734  -1.574
  423   1HB   PHE  52          2HB       PHE  52  81.465  -3.592  -1.050
  424   2HB   PHE  52          1HB       PHE  52  81.619  -2.662   0.433
  425    HD1  PHE  52           HD1      PHE  52  79.343  -4.143  -1.921
  426    HD2  PHE  52           HD2      PHE  52  79.717  -0.876   0.936
  427    HE1  PHE  52           HE1      PHE  52  76.842  -3.929  -1.841
  428    HE2  PHE  52           HE2      PHE  52  77.210  -0.663   1.017
  429    HZ   PHE  52           HZ       PHE  52  75.774  -2.192  -0.380
  430    H    THR  53           H        THR  53  81.757  -2.910  -3.480
  431    HA   THR  53           HA       THR  53  80.039  -0.970  -4.991
  432    HB   THR  53           HB       THR  53  81.782  -3.269  -5.945
  433    HG1  THR  53           HG1      THR  53  83.335  -1.873  -5.999
  434   1HG2  THR  53          1HG2      THR  53  81.478  -1.912  -8.143
  435   2HG2  THR  53          2HG2      THR  53  80.082  -1.204  -7.329
  436   3HG2  THR  53          3HG2      THR  53  80.152  -2.945  -7.609
  437    H    ALA  54           H        ALA  54  78.034  -1.711  -5.718
  438    HA   ALA  54           HA       ALA  54  77.305  -4.561  -5.198
  439   1HB   ALA  54          1HB       ALA  54  75.292  -2.537  -4.459
  440   2HB   ALA  54          2HB       ALA  54  76.764  -2.459  -3.493
  441   3HB   ALA  54          3HB       ALA  54  75.832  -3.955  -3.562
  442    H    ARG  55           H        ARG  55  75.702  -5.367  -6.576
  443    HA   ARG  55           HA       ARG  55  74.966  -3.677  -8.911
  444   1HB   ARG  55          2HB       ARG  55  75.909  -6.059  -9.020
  445   2HB   ARG  55          1HB       ARG  55  74.355  -6.594  -8.380
  446   1HG   ARG  55          2HG       ARG  55  73.230  -5.400 -10.284
  447   2HG   ARG  55          1HG       ARG  55  74.827  -5.076 -10.959
  448   1HD   ARG  55          2HD       ARG  55  75.244  -7.594 -10.885
  449   2HD   ARG  55          1HD       ARG  55  73.513  -7.774 -10.533
  450    HE   ARG  55           HE       ARG  55  74.043  -6.029 -12.816
  451   1HH1  ARG  55          1HH1      ARG  55  73.542  -9.351 -11.801
  452   2HH1  ARG  55          2HH1      ARG  55  73.018  -9.848 -13.371
  453   1HH2  ARG  55          1HH2      ARG  55  73.359  -6.730 -14.820
  454   2HH2  ARG  55          2HH2      ARG  55  72.915  -8.386 -15.059
  455    H    VAL  56           H        VAL  56  72.804  -3.177  -9.357
  456    HA   VAL  56           HA       VAL  56  70.935  -3.185  -7.106
  457    HB   VAL  56           HB       VAL  56  70.752  -2.301 -10.007
  458   1HG1  VAL  56          1HG1      VAL  56  68.613  -1.634  -9.671
  459   2HG1  VAL  56          2HG1      VAL  56  68.965  -1.011  -8.057
  460   3HG1  VAL  56          3HG1      VAL  56  68.611  -2.721  -8.282
  461   1HG2  VAL  56          1HG2      VAL  56  70.884  -0.441  -7.675
  462   2HG2  VAL  56          2HG2      VAL  56  71.531  -0.243  -9.303
  463   3HG2  VAL  56          3HG2      VAL  56  72.367  -1.271  -8.140
  464    H    GLY  57           H        GLY  57  69.530  -4.783  -6.701
  465   1HA   GLY  57          2HA       GLY  57  68.966  -6.803  -8.818
  466   2HA   GLY  57          1HA       GLY  57  68.771  -7.072  -7.085
  467    H    GLU  58           H        GLU  58  66.610  -7.832  -7.898
  468    HA   GLU  58           HA       GLU  58  64.626  -6.078  -8.978
  469   1HB   GLU  58          2HB       GLU  58  64.550  -8.581  -8.812
  470   2HB   GLU  58          1HB       GLU  58  64.298  -8.422  -7.074
  471   1HG   GLU  58          2HG       GLU  58  62.248  -7.086  -7.521
  472   2HG   GLU  58          1HG       GLU  58  62.482  -7.334  -9.248
  473    H    GLN  59           H        GLN  59  62.922  -4.946  -7.885
  474    HA   GLN  59           HA       GLN  59  62.072  -3.466  -6.265
  475   1HB   GLN  59          2HB       GLN  59  63.062  -5.841  -4.688
  476   2HB   GLN  59          1HB       GLN  59  62.232  -4.497  -3.904
  477   1HG   GLN  59          2HG       GLN  59  60.289  -4.804  -5.358
  478   2HG   GLN  59          1HG       GLN  59  61.117  -6.093  -6.228
  479   1HE2  GLN  59          1HE2      GLN  59  61.095  -8.192  -5.308
  480   2HE2  GLN  59          2HE2      GLN  59  60.363  -8.556  -3.822
  481    H    GLY  60           H        GLY  60  65.143  -3.358  -6.977
  482   1HA   GLY  60          2HA       GLY  60  66.729  -1.704  -6.463
  483   2HA   GLY  60          1HA       GLY  60  65.569  -1.054  -5.308
  484    H    SER  61           H        SER  61  66.477  -4.383  -4.914
  485    HA   SER  61           HA       SER  61  67.473  -3.821  -2.239
  486   1HB   SER  61          2HB       SER  61  67.520  -6.380  -3.870
  487   2HB   SER  61          1HB       SER  61  67.604  -6.256  -2.116
  488    HG   SER  61           HG       SER  61  65.448  -6.028  -3.835
  489    H    VAL  62           H        VAL  62  69.595  -3.996  -1.492
  490    HA   VAL  62           HA       VAL  62  71.738  -4.765  -3.411
  491    HB   VAL  62           HB       VAL  62  71.510  -2.308  -3.457
  492   1HG1  VAL  62          1HG1      VAL  62  72.011  -2.486  -0.471
  493   2HG1  VAL  62          2HG1      VAL  62  70.494  -2.009  -1.234
  494   3HG1  VAL  62          3HG1      VAL  62  71.925  -0.994  -1.407
  495   1HG2  VAL  62          1HG2      VAL  62  73.945  -2.957  -1.794
  496   2HG2  VAL  62          2HG2      VAL  62  73.798  -1.791  -3.110
  497   3HG2  VAL  62          3HG2      VAL  62  73.787  -3.521  -3.457
  498    H    ILE  63           H        ILE  63  73.480  -5.829  -2.367
  499    HA   ILE  63           HA       ILE  63  72.979  -6.507   0.509
  500    HB   ILE  63           HB       ILE  63  74.477  -7.987  -1.681
  501   1HG1  ILE  63          2HG1      ILE  63  72.070  -7.833  -2.189
  502   2HG1  ILE  63          1HG1      ILE  63  72.495  -9.479  -1.732
  503   1HG2  ILE  63          1HG2      ILE  63  75.303  -8.697   0.447
  504   2HG2  ILE  63          2HG2      ILE  63  74.144  -9.925  -0.061
  505   3HG2  ILE  63          3HG2      ILE  63  73.683  -8.723   1.143
  506   1HD1  ILE  63          1HD1      ILE  63  70.423  -8.837  -0.606
  507   2HD1  ILE  63          2HD1      ILE  63  71.199  -7.398   0.057
  508   3HD1  ILE  63          3HD1      ILE  63  71.709  -9.000   0.590
  509    H    ILE  64           H        ILE  64  74.430  -5.722   1.955
  510    HA   ILE  64           HA       ILE  64  77.040  -4.613   1.146
  511    HB   ILE  64           HB       ILE  64  75.731  -5.135   3.843
  512   1HG1  ILE  64          2HG1      ILE  64  76.035  -2.464   2.474
  513   2HG1  ILE  64          1HG1      ILE  64  74.656  -3.503   2.116
  514   1HG2  ILE  64          1HG2      ILE  64  78.234  -4.895   3.895
  515   2HG2  ILE  64          2HG2      ILE  64  77.385  -3.612   4.759
  516   3HG2  ILE  64          3HG2      ILE  64  78.050  -3.305   3.155
  517   1HD1  ILE  64          1HD1      ILE  64  74.628  -1.710   4.127
  518   2HD1  ILE  64          2HD1      ILE  64  75.297  -3.094   4.991
  519   3HD1  ILE  64          3HD1      ILE  64  73.728  -3.224   4.195
  520    HA   PRO  65           HA       PRO  65  79.217  -8.477   1.531
  521   1HB   PRO  65          2HB       PRO  65  81.697  -7.579   2.261
  522   2HB   PRO  65          1HB       PRO  65  81.063  -7.406   0.608
  523   1HG   PRO  65          2HG       PRO  65  81.004  -5.421   2.855
  524   2HG   PRO  65          1HG       PRO  65  81.566  -5.191   1.186
  525   1HD   PRO  65          2HD       PRO  65  79.144  -4.383   1.869
  526   2HD   PRO  65          1HD       PRO  65  79.383  -5.236   0.322
  527    H    LYS  66           H        LYS  66  79.297  -9.928   3.208
  528    HA   LYS  66           HA       LYS  66  78.563  -9.340   5.874
  529   1HB   LYS  66          2HB       LYS  66  78.513 -11.556   4.718
  530   2HB   LYS  66          1HB       LYS  66  80.272 -11.629   4.847
  531   1HG   LYS  66          2HG       LYS  66  80.078 -11.463   7.318
  532   2HG   LYS  66          1HG       LYS  66  78.320 -11.464   7.164
  533   1HD   LYS  66          2HD       LYS  66  78.483 -13.674   5.989
  534   2HD   LYS  66          1HD       LYS  66  80.212 -13.684   6.338
  535   1HE   LYS  66          2HE       LYS  66  79.678 -13.498   8.781
  536   2HE   LYS  66          1HE       LYS  66  77.957 -13.653   8.375
  537   1HZ   LYS  66          1HZ       LYS  66  78.793 -15.832   8.806
  538   2HZ   LYS  66          2HZ       LYS  66  80.122 -15.596   7.775
  539   3HZ   LYS  66          3HZ       LYS  66  78.553 -15.704   7.131
  540    H    ALA  67           H        ALA  67  81.767  -9.482   4.395
  541    HA   ALA  67           HA       ALA  67  83.396  -9.526   6.725
  542   1HB   ALA  67          1HB       ALA  67  84.878  -8.086   4.991
  543   2HB   ALA  67          2HB       ALA  67  83.624  -8.647   3.884
  544   3HB   ALA  67          3HB       ALA  67  84.599  -9.814   4.777
  545    H    LEU  68           H        LEU  68  81.868  -6.801   5.037
  546    HA   LEU  68           HA       LEU  68  83.067  -4.772   6.762
  547   1HB   LEU  68          2HB       LEU  68  80.809  -4.784   4.739
  548   2HB   LEU  68          1HB       LEU  68  81.364  -3.324   5.554
  549    HG   LEU  68           HG       LEU  68  83.080  -5.140   3.824
  550   1HD1  LEU  68          1HD1      LEU  68  82.808  -3.631   2.100
  551   2HD1  LEU  68          2HD1      LEU  68  82.533  -2.273   3.190
  552   3HD1  LEU  68          3HD1      LEU  68  81.241  -3.433   2.885
  553   1HD2  LEU  68          1HD2      LEU  68  83.658  -2.678   5.475
  554   2HD2  LEU  68          2HD2      LEU  68  84.630  -3.051   4.051
  555   3HD2  LEU  68          3HD2      LEU  68  84.564  -4.189   5.397
  556    H    ARG  69           H        ARG  69  80.017  -6.602   6.721
  557    HA   ARG  69           HA       ARG  69  78.505  -5.079   8.606
  558   1HB   ARG  69          2HB       ARG  69  78.700  -8.103   8.337
  559   2HB   ARG  69          1HB       ARG  69  77.349  -7.212   9.021
  560   1HG   ARG  69          2HG       ARG  69  77.060  -6.112   6.754
  561   2HG   ARG  69          1HG       ARG  69  78.242  -7.267   6.131
  562   1HD   ARG  69          2HD       ARG  69  76.675  -9.017   7.402
  563   2HD   ARG  69          1HD       ARG  69  75.457  -7.765   7.105
  564    HE   ARG  69           HE       ARG  69  76.658  -7.937   4.662
  565   1HH1  ARG  69          1HH1      ARG  69  75.402 -10.415   6.814
  566   2HH1  ARG  69          2HH1      ARG  69  75.081 -11.507   5.514
  567   1HH2  ARG  69          1HH2      ARG  69  76.212  -9.391   3.035
  568   2HH2  ARG  69          2HH2      ARG  69  75.531 -10.938   3.403
  569    H    ASP  70           H        ASP  70  80.809  -7.745   9.104
  570    HA   ASP  70           HA       ASP  70  80.532  -7.855  11.963
  571   1HB   ASP  70          2HB       ASP  70  82.738  -8.757  10.080
  572   2HB   ASP  70          1HB       ASP  70  82.589  -9.271  11.759
  573    H    VAL  71           H        VAL  71  83.051  -6.389   9.881
  574    HA   VAL  71           HA       VAL  71  84.742  -5.419  11.965
  575    HB   VAL  71           HB       VAL  71  84.139  -4.378   9.171
  576   1HG1  VAL  71          1HG1      VAL  71  85.286  -2.660  10.495
  577   2HG1  VAL  71          2HG1      VAL  71  86.386  -3.338   9.293
  578   3HG1  VAL  71          3HG1      VAL  71  86.512  -3.831  10.982
  579   1HG2  VAL  71          1HG2      VAL  71  86.563  -5.960   9.957
  580   2HG2  VAL  71          2HG2      VAL  71  85.748  -5.867   8.396
  581   3HG2  VAL  71          3HG2      VAL  71  85.036  -6.808   9.707
  582    H    ILE  72           H        ILE  72  81.915  -3.961  10.404
  583    HA   ILE  72           HA       ILE  72  82.193  -1.422  11.817
  584    HB   ILE  72           HB       ILE  72  79.963  -2.613  10.122
  585   1HG1  ILE  72          2HG1      ILE  72  82.194  -0.692   9.369
  586   2HG1  ILE  72          1HG1      ILE  72  82.209  -2.418   9.011
  587   1HG2  ILE  72          1HG2      ILE  72  78.974  -0.507  10.048
  588   2HG2  ILE  72          2HG2      ILE  72  80.476   0.328  10.436
  589   3HG2  ILE  72          3HG2      ILE  72  79.582  -0.507  11.702
  590   1HD1  ILE  72          1HD1      ILE  72  80.450  -0.266   7.878
  591   2HD1  ILE  72          2HD1      ILE  72  79.861  -1.931   7.933
  592   3HD1  ILE  72          3HD1      ILE  72  81.330  -1.542   7.035
  593    H    GLY  73           H        GLY  73  80.655  -4.474  12.538
  594   1HA   GLY  73          2HA       GLY  73  79.621  -5.121  14.551
  595   2HA   GLY  73          1HA       GLY  73  79.867  -3.480  15.147
  596    H    ILE  74           H        ILE  74  78.149  -4.319  12.172
  597    HA   ILE  74           HA       ILE  74  75.850  -2.718  13.100
  598    HB   ILE  74           HB       ILE  74  76.438  -4.115  10.468
  599   1HG1  ILE  74          2HG1      ILE  74  78.188  -2.471  11.027
  600   2HG1  ILE  74          1HG1      ILE  74  77.190  -1.877   9.702
  601   1HG2  ILE  74          1HG2      ILE  74  74.867  -2.193   9.680
  602   2HG2  ILE  74          2HG2      ILE  74  74.356  -2.136  11.366
  603   3HG2  ILE  74          3HG2      ILE  74  74.146  -3.616  10.431
  604   1HD1  ILE  74          1HD1      ILE  74  77.211  -0.990  12.586
  605   2HD1  ILE  74          2HD1      ILE  74  75.805  -0.696  11.564
  606   3HD1  ILE  74          3HD1      ILE  74  77.369  -0.008  11.131
  607    H    LYS  75           H        LYS  75  73.774  -3.516  13.444
  608    HA   LYS  75           HA       LYS  75  73.405  -6.491  13.307
  609   1HB   LYS  75          2HB       LYS  75  72.783  -4.469  15.472
  610   2HB   LYS  75          1HB       LYS  75  72.094  -6.092  15.470
  611   1HG   LYS  75          2HG       LYS  75  74.109  -7.101  15.936
  612   2HG   LYS  75          1HG       LYS  75  75.041  -5.868  15.085
  613   1HD   LYS  75          2HD       LYS  75  75.488  -5.584  17.432
  614   2HD   LYS  75          1HD       LYS  75  74.424  -4.263  16.948
  615   1HE   LYS  75          2HE       LYS  75  72.515  -5.971  17.657
  616   2HE   LYS  75          1HE       LYS  75  73.816  -6.649  18.657
  617   1HZ   LYS  75          1HZ       LYS  75  74.291  -4.395  19.454
  618   2HZ   LYS  75          2HZ       LYS  75  72.713  -4.879  19.853
  619   3HZ   LYS  75          3HZ       LYS  75  72.974  -3.799  18.568
  620    HA   PRO  76           HA       PRO  76  69.581  -5.825  11.245
  621   1HB   PRO  76          2HB       PRO  76  67.803  -7.373  12.743
  622   2HB   PRO  76          1HB       PRO  76  68.841  -7.979  11.440
  623   1HG   PRO  76          2HG       PRO  76  69.209  -8.128  14.377
  624   2HG   PRO  76          1HG       PRO  76  69.673  -9.281  13.117
  625   1HD   PRO  76          2HD       PRO  76  71.458  -7.673  14.355
  626   2HD   PRO  76          1HD       PRO  76  71.646  -8.197  12.665
  627    H    GLY  77           H        GLY  77  68.077  -4.195  11.341
  628   1HA   GLY  77          2HA       GLY  77  66.305  -2.923  12.303
  629   2HA   GLY  77          1HA       GLY  77  66.737  -3.561  13.886
  630    H    GLU  78           H        GLU  78  69.616  -2.530  12.535
  631    HA   GLU  78           HA       GLU  78  69.490   0.027  14.051
  632   1HB   GLU  78          2HB       GLU  78  71.555  -1.938  13.196
  633   2HB   GLU  78          1HB       GLU  78  72.073  -0.255  13.310
  634   1HG   GLU  78          2HG       GLU  78  71.093  -0.164  15.614
  635   2HG   GLU  78          1HG       GLU  78  70.757  -1.891  15.496
  636    H    VAL  79           H        VAL  79  69.458   1.960  13.018
  637    HA   VAL  79           HA       VAL  79  69.296   1.942  10.075
  638    HB   VAL  79           HB       VAL  79  67.610   3.030  11.514
  639   1HG1  VAL  79          1HG1      VAL  79  69.186   5.376  12.241
  640   2HG1  VAL  79          2HG1      VAL  79  69.837   3.914  12.977
  641   3HG1  VAL  79          3HG1      VAL  79  68.156   4.363  13.251
  642   1HG2  VAL  79          1HG2      VAL  79  67.693   5.311  10.403
  643   2HG2  VAL  79          2HG2      VAL  79  67.840   3.942   9.300
  644   3HG2  VAL  79          3HG2      VAL  79  69.273   4.860   9.762
  645    H    ILE  80           H        ILE  80  70.877   2.645   8.757
  646    HA   ILE  80           HA       ILE  80  73.153   4.228   9.892
  647    HB   ILE  80           HB       ILE  80  74.528   3.049   8.187
  648   1HG1  ILE  80          2HG1      ILE  80  71.998   1.487   7.577
  649   2HG1  ILE  80          1HG1      ILE  80  72.659   2.759   6.547
  650   1HG2  ILE  80          1HG2      ILE  80  73.852   2.056  10.532
  651   2HG2  ILE  80          2HG2      ILE  80  74.710   1.048   9.368
  652   3HG2  ILE  80          3HG2      ILE  80  72.965   0.883   9.560
  653   1HD1  ILE  80          1HD1      ILE  80  74.411   0.470   7.404
  654   2HD1  ILE  80          2HD1      ILE  80  74.547   1.500   5.979
  655   3HD1  ILE  80          3HD1      ILE  80  73.294   0.262   6.056
  656    H    GLU  81           H        GLU  81  74.099   5.757   8.339
  657    HA   GLU  81           HA       GLU  81  72.133   6.865   6.390
  658   1HB   GLU  81          2HB       GLU  81  73.134   8.327   8.139
  659   2HB   GLU  81          1HB       GLU  81  74.742   7.937   7.527
  660   1HG   GLU  81          2HG       GLU  81  74.085   8.873   5.310
  661   2HG   GLU  81          1HG       GLU  81  72.534   9.350   6.002
  662    H    VAL  82           H        VAL  82  72.504   6.554   4.248
  663    HA   VAL  82           HA       VAL  82  75.040   5.188   3.465
  664    HB   VAL  82           HB       VAL  82  72.205   5.097   2.372
  665   1HG1  VAL  82          1HG1      VAL  82  73.117   3.070   1.143
  666   2HG1  VAL  82          2HG1      VAL  82  74.731   3.622   1.592
  667   3HG1  VAL  82          3HG1      VAL  82  73.709   4.628   0.564
  668   1HG2  VAL  82          1HG2      VAL  82  72.570   2.643   3.248
  669   2HG2  VAL  82          2HG2      VAL  82  72.129   3.915   4.388
  670   3HG2  VAL  82          3HG2      VAL  82  73.809   3.392   4.256
  671    H    LEU  83           H        LEU  83  76.310   6.180   2.004
  672    HA   LEU  83           HA       LEU  83  75.225   8.490   0.419
  673   1HB   LEU  83          2HB       LEU  83  78.102   7.887   1.215
  674   2HB   LEU  83          1HB       LEU  83  77.478   9.400   0.572
  675    HG   LEU  83           HG       LEU  83  76.753   8.200   3.263
  676   1HD1  LEU  83          1HD1      LEU  83  78.361  10.688   2.636
  677   2HD1  LEU  83          2HD1      LEU  83  79.091   9.124   3.005
  678   3HD1  LEU  83          3HD1      LEU  83  78.107   9.949   4.217
  679   1HD2  LEU  83          1HD2      LEU  83  76.081  10.924   2.116
  680   2HD2  LEU  83          2HD2      LEU  83  75.504  10.232   3.634
  681   3HD2  LEU  83          3HD2      LEU  83  74.973   9.551   2.096
  682    H    LEU  84           H        LEU  84  75.267   8.153  -1.805
  683    HA   LEU  84           HA       LEU  84  76.664   5.824  -2.971
  684   1HB   LEU  84          2HB       LEU  84  74.831   8.018  -3.889
  685   2HB   LEU  84          1HB       LEU  84  75.776   7.134  -5.090
  686    HG   LEU  84           HG       LEU  84  74.322   5.556  -3.009
  687   1HD1  LEU  84          1HD1      LEU  84  72.267   6.232  -3.637
  688   2HD1  LEU  84          2HD1      LEU  84  72.625   5.809  -5.309
  689   3HD1  LEU  84          3HD1      LEU  84  72.977   7.429  -4.715
  690   1HD2  LEU  84          1HD2      LEU  84  75.489   4.131  -4.397
  691   2HD2  LEU  84          2HD2      LEU  84  75.410   5.235  -5.770
  692   3HD2  LEU  84          3HD2      LEU  84  74.004   4.260  -5.340
  693    H    LEU  85           H        LEU  85  78.573   5.966  -4.174
  694    HA   LEU  85           HA       LEU  85  80.012   8.586  -4.011
  695   1HB   LEU  85          2HB       LEU  85  80.798   5.702  -3.610
  696   2HB   LEU  85          1HB       LEU  85  82.018   6.945  -3.898
  697    HG   LEU  85           HG       LEU  85  79.930   7.063  -1.701
  698   1HD1  LEU  85          1HD1      LEU  85  81.820   6.579  -0.185
  699   2HD1  LEU  85          2HD1      LEU  85  82.887   6.390  -1.578
  700   3HD1  LEU  85          3HD1      LEU  85  81.563   5.253  -1.319
  701   1HD2  LEU  85          1HD2      LEU  85  80.548   9.283  -2.119
  702   2HD2  LEU  85          2HD2      LEU  85  82.184   8.840  -2.606
  703   3HD2  LEU  85          3HD2      LEU  85  81.733   8.808  -0.902
  704    H    GLY  86           H        GLY  86  79.171   5.874  -6.098
  705   1HA   GLY  86          2HA       GLY  86  80.069   7.339  -8.474
  706   2HA   GLY  86          1HA       GLY  86  81.115   5.983  -8.087
  707    H    HIS  87           H        HIS  87  80.079   5.642 -10.441
  708    HA   HIS  87           HA       HIS  87  77.929   3.605 -10.095
  709   1HB   HIS  87          2HB       HIS  87  76.658   4.676 -11.947
  710   2HB   HIS  87          1HB       HIS  87  76.835   5.762 -10.575
  711    HD1  HIS  87           HD1      HIS  87  78.065   5.216 -14.089
  712    HD2  HIS  87           HD2      HIS  87  78.447   8.046 -11.052
  713    HE1  HIS  87           HE1      HIS  87  79.183   7.236 -15.130
  714    H    TYR  88           H        TYR  88  77.890   2.041 -11.831
  715    HA   TYR  88           HA       TYR  88  79.969   2.317 -13.953
  716   1HB   TYR  88          2HB       TYR  88  79.549  -0.013 -12.054
  717   2HB   TYR  88          1HB       TYR  88  80.572  -0.089 -13.488
  718    HD1  TYR  88           HD1      TYR  88  80.266   1.129 -10.030
  719    HD2  TYR  88           HD2      TYR  88  82.610   1.395 -13.691
  720    HE1  TYR  88           HE1      TYR  88  82.157   2.175  -8.744
  721    HE2  TYR  88           HE2      TYR  88  84.501   2.441 -12.405
  722    HH   TYR  88           HH       TYR  88  84.357   3.904  -9.758
  723    H    LYS  89           H        LYS  89  79.308   1.418 -15.924
  724    HA   LYS  89           HA       LYS  89  76.614   0.087 -15.966
  725   1HB   LYS  89          2HB       LYS  89  77.951   2.123 -17.759
  726   2HB   LYS  89          1HB       LYS  89  76.557   1.188 -18.301
  727   1HG   LYS  89          2HG       LYS  89  76.341   2.496 -15.634
  728   2HG   LYS  89          1HG       LYS  89  76.295   3.552 -17.047
  729   1HD   LYS  89          2HD       LYS  89  74.337   2.601 -17.865
  730   2HD   LYS  89          1HD       LYS  89  74.615   1.068 -17.040
  731   1HE   LYS  89          2HE       LYS  89  73.766   1.844 -15.018
  732   2HE   LYS  89          1HE       LYS  89  74.187   3.532 -15.375
  733   1HZ   LYS  89          1HZ       LYS  89  72.485   3.659 -16.999
  734   2HZ   LYS  89          2HZ       LYS  89  71.767   2.984 -15.614
  735   3HZ   LYS  89          3HZ       LYS  89  72.183   1.992 -16.929
  736    HA   PRO  90           HA       PRO  90  78.444  -3.432 -17.953
  737   1HB   PRO  90          2HB       PRO  90  76.229  -3.153 -19.962
  738   2HB   PRO  90          1HB       PRO  90  76.730  -4.583 -19.033
  739   1HG   PRO  90          2HG       PRO  90  74.574  -3.317 -18.299
  740   2HG   PRO  90          1HG       PRO  90  75.754  -3.790 -17.059
  741   1HD   PRO  90          2HD       PRO  90  75.322  -1.095 -18.310
  742   2HD   PRO  90          1HD       PRO  90  75.557  -1.516 -16.594
  743    H    ARG  91           H        ARG  91  79.963  -3.747 -19.597
  744    HA   ARG  91           HA       ARG  91  80.028  -1.741 -21.830
  745   1HB   ARG  91          2HB       ARG  91  82.270  -2.908 -20.149
  746   2HB   ARG  91          1HB       ARG  91  82.520  -1.877 -21.559
  747   1HG   ARG  91          2HG       ARG  91  81.152  -0.103 -20.455
  748   2HG   ARG  91          1HG       ARG  91  81.042  -1.124 -19.021
  749   1HD   ARG  91          2HD       ARG  91  83.562  -1.148 -18.920
  750   2HD   ARG  91          1HD       ARG  91  83.567   0.051 -20.229
  751    HE   ARG  91           HE       ARG  91  82.798   1.666 -18.691
  752   1HH1  ARG  91          1HH1      ARG  91  82.277  -1.547 -17.378
  753   2HH1  ARG  91          2HH1      ARG  91  81.752  -0.938 -15.849
  754   1HH2  ARG  91          1HH2      ARG  91  82.113   2.393 -16.697
  755   2HH2  ARG  91          2HH2      ARG  91  81.659   1.263 -15.465
  756    H    ASN  92           H        ASN  92  80.692  -2.573 -23.858
  757    HA   ASN  92           HA       ASN  92  81.688  -5.298 -24.187
  758   1HB   ASN  92          2HB       ASN  92  79.194  -5.437 -23.581
  759   2HB   ASN  92          1HB       ASN  92  78.882  -4.706 -25.156
  760   1HD2  ASN  92          1HD2      ASN  92  78.534  -6.226 -26.773
  761   2HD2  ASN  92          2HD2      ASN  92  79.194  -7.790 -26.805
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1  84.038  15.418  -0.041
    2   2H    MET   1          2H        MET   1  84.665  15.203  -1.606
    3   3H    MET   1          3H        MET   1  85.463  14.528  -0.266
    4    HA   MET   1           HA       MET   1  84.285  12.774  -1.387
    5   1HB   MET   1          2HB       MET   1  84.444  12.965   1.124
    6   2HB   MET   1          1HB       MET   1  82.838  13.695   1.116
    7   1HG   MET   1          2HG       MET   1  81.973  11.654  -0.049
    8   2HG   MET   1          1HG       MET   1  83.565  10.920   0.139
    9   1HE   MET   1          1HE       MET   1  84.232  11.875   3.622
   10   2HE   MET   1          2HE       MET   1  84.820  11.197   2.107
   11   3HE   MET   1          3HE       MET   1  84.283  10.121   3.393
   12    H    ASP   2           H        ASP   2  83.140  13.353  -3.296
   13    HA   ASP   2           HA       ASP   2  80.625  14.845  -3.217
   14   1HB   ASP   2          2HB       ASP   2  82.015  13.170  -5.335
   15   2HB   ASP   2          1HB       ASP   2  80.612  14.196  -5.637
   16    H    VAL   3           H        VAL   3  78.527  13.961  -3.392
   17    HA   VAL   3           HA       VAL   3  78.311  10.990  -3.279
   18    HB   VAL   3           HB       VAL   3  78.072  12.358  -1.099
   19   1HG1  VAL   3          1HG1      VAL   3  75.298  12.906  -2.173
   20   2HG1  VAL   3          2HG1      VAL   3  76.581  14.121  -2.155
   21   3HG1  VAL   3          3HG1      VAL   3  75.986  13.446  -0.638
   22   1HG2  VAL   3          1HG2      VAL   3  75.815  10.536  -1.974
   23   2HG2  VAL   3          2HG2      VAL   3  76.244  10.903  -0.302
   24   3HG2  VAL   3          3HG2      VAL   3  77.371  10.012  -1.327
   25    H    LEU   4           H        LEU   4  76.736  10.139  -4.625
   26    HA   LEU   4           HA       LEU   4  75.445  11.977  -6.532
   27   1HB   LEU   4          2HB       LEU   4  75.334   8.952  -6.318
   28   2HB   LEU   4          1HB       LEU   4  74.961   9.917  -7.741
   29    HG   LEU   4           HG       LEU   4  77.680   9.580  -6.428
   30   1HD1  LEU   4          1HD1      LEU   4  77.297   7.701  -7.782
   31   2HD1  LEU   4          2HD1      LEU   4  78.166   8.797  -8.857
   32   3HD1  LEU   4          3HD1      LEU   4  76.415   8.636  -8.990
   33   1HD2  LEU   4          1HD2      LEU   4  78.362  10.928  -8.580
   34   2HD2  LEU   4          2HD2      LEU   4  77.789  11.807  -7.159
   35   3HD2  LEU   4          3HD2      LEU   4  76.699  11.515  -8.518
   36    H    ALA   5           H        ALA   5  74.570  10.275  -3.628
   37    HA   ALA   5           HA       ALA   5  71.988  11.543  -3.521
   38   1HB   ALA   5          1HB       ALA   5  71.974   9.398  -5.177
   39   2HB   ALA   5          2HB       ALA   5  70.573   9.853  -4.206
   40   3HB   ALA   5          3HB       ALA   5  71.661   8.584  -3.645
   41    H    LYS   6           H        LYS   6  71.004  11.175  -1.426
   42    HA   LYS   6           HA       LYS   6  72.681   9.600   0.507
   43   1HB   LYS   6          2HB       LYS   6  73.172  12.060   0.433
   44   2HB   LYS   6          1HB       LYS   6  71.491  12.373   0.863
   45   1HG   LYS   6          2HG       LYS   6  71.770  11.149   2.965
   46   2HG   LYS   6          1HG       LYS   6  73.432  10.755   2.534
   47   1HD   LYS   6          2HD       LYS   6  73.621  13.391   2.251
   48   2HD   LYS   6          1HD       LYS   6  72.266  13.374   3.381
   49   1HE   LYS   6          2HE       LYS   6  73.914  11.572   4.586
   50   2HE   LYS   6          1HE       LYS   6  75.105  12.657   3.842
   51   1HZ   LYS   6          1HZ       LYS   6  72.753  13.586   5.401
   52   2HZ   LYS   6          2HZ       LYS   6  74.024  14.541   4.801
   53   3HZ   LYS   6          3HZ       LYS   6  74.312  13.428   6.052
   54    H    PHE   7           H        PHE   7  71.395   8.184   1.652
   55    HA   PHE   7           HA       PHE   7  68.641   8.994   2.411
   56   1HB   PHE   7          2HB       PHE   7  67.685   6.998   1.331
   57   2HB   PHE   7          1HB       PHE   7  68.517   8.003   0.151
   58    HD1  PHE   7           HD1      PHE   7  68.207   4.691   1.518
   59    HD2  PHE   7           HD2      PHE   7  71.044   7.406  -0.368
   60    HE1  PHE   7           HE1      PHE   7  69.647   2.734   0.862
   61    HE2  PHE   7           HE2      PHE   7  72.485   5.448  -1.015
   62    HZ   PHE   7           HZ       PHE   7  71.786   3.110  -0.395
   63    H    HIS   8           H        HIS   8  67.684   7.455   3.992
   64    HA   HIS   8           HA       HIS   8  69.825   6.141   5.640
   65   1HB   HIS   8          2HB       HIS   8  67.132   7.374   6.325
   66   2HB   HIS   8          1HB       HIS   8  68.225   6.643   7.498
   67    HD1  HIS   8           HD1      HIS   8  67.838   9.645   5.278
   68    HD2  HIS   8           HD2      HIS   8  70.544   8.186   8.093
   69    HE1  HIS   8           HE1      HIS   8  69.418  11.553   5.810
   70    H    THR   9           H        THR   9  69.548   4.003   6.222
   71    HA   THR   9           HA       THR   9  66.921   2.679   5.930
   72    HB   THR   9           HB       THR   9  68.071   2.637   3.687
   73    HG1  THR   9           HG1      THR   9  67.320   0.691   3.375
   74   1HG2  THR   9          1HG2      THR   9  70.101   0.942   5.167
   75   2HG2  THR   9          2HG2      THR   9  70.400   2.531   4.461
   76   3HG2  THR   9          3HG2      THR   9  70.037   1.156   3.417
   77    H    THR  10           H        THR  10  67.003   0.446   6.925
   78    HA   THR  10           HA       THR  10  69.215   0.255   8.931
   79    HB   THR  10           HB       THR  10  66.799   0.665   9.691
   80    HG1  THR  10           HG1      THR  10  68.129  -1.666  10.574
   81   1HG2  THR  10          1HG2      THR  10  65.136  -0.815   9.281
   82   2HG2  THR  10          2HG2      THR  10  66.189  -2.197   9.602
   83   3HG2  THR  10          3HG2      THR  10  66.185  -1.440   8.006
   84    H    VAL  11           H        VAL  11  69.947  -1.940   9.448
   85    HA   VAL  11           HA       VAL  11  70.351  -3.501   7.019
   86    HB   VAL  11           HB       VAL  11  71.129  -3.999   9.915
   87   1HG1  VAL  11          1HG1      VAL  11  71.514  -6.048   8.862
   88   2HG1  VAL  11          2HG1      VAL  11  73.054  -5.229   8.605
   89   3HG1  VAL  11          3HG1      VAL  11  71.864  -5.297   7.305
   90   1HG2  VAL  11          1HG2      VAL  11  73.382  -3.171   8.520
   91   2HG2  VAL  11          2HG2      VAL  11  72.414  -2.155   9.585
   92   3HG2  VAL  11          3HG2      VAL  11  72.111  -2.149   7.847
   93    H    HIS  12           H        HIS  12  69.368  -5.382   6.438
   94    HA   HIS  12           HA       HIS  12  67.445  -6.648   8.358
   95   1HB   HIS  12          2HB       HIS  12  67.391  -6.125   5.405
   96   2HB   HIS  12          1HB       HIS  12  66.534  -7.534   6.037
   97    HD1  HIS  12           HD1      HIS  12  66.842  -3.845   7.021
   98    HD2  HIS  12           HD2      HIS  12  63.967  -6.852   6.754
   99    HE1  HIS  12           HE1      HIS  12  64.648  -2.803   7.737
  100    H    ARG  13           H        ARG  13  67.161  -9.045   7.783
  101    HA   ARG  13           HA       ARG  13  69.401 -10.540   8.384
  102   1HB   ARG  13          2HB       ARG  13  66.986 -11.176   6.680
  103   2HB   ARG  13          1HB       ARG  13  68.094 -12.422   7.262
  104   1HG   ARG  13          2HG       ARG  13  67.681 -11.618   9.600
  105   2HG   ARG  13          1HG       ARG  13  66.475 -10.502   8.962
  106   1HD   ARG  13          2HD       ARG  13  66.387 -13.528   8.660
  107   2HD   ARG  13          1HD       ARG  13  65.384 -12.571   9.767
  108    HE   ARG  13           HE       ARG  13  64.946 -11.334   7.352
  109   1HH1  ARG  13          1HH1      ARG  13  64.760 -14.690   8.365
  110   2HH1  ARG  13          2HH1      ARG  13  63.540 -15.069   7.200
  111   1HH2  ARG  13          1HH2      ARG  13  63.371 -11.884   5.870
  112   2HH2  ARG  13          2HH2      ARG  13  62.763 -13.505   5.806
  113    H    ILE  14           H        ILE  14  70.905 -11.820   7.197
  114    HA   ILE  14           HA       ILE  14  72.466 -12.291   5.506
  115    HB   ILE  14           HB       ILE  14  70.314 -11.226   3.645
  116   1HG1  ILE  14          2HG1      ILE  14  70.806 -14.107   4.437
  117   2HG1  ILE  14          1HG1      ILE  14  69.605 -13.098   5.245
  118   1HG2  ILE  14          1HG2      ILE  14  71.538 -13.131   2.247
  119   2HG2  ILE  14          2HG2      ILE  14  72.881 -12.713   3.312
  120   3HG2  ILE  14          3HG2      ILE  14  72.156 -11.479   2.280
  121   1HD1  ILE  14          1HD1      ILE  14  68.822 -12.587   2.773
  122   2HD1  ILE  14          2HD1      ILE  14  68.302 -14.069   3.580
  123   3HD1  ILE  14          3HD1      ILE  14  69.633 -14.116   2.424
  124    H    GLY  15           H        GLY  15  71.725  -9.214   6.448
  125   1HA   GLY  15          2HA       GLY  15  73.032  -7.263   6.264
  126   2HA   GLY  15          1HA       GLY  15  74.059  -8.110   5.111
  127    H    ARG  16           H        ARG  16  70.687  -8.230   4.365
  128    HA   ARG  16           HA       ARG  16  71.170  -6.689   1.919
  129   1HB   ARG  16          2HB       ARG  16  69.937  -8.838   2.015
  130   2HB   ARG  16          1HB       ARG  16  68.720  -8.087   3.045
  131   1HG   ARG  16          2HG       ARG  16  68.248  -6.443   1.226
  132   2HG   ARG  16          1HG       ARG  16  69.385  -7.308   0.191
  133   1HD   ARG  16          2HD       ARG  16  66.957  -8.603   1.485
  134   2HD   ARG  16          1HD       ARG  16  67.005  -8.020  -0.190
  135    HE   ARG  16           HE       ARG  16  69.269  -9.732   0.367
  136   1HH1  ARG  16          1HH1      ARG  16  65.835  -9.813  -0.354
  137   2HH1  ARG  16          2HH1      ARG  16  65.925 -11.395  -1.044
  138   1HH2  ARG  16          1HH2      ARG  16  69.322 -11.770  -0.534
  139   2HH2  ARG  16          2HH2      ARG  16  67.870 -12.490  -1.146
  140    H    ILE  17           H        ILE  17  70.210  -4.713   1.397
  141    HA   ILE  17           HA       ILE  17  68.310  -3.507   3.358
  142    HB   ILE  17           HB       ILE  17  69.486  -1.341   3.103
  143   1HG1  ILE  17          2HG1      ILE  17  71.635  -2.874   1.611
  144   2HG1  ILE  17          1HG1      ILE  17  70.392  -1.929   0.792
  145   1HG2  ILE  17          1HG2      ILE  17  71.524  -1.920   4.360
  146   2HG2  ILE  17          2HG2      ILE  17  71.340  -3.609   3.887
  147   3HG2  ILE  17          3HG2      ILE  17  70.143  -2.853   4.939
  148   1HD1  ILE  17          1HD1      ILE  17  71.363   0.053   1.340
  149   2HD1  ILE  17          2HD1      ILE  17  72.804  -0.921   1.635
  150   3HD1  ILE  17          3HD1      ILE  17  71.748  -0.484   2.977
  151    H    ILE  18           H        ILE  18  66.807  -1.999   2.326
  152    HA   ILE  18           HA       ILE  18  66.735  -2.232  -0.669
  153    HB   ILE  18           HB       ILE  18  64.444  -1.873   1.292
  154   1HG1  ILE  18          2HG1      ILE  18  65.440  -4.109   1.539
  155   2HG1  ILE  18          1HG1      ILE  18  63.877  -4.230   0.738
  156   1HG2  ILE  18          1HG2      ILE  18  63.206  -2.690  -0.877
  157   2HG2  ILE  18          2HG2      ILE  18  64.653  -2.100  -1.698
  158   3HG2  ILE  18          3HG2      ILE  18  63.676  -0.994  -0.729
  159   1HD1  ILE  18          1HD1      ILE  18  65.470  -3.964  -1.433
  160   2HD1  ILE  18          2HD1      ILE  18  65.073  -5.530  -0.726
  161   3HD1  ILE  18          3HD1      ILE  18  66.603  -4.746  -0.331
  162    H    ILE  19           H        ILE  19  66.906  -0.311  -1.733
  163    HA   ILE  19           HA       ILE  19  66.918   2.236  -0.248
  164    HB   ILE  19           HB       ILE  19  67.133   1.566  -3.219
  165   1HG1  ILE  19          2HG1      ILE  19  69.214   2.011  -1.034
  166   2HG1  ILE  19          1HG1      ILE  19  68.920   0.516  -1.909
  167   1HG2  ILE  19          1HG2      ILE  19  66.450   3.938  -2.604
  168   2HG2  ILE  19          2HG2      ILE  19  67.974   3.822  -3.484
  169   3HG2  ILE  19          3HG2      ILE  19  67.981   4.087  -1.740
  170   1HD1  ILE  19          1HD1      ILE  19  70.468   1.160  -3.407
  171   2HD1  ILE  19          2HD1      ILE  19  70.615   2.735  -2.627
  172   3HD1  ILE  19          3HD1      ILE  19  69.401   2.482  -3.880
  173    HA   PRO  20           HA       PRO  20  62.581   3.109  -0.974
  174   1HB   PRO  20          2HB       PRO  20  62.703   5.845  -1.080
  175   2HB   PRO  20          1HB       PRO  20  62.773   4.943   0.444
  176   1HG   PRO  20          2HG       PRO  20  65.039   5.977  -1.225
  177   2HG   PRO  20          1HG       PRO  20  64.767   6.178   0.517
  178   1HD   PRO  20          2HD       PRO  20  66.448   4.323  -0.321
  179   2HD   PRO  20          1HD       PRO  20  65.289   3.928   0.976
  180    H    ALA  21           H        ALA  21  61.372   3.464  -2.845
  181    HA   ALA  21           HA       ALA  21  62.609   3.331  -5.386
  182   1HB   ALA  21          1HB       ALA  21  59.863   4.401  -4.653
  183   2HB   ALA  21          2HB       ALA  21  60.271   2.692  -4.806
  184   3HB   ALA  21          3HB       ALA  21  60.333   3.745  -6.220
  185    H    GLY  22           H        GLY  22  61.783   6.122  -3.408
  186   1HA   GLY  22          2HA       GLY  22  61.810   8.120  -5.481
  187   2HA   GLY  22          1HA       GLY  22  62.096   8.431  -3.766
  188    H    THR  23           H        THR  23  64.397   6.875  -3.353
  189    HA   THR  23           HA       THR  23  66.453   8.626  -4.396
  190    HB   THR  23           HB       THR  23  66.644   5.914  -3.041
  191    HG1  THR  23           HG1      THR  23  66.587   8.552  -2.002
  192   1HG2  THR  23          1HG2      THR  23  68.638   8.185  -2.998
  193   2HG2  THR  23          2HG2      THR  23  68.715   6.890  -4.192
  194   3HG2  THR  23          3HG2      THR  23  68.879   6.518  -2.475
  195    H    ARG  24           H        ARG  24  65.375   5.331  -5.234
  196    HA   ARG  24           HA       ARG  24  67.403   4.635  -7.140
  197   1HB   ARG  24          2HB       ARG  24  64.453   4.047  -7.502
  198   2HB   ARG  24          1HB       ARG  24  65.819   3.053  -7.986
  199   1HG   ARG  24          2HG       ARG  24  66.304   3.026  -5.380
  200   2HG   ARG  24          1HG       ARG  24  64.586   3.394  -5.287
  201   1HD   ARG  24          2HD       ARG  24  64.433   1.408  -7.069
  202   2HD   ARG  24          1HD       ARG  24  65.933   0.920  -6.246
  203    HE   ARG  24           HE       ARG  24  64.352   1.526  -4.127
  204   1HH1  ARG  24          1HH1      ARG  24  63.692  -0.420  -6.972
  205   2HH1  ARG  24          2HH1      ARG  24  62.557  -1.416  -6.134
  206   1HH2  ARG  24          1HH2      ARG  24  62.901   0.205  -3.103
  207   2HH2  ARG  24          2HH2      ARG  24  62.110  -1.071  -3.968
  208    H    LYS  25           H        LYS  25  64.407   6.495  -7.480
  209    HA   LYS  25           HA       LYS  25  64.491   6.878 -10.318
  210   1HB   LYS  25          2HB       LYS  25  62.520   7.178  -8.834
  211   2HB   LYS  25          1HB       LYS  25  63.295   8.580  -8.100
  212   1HG   LYS  25          2HG       LYS  25  63.330   9.707 -10.293
  213   2HG   LYS  25          1HG       LYS  25  62.535   8.311 -11.020
  214   1HD   LYS  25          2HD       LYS  25  60.635   8.632  -9.415
  215   2HD   LYS  25          1HD       LYS  25  61.411  10.115  -8.860
  216   1HE   LYS  25          2HE       LYS  25  61.432  10.720 -11.435
  217   2HE   LYS  25          1HE       LYS  25  60.105   9.543 -11.504
  218   1HZ   LYS  25          1HZ       LYS  25  59.023  10.697  -9.681
  219   2HZ   LYS  25          2HZ       LYS  25  59.280  11.765 -10.978
  220   3HZ   LYS  25          3HZ       LYS  25  60.286  11.827  -9.609
  221    H    PHE  26           H        PHE  26  65.484   9.038  -7.653
  222    HA   PHE  26           HA       PHE  26  66.488  11.203  -9.202
  223   1HB   PHE  26          2HB       PHE  26  66.078  11.175  -6.750
  224   2HB   PHE  26          1HB       PHE  26  67.458  10.097  -6.543
  225    HD1  PHE  26           HD1      PHE  26  69.685  10.945  -6.371
  226    HD2  PHE  26           HD2      PHE  26  66.473  13.503  -7.827
  227    HE1  PHE  26           HE1      PHE  26  71.233  12.927  -6.305
  228    HE2  PHE  26           HE2      PHE  26  68.020  15.485  -7.760
  229    HZ   PHE  26           HZ       PHE  26  70.400  15.197  -6.999
  230    H    TYR  27           H        TYR  27  68.059   8.201  -8.172
  231    HA   TYR  27           HA       TYR  27  70.678   9.010  -9.242
  232   1HB   TYR  27          2HB       TYR  27  70.240   7.723  -7.136
  233   2HB   TYR  27          1HB       TYR  27  69.667   6.384  -8.115
  234    HD1  TYR  27           HD1      TYR  27  71.344   5.451  -9.963
  235    HD2  TYR  27           HD2      TYR  27  72.517   7.923  -6.578
  236    HE1  TYR  27           HE1      TYR  27  73.698   4.600 -10.159
  237    HE2  TYR  27           HE2      TYR  27  74.875   7.079  -6.787
  238    HH   TYR  27           HH       TYR  27  76.338   6.058  -8.470
  239    H    GLY  28           H        GLY  28  67.878   7.394 -10.531
  240   1HA   GLY  28          2HA       GLY  28  67.533   6.579 -12.708
  241   2HA   GLY  28          1HA       GLY  28  69.197   7.025 -13.085
  242    H    ILE  29           H        ILE  29  68.016   4.806 -10.555
  243    HA   ILE  29           HA       ILE  29  70.005   2.808 -11.416
  244    HB   ILE  29           HB       ILE  29  68.011   2.879  -9.121
  245   1HG1  ILE  29          2HG1      ILE  29  70.980   3.503  -9.181
  246   2HG1  ILE  29          1HG1      ILE  29  69.700   4.710  -9.140
  247   1HG2  ILE  29          1HG2      ILE  29  70.072   0.920 -10.001
  248   2HG2  ILE  29          2HG2      ILE  29  68.591   0.658  -9.080
  249   3HG2  ILE  29          3HG2      ILE  29  70.030   1.283  -8.274
  250   1HD1  ILE  29          1HD1      ILE  29  69.008   3.054  -7.041
  251   2HD1  ILE  29          2HD1      ILE  29  69.885   4.576  -6.885
  252   3HD1  ILE  29          3HD1      ILE  29  70.773   3.050  -6.965
  253    H    GLU  30           H        GLU  30  69.547   1.022 -12.572
  254    HA   GLU  30           HA       GLU  30  66.740  -0.015 -12.614
  255   1HB   GLU  30          2HB       GLU  30  68.707   0.173 -14.925
  256   2HB   GLU  30          1HB       GLU  30  67.124  -0.598 -15.004
  257   1HG   GLU  30          2HG       GLU  30  66.065   1.568 -14.388
  258   2HG   GLU  30          1HG       GLU  30  67.655   2.327 -14.400
  259    H    GLN  31           H        GLN  31  66.709  -2.399 -12.927
  260    HA   GLN  31           HA       GLN  31  68.585  -3.811 -11.336
  261   1HB   GLN  31          2HB       GLN  31  66.263  -4.498 -12.041
  262   2HB   GLN  31          1HB       GLN  31  66.929  -4.906 -13.622
  263   1HG   GLN  31          2HG       GLN  31  68.468  -6.513 -12.579
  264   2HG   GLN  31          1HG       GLN  31  67.841  -6.093 -10.987
  265   1HE2  GLN  31          1HE2      GLN  31  67.629  -8.755 -11.725
  266   2HE2  GLN  31          2HE2      GLN  31  66.018  -9.145 -12.094
  267    H    GLY  32           H        GLY  32  70.482  -4.859 -11.788
  268   1HA   GLY  32          2HA       GLY  32  72.117  -5.941 -13.163
  269   2HA   GLY  32          1HA       GLY  32  71.354  -5.234 -14.585
  270    H    ASP  33           H        ASP  33  71.439  -2.547 -12.855
  271    HA   ASP  33           HA       ASP  33  73.945  -1.583 -14.026
  272   1HB   ASP  33          2HB       ASP  33  71.878  -0.413 -12.139
  273   2HB   ASP  33          1HB       ASP  33  73.228   0.510 -12.797
  274    H    PHE  34           H        PHE  34  75.727  -0.665 -12.720
  275    HA   PHE  34           HA       PHE  34  75.994  -1.969 -10.031
  276   1HB   PHE  34          2HB       PHE  34  77.987  -1.086 -12.137
  277   2HB   PHE  34          1HB       PHE  34  78.465  -1.578 -10.512
  278    HD1  PHE  34           HD1      PHE  34  76.948  -2.715 -13.728
  279    HD2  PHE  34           HD2      PHE  34  78.348  -3.911  -9.779
  280    HE1  PHE  34           HE1      PHE  34  76.841  -5.129 -14.422
  281    HE2  PHE  34           HE2      PHE  34  78.239  -6.327 -10.474
  282    HZ   PHE  34           HZ       PHE  34  77.487  -6.936 -12.795
  283    H    VAL  35           H        VAL  35  76.332  -0.620  -8.292
  284    HA   VAL  35           HA       VAL  35  76.969   2.250  -8.841
  285    HB   VAL  35           HB       VAL  35  75.352   2.847  -7.044
  286   1HG1  VAL  35          1HG1      VAL  35  74.627   2.781  -9.424
  287   2HG1  VAL  35          2HG1      VAL  35  73.308   2.382  -8.324
  288   3HG1  VAL  35          3HG1      VAL  35  74.133   1.102  -9.211
  289   1HG2  VAL  35          1HG2      VAL  35  75.358   0.841  -5.700
  290   2HG2  VAL  35          2HG2      VAL  35  74.828  -0.140  -7.066
  291   3HG2  VAL  35          3HG2      VAL  35  73.725   1.034  -6.344
  292    H    GLU  36           H        GLU  36  78.206   3.241  -7.096
  293    HA   GLU  36           HA       GLU  36  79.542   1.239  -5.299
  294   1HB   GLU  36          2HB       GLU  36  80.910   2.251  -7.142
  295   2HB   GLU  36          1HB       GLU  36  80.574   3.848  -6.473
  296   1HG   GLU  36          2HG       GLU  36  81.610   3.122  -4.319
  297   2HG   GLU  36          1HG       GLU  36  82.035   1.587  -5.077
  298    H    ILE  37           H        ILE  37  79.091   1.584  -3.186
  299    HA   ILE  37           HA       ILE  37  78.173   4.308  -2.360
  300    HB   ILE  37           HB       ILE  37  76.337   2.831  -3.087
  301   1HG1  ILE  37          2HG1      ILE  37  76.193   2.901  -0.082
  302   2HG1  ILE  37          1HG1      ILE  37  76.214   4.399  -1.011
  303   1HG2  ILE  37          1HG2      ILE  37  75.847   0.762  -1.800
  304   2HG2  ILE  37          2HG2      ILE  37  77.360   0.973  -0.919
  305   3HG2  ILE  37          3HG2      ILE  37  77.387   0.663  -2.655
  306   1HD1  ILE  37          1HD1      ILE  37  73.988   4.146  -1.283
  307   2HD1  ILE  37          2HD1      ILE  37  74.032   2.512  -0.627
  308   3HD1  ILE  37          3HD1      ILE  37  74.342   2.781  -2.341
  309    H    LYS  38           H        LYS  38  78.187   4.634  -0.021
  310    HA   LYS  38           HA       LYS  38  79.832   2.685   1.542
  311   1HB   LYS  38          2HB       LYS  38  81.104   4.696   0.667
  312   2HB   LYS  38          1HB       LYS  38  80.049   5.708   1.660
  313   1HG   LYS  38          2HG       LYS  38  80.761   4.541   3.679
  314   2HG   LYS  38          1HG       LYS  38  81.730   3.423   2.720
  315   1HD   LYS  38          2HD       LYS  38  83.161   5.162   3.699
  316   2HD   LYS  38          1HD       LYS  38  83.126   5.323   1.942
  317   1HE   LYS  38          2HE       LYS  38  82.053   7.344   2.031
  318   2HE   LYS  38          1HE       LYS  38  81.037   6.851   3.401
  319   1HZ   LYS  38          1HZ       LYS  38  82.777   8.514   3.989
  320   2HZ   LYS  38          2HZ       LYS  38  83.957   7.354   3.603
  321   3HZ   LYS  38          3HZ       LYS  38  82.873   7.074   4.882
  322    H    ILE  39           H        ILE  39  79.218   2.499   3.732
  323    HA   ILE  39           HA       ILE  39  76.780   4.050   4.559
  324    HB   ILE  39           HB       ILE  39  76.337   2.057   6.012
  325   1HG1  ILE  39          2HG1      ILE  39  78.504   0.657   4.436
  326   2HG1  ILE  39          1HG1      ILE  39  78.835   1.399   6.001
  327   1HG2  ILE  39          1HG2      ILE  39  76.437   1.995   3.048
  328   2HG2  ILE  39          2HG2      ILE  39  75.063   1.809   4.140
  329   3HG2  ILE  39          3HG2      ILE  39  76.153   0.451   3.856
  330   1HD1  ILE  39          1HD1      ILE  39  77.172  -0.993   5.348
  331   2HD1  ILE  39          2HD1      ILE  39  76.653   0.023   6.692
  332   3HD1  ILE  39          3HD1      ILE  39  78.254  -0.714   6.713
  333    H    VAL  40           H        VAL  40  76.741   4.827   6.715
  334    HA   VAL  40           HA       VAL  40  79.229   4.534   8.336
  335    HB   VAL  40           HB       VAL  40  77.823   7.133   7.617
  336   1HG1  VAL  40          1HG1      VAL  40  78.700   7.539   9.743
  337   2HG1  VAL  40          2HG1      VAL  40  80.061   7.992   8.717
  338   3HG1  VAL  40          3HG1      VAL  40  80.044   6.419   9.514
  339   1HG2  VAL  40          1HG2      VAL  40  80.211   5.698   6.538
  340   2HG2  VAL  40          2HG2      VAL  40  80.352   7.445   6.731
  341   3HG2  VAL  40          3HG2      VAL  40  79.079   6.770   5.715
  342    H    LYS  41           H        LYS  41  78.615   3.913  10.337
  343    HA   LYS  41           HA       LYS  41  76.090   5.000  11.516
  344   1HB   LYS  41          2HB       LYS  41  75.850   2.642  10.665
  345   2HB   LYS  41          1HB       LYS  41  77.138   2.163  11.770
  346   1HG   LYS  41          2HG       LYS  41  75.750   3.157  13.648
  347   2HG   LYS  41          1HG       LYS  41  74.428   3.300  12.489
  348   1HD   LYS  41          2HD       LYS  41  74.599   0.853  12.042
  349   2HD   LYS  41          1HD       LYS  41  75.842   0.739  13.288
  350   1HE   LYS  41          2HE       LYS  41  72.979   1.676  13.729
  351   2HE   LYS  41          1HE       LYS  41  73.661   0.120  14.241
  352   1HZ   LYS  41          1HZ       LYS  41  73.861   1.556  16.088
  353   2HZ   LYS  41          2HZ       LYS  41  74.460   2.832  15.139
  354   3HZ   LYS  41          3HZ       LYS  41  75.414   1.454  15.415
  355    H    TYR  42           H        TYR  42  76.280   5.417  13.773
  356    HA   TYR  42           HA       TYR  42  79.092   5.443  14.778
  357   1HB   TYR  42          2HB       TYR  42  77.579   7.497  14.596
  358   2HB   TYR  42          1HB       TYR  42  76.648   6.807  15.928
  359    HD1  TYR  42           HD1      TYR  42  80.145   7.800  14.928
  360    HD2  TYR  42           HD2      TYR  42  77.351   7.099  18.195
  361    HE1  TYR  42           HE1      TYR  42  81.836   8.690  16.561
  362    HE2  TYR  42           HE2      TYR  42  79.040   7.992  19.831
  363    HH   TYR  42           HH       TYR  42  81.443   9.853  19.186
  364    H    GLU  43           H        GLU  43  79.707   4.113  16.436
  365    HA   GLU  43           HA       GLU  43  77.586   2.904  18.176
  366   1HB   GLU  43          2HB       GLU  43  79.982   1.584  16.859
  367   2HB   GLU  43          1HB       GLU  43  78.953   0.800  18.058
  368   1HG   GLU  43          2HG       GLU  43  76.992   1.151  16.585
  369   2HG   GLU  43          1HG       GLU  43  78.043   1.883  15.374
  370    H    GLY  44           H        GLY  44  78.067   3.154  20.327
  371   1HA   GLY  44          2HA       GLY  44  79.257   3.689  22.277
  372   2HA   GLY  44          1HA       GLY  44  80.658   2.958  21.493
  373    H    GLU  45           H        GLU  45  82.310   4.385  21.570
  374    HA   GLU  45           HA       GLU  45  81.742   7.287  21.147
  375   1HB   GLU  45          2HB       GLU  45  83.862   7.639  22.306
  376   2HB   GLU  45          1HB       GLU  45  82.863   6.538  23.246
  377   1HG   GLU  45          2HG       GLU  45  84.119   4.611  22.309
  378   2HG   GLU  45          1HG       GLU  45  85.125   5.727  21.388
  379    H    GLU  46           H        GLU  46  82.422   4.823  19.138
  380    HA   GLU  46           HA       GLU  46  84.312   6.465  17.499
  381   1HB   GLU  46          2HB       GLU  46  85.366   4.311  16.836
  382   2HB   GLU  46          1HB       GLU  46  85.469   4.588  18.573
  383   1HG   GLU  46          2HG       GLU  46  83.464   3.147  18.896
  384   2HG   GLU  46          1HG       GLU  46  83.444   2.823  17.163
  385    HA   PRO  47           HA       PRO  47  81.137   5.670  14.411
  386   1HB   PRO  47          2HB       PRO  47  82.829   6.689  12.311
  387   2HB   PRO  47          1HB       PRO  47  81.459   7.492  13.094
  388   1HG   PRO  47          2HG       PRO  47  84.126   8.220  13.325
  389   2HG   PRO  47          1HG       PRO  47  82.804   8.745  14.374
  390   1HD   PRO  47          2HD       PRO  47  84.917   6.744  14.873
  391   2HD   PRO  47          1HD       PRO  47  83.996   7.741  16.019
  392    H    LYS  48           H        LYS  48  80.801   3.926  13.048
  393    HA   LYS  48           HA       LYS  48  83.181   2.350  12.125
  394   1HB   LYS  48          2HB       LYS  48  80.310   1.509  12.664
  395   2HB   LYS  48          1HB       LYS  48  81.600   0.440  12.115
  396   1HG   LYS  48          2HG       LYS  48  81.741   2.036  14.683
  397   2HG   LYS  48          1HG       LYS  48  81.190   0.362  14.602
  398   1HD   LYS  48          2HD       LYS  48  83.365  -0.235  13.502
  399   2HD   LYS  48          1HD       LYS  48  83.914   1.415  13.799
  400   1HE   LYS  48          2HE       LYS  48  83.996   1.110  16.124
  401   2HE   LYS  48          1HE       LYS  48  82.841  -0.238  16.083
  402   1HZ   LYS  48          1HZ       LYS  48  85.067  -1.098  16.345
  403   2HZ   LYS  48          2HZ       LYS  48  85.601  -0.245  14.976
  404   3HZ   LYS  48          3HZ       LYS  48  84.485  -1.516  14.807
  405    H    GLU  49           H        GLU  49  83.353   2.080   9.899
  406    HA   GLU  49           HA       GLU  49  81.069   3.002   8.189
  407   1HB   GLU  49          2HB       GLU  49  84.010   3.733   8.016
  408   2HB   GLU  49          1HB       GLU  49  82.778   4.230   6.856
  409   1HG   GLU  49          2HG       GLU  49  81.533   5.354   8.695
  410   2HG   GLU  49          1HG       GLU  49  82.826   4.916   9.810
  411    H    GLY  50           H        GLY  50  81.318   2.298   5.901
  412   1HA   GLY  50          2HA       GLY  50  83.279   0.226   5.268
  413   2HA   GLY  50          1HA       GLY  50  81.625  -0.377   5.400
  414    H    THR  51           H        THR  51  83.637   0.239   3.071
  415    HA   THR  51           HA       THR  51  81.577   1.556   1.323
  416    HB   THR  51           HB       THR  51  84.556   1.637   0.833
  417    HG1  THR  51           HG1      THR  51  84.576   3.598   1.970
  418   1HG2  THR  51          1HG2      THR  51  82.902   3.969   0.205
  419   2HG2  THR  51          2HG2      THR  51  82.354   2.508  -0.620
  420   3HG2  THR  51          3HG2      THR  51  84.013   3.070  -0.827
  421    H    PHE  52           H        PHE  52  81.064   0.382  -0.521
  422    HA   PHE  52           HA       PHE  52  82.937  -1.634  -1.569
  423   1HB   PHE  52          2HB       PHE  52  81.558  -3.544  -1.103
  424   2HB   PHE  52          1HB       PHE  52  81.684  -2.647   0.403
  425    HD1  PHE  52           HD1      PHE  52  79.450  -4.185  -1.932
  426    HD2  PHE  52           HD2      PHE  52  79.734  -0.870   0.880
  427    HE1  PHE  52           HE1      PHE  52  76.944  -4.039  -1.855
  428    HE2  PHE  52           HE2      PHE  52  77.222  -0.726   0.959
  429    HZ   PHE  52           HZ       PHE  52  75.829  -2.312  -0.416
  430    H    THR  53           H        THR  53  81.844  -2.818  -3.500
  431    HA   THR  53           HA       THR  53  80.088  -0.901  -4.998
  432    HB   THR  53           HB       THR  53  81.891  -3.143  -5.975
  433    HG1  THR  53           HG1      THR  53  83.406  -1.726  -5.825
  434   1HG2  THR  53          1HG2      THR  53  81.577  -1.772  -8.155
  435   2HG2  THR  53          2HG2      THR  53  80.174  -1.078  -7.341
  436   3HG2  THR  53          3HG2      THR  53  80.252  -2.816  -7.636
  437    H    ALA  54           H        ALA  54  78.105  -1.675  -5.733
  438    HA   ALA  54           HA       ALA  54  77.439  -4.553  -5.286
  439   1HB   ALA  54          1HB       ALA  54  76.874  -2.513  -3.513
  440   2HB   ALA  54          2HB       ALA  54  75.973  -4.024  -3.615
  441   3HB   ALA  54          3HB       ALA  54  75.393  -2.592  -4.466
  442    H    ARG  55           H        ARG  55  75.817  -5.339  -6.670
  443    HA   ARG  55           HA       ARG  55  75.034  -3.573  -8.936
  444   1HB   ARG  55          2HB       ARG  55  76.024  -5.951  -9.118
  445   2HB   ARG  55          1HB       ARG  55  74.450  -6.516  -8.557
  446   1HG   ARG  55          2HG       ARG  55  73.359  -5.319 -10.429
  447   2HG   ARG  55          1HG       ARG  55  74.940  -4.788 -11.002
  448   1HD   ARG  55          2HD       ARG  55  74.468  -6.721 -12.310
  449   2HD   ARG  55          1HD       ARG  55  75.540  -7.326 -11.030
  450    HE   ARG  55           HE       ARG  55  72.689  -7.371 -10.334
  451   1HH1  ARG  55          1HH1      ARG  55  75.352  -9.173 -11.744
  452   2HH1  ARG  55          2HH1      ARG  55  74.611 -10.699 -11.420
  453   1HH2  ARG  55          1HH2      ARG  55  71.783  -9.370  -9.944
  454   2HH2  ARG  55          2HH2      ARG  55  72.618 -10.813 -10.415
  455    H    VAL  56           H        VAL  56  72.852  -3.124  -9.365
  456    HA   VAL  56           HA       VAL  56  71.019  -3.181  -7.092
  457    HB   VAL  56           HB       VAL  56  70.770  -2.320  -9.994
  458   1HG1  VAL  56          1HG1      VAL  56  68.975  -1.024  -8.080
  459   2HG1  VAL  56          2HG1      VAL  56  68.672  -2.757  -8.191
  460   3HG1  VAL  56          3HG1      VAL  56  68.613  -1.755  -9.644
  461   1HG2  VAL  56          1HG2      VAL  56  71.535  -0.253  -9.322
  462   2HG2  VAL  56          2HG2      VAL  56  72.381  -1.246  -8.137
  463   3HG2  VAL  56          3HG2      VAL  56  70.884  -0.428  -7.693
  464    H    GLY  57           H        GLY  57  69.620  -4.784  -6.657
  465   1HA   GLY  57          2HA       GLY  57  69.080  -6.846  -8.740
  466   2HA   GLY  57          1HA       GLY  57  68.891  -7.089  -7.003
  467    H    GLU  58           H        GLU  58  66.737  -7.893  -7.808
  468    HA   GLU  58           HA       GLU  58  64.734  -6.181  -8.916
  469   1HB   GLU  58          2HB       GLU  58  64.772  -8.723  -8.617
  470   2HB   GLU  58          1HB       GLU  58  64.314  -8.440  -6.938
  471   1HG   GLU  58          2HG       GLU  58  62.266  -8.801  -8.115
  472   2HG   GLU  58          1HG       GLU  58  62.365  -7.064  -7.841
  473    H    GLN  59           H        GLN  59  63.016  -5.049  -7.844
  474    HA   GLN  59           HA       GLN  59  62.136  -3.564  -6.243
  475   1HB   GLN  59          2HB       GLN  59  63.229  -5.811  -4.528
  476   2HB   GLN  59          1HB       GLN  59  62.179  -4.535  -3.910
  477   1HG   GLN  59          2HG       GLN  59  60.413  -5.167  -5.453
  478   2HG   GLN  59          1HG       GLN  59  61.464  -6.346  -6.231
  479   1HE2  GLN  59          1HE2      GLN  59  59.759  -7.974  -5.601
  480   2HE2  GLN  59          2HE2      GLN  59  59.770  -8.599  -4.024
  481    H    GLY  60           H        GLY  60  65.213  -3.431  -6.952
  482   1HA   GLY  60          2HA       GLY  60  66.789  -1.763  -6.463
  483   2HA   GLY  60          1HA       GLY  60  65.611  -1.086  -5.344
  484    H    SER  61           H        SER  61  66.527  -4.400  -4.838
  485    HA   SER  61           HA       SER  61  67.547  -3.745  -2.186
  486   1HB   SER  61          2HB       SER  61  67.550  -6.132  -1.920
  487   2HB   SER  61          1HB       SER  61  66.162  -5.760  -2.938
  488    HG   SER  61           HG       SER  61  67.307  -7.422  -3.889
  489    H    VAL  62           H        VAL  62  69.685  -3.972  -1.459
  490    HA   VAL  62           HA       VAL  62  71.788  -4.756  -3.416
  491    HB   VAL  62           HB       VAL  62  71.567  -2.299  -3.467
  492   1HG1  VAL  62          1HG1      VAL  62  72.092  -2.485  -0.486
  493   2HG1  VAL  62          2HG1      VAL  62  70.589  -1.961  -1.245
  494   3HG1  VAL  62          3HG1      VAL  62  72.049  -0.987  -1.415
  495   1HG2  VAL  62          1HG2      VAL  62  73.847  -3.554  -3.451
  496   2HG2  VAL  62          2HG2      VAL  62  74.028  -2.884  -1.830
  497   3HG2  VAL  62          3HG2      VAL  62  73.855  -1.806  -3.216
  498    H    ILE  63           H        ILE  63  73.566  -5.795  -2.397
  499    HA   ILE  63           HA       ILE  63  73.075  -6.532   0.462
  500    HB   ILE  63           HB       ILE  63  74.661  -7.914  -1.731
  501   1HG1  ILE  63          2HG1      ILE  63  72.267  -7.818  -2.309
  502   2HG1  ILE  63          1HG1      ILE  63  72.726  -9.461  -1.875
  503   1HG2  ILE  63          1HG2      ILE  63  74.258  -9.901  -0.136
  504   2HG2  ILE  63          2HG2      ILE  63  73.862  -8.682   1.075
  505   3HG2  ILE  63          3HG2      ILE  63  75.466  -8.710   0.342
  506   1HD1  ILE  63          1HD1      ILE  63  71.816  -9.128   0.392
  507   2HD1  ILE  63          2HD1      ILE  63  70.579  -8.818  -0.826
  508   3HD1  ILE  63          3HD1      ILE  63  71.380  -7.469  -0.021
  509    H    ILE  64           H        ILE  64  74.488  -5.733   1.943
  510    HA   ILE  64           HA       ILE  64  77.108  -4.591   1.196
  511    HB   ILE  64           HB       ILE  64  75.751  -5.161   3.860
  512   1HG1  ILE  64          2HG1      ILE  64  76.070  -2.484   2.496
  513   2HG1  ILE  64          1HG1      ILE  64  74.673  -3.513   2.180
  514   1HG2  ILE  64          1HG2      ILE  64  77.388  -3.639   4.823
  515   2HG2  ILE  64          2HG2      ILE  64  78.091  -3.335   3.235
  516   3HG2  ILE  64          3HG2      ILE  64  78.244  -4.928   3.976
  517   1HD1  ILE  64          1HD1      ILE  64  73.918  -3.384   4.408
  518   2HD1  ILE  64          2HD1      ILE  64  74.480  -1.746   4.075
  519   3HD1  ILE  64          3HD1      ILE  64  75.491  -2.852   5.005
  520    HA   PRO  65           HA       PRO  65  79.252  -8.477   1.552
  521   1HB   PRO  65          2HB       PRO  65  81.733  -7.609   2.303
  522   2HB   PRO  65          1HB       PRO  65  81.109  -7.406   0.650
  523   1HG   PRO  65          2HG       PRO  65  81.056  -5.455   2.926
  524   2HG   PRO  65          1HG       PRO  65  81.628  -5.205   1.264
  525   1HD   PRO  65          2HD       PRO  65  79.208  -4.388   1.954
  526   2HD   PRO  65          1HD       PRO  65  79.448  -5.209   0.390
  527    H    LYS  66           H        LYS  66  79.336  -9.951   3.216
  528    HA   LYS  66           HA       LYS  66  78.564  -9.389   5.877
  529   1HB   LYS  66          2HB       LYS  66  78.541 -11.595   4.706
  530   2HB   LYS  66          1HB       LYS  66  80.298 -11.661   4.852
  531   1HG   LYS  66          2HG       LYS  66  80.130 -11.601   7.292
  532   2HG   LYS  66          1HG       LYS  66  78.377 -11.439   7.189
  533   1HD   LYS  66          2HD       LYS  66  78.866 -13.762   7.624
  534   2HD   LYS  66          1HD       LYS  66  78.331 -13.637   5.947
  535   1HE   LYS  66          2HE       LYS  66  80.511 -13.935   5.097
  536   2HE   LYS  66          1HE       LYS  66  81.269 -13.491   6.640
  537   1HZ   LYS  66          1HZ       LYS  66  80.182 -15.448   7.641
  538   2HZ   LYS  66          2HZ       LYS  66  81.293 -15.871   6.427
  539   3HZ   LYS  66          3HZ       LYS  66  79.624 -15.908   6.107
  540    H    ALA  67           H        ALA  67  81.788  -9.501   4.438
  541    HA   ALA  67           HA       ALA  67  83.389  -9.548   6.789
  542   1HB   ALA  67          1HB       ALA  67  84.252  -7.850   4.502
  543   2HB   ALA  67          2HB       ALA  67  83.805  -9.510   4.110
  544   3HB   ALA  67          3HB       ALA  67  85.087  -9.196   5.279
  545    H    LEU  68           H        LEU  68  81.854  -6.827   5.100
  546    HA   LEU  68           HA       LEU  68  83.011  -4.796   6.855
  547   1HB   LEU  68          2HB       LEU  68  80.783  -4.822   4.800
  548   2HB   LEU  68          1HB       LEU  68  81.300  -3.361   5.640
  549    HG   LEU  68           HG       LEU  68  83.075  -5.127   3.918
  550   1HD1  LEU  68          1HD1      LEU  68  82.816  -3.591   2.209
  551   2HD1  LEU  68          2HD1      LEU  68  82.470  -2.261   3.316
  552   3HD1  LEU  68          3HD1      LEU  68  81.225  -3.457   2.956
  553   1HD2  LEU  68          1HD2      LEU  68  84.448  -4.140   5.616
  554   2HD2  LEU  68          2HD2      LEU  68  83.591  -2.602   5.512
  555   3HD2  LEU  68          3HD2      LEU  68  84.643  -3.116   4.194
  556    H    ARG  69           H        ARG  69  79.985  -6.663   6.760
  557    HA   ARG  69           HA       ARG  69  78.430  -5.175   8.638
  558   1HB   ARG  69          2HB       ARG  69  78.672  -8.191   8.329
  559   2HB   ARG  69          1HB       ARG  69  77.304  -7.335   9.022
  560   1HG   ARG  69          2HG       ARG  69  77.010  -6.194   6.775
  561   2HG   ARG  69          1HG       ARG  69  78.212  -7.319   6.137
  562   1HD   ARG  69          2HD       ARG  69  76.663  -9.117   7.364
  563   2HD   ARG  69          1HD       ARG  69  75.429  -7.877   7.085
  564    HE   ARG  69           HE       ARG  69  76.650  -7.986   4.647
  565   1HH1  ARG  69          1HH1      ARG  69  75.408 -10.519   6.742
  566   2HH1  ARG  69          2HH1      ARG  69  75.090 -11.581   5.419
  567   1HH2  ARG  69          1HH2      ARG  69  76.205  -9.404   2.986
  568   2HH2  ARG  69          2HH2      ARG  69  75.531 -10.962   3.322
  569    H    ASP  70           H        ASP  70  80.761  -7.814   9.145
  570    HA   ASP  70           HA       ASP  70  80.454  -7.943  12.002
  571   1HB   ASP  70          2HB       ASP  70  82.685  -8.813  10.136
  572   2HB   ASP  70          1HB       ASP  70  82.528  -9.334  11.814
  573    H    VAL  71           H        VAL  71  82.987  -6.450   9.956
  574    HA   VAL  71           HA       VAL  71  84.638  -5.468  12.067
  575    HB   VAL  71           HB       VAL  71  84.072  -4.434   9.263
  576   1HG1  VAL  71          1HG1      VAL  71  86.282  -3.350   9.410
  577   2HG1  VAL  71          2HG1      VAL  71  86.433  -3.877  11.086
  578   3HG1  VAL  71          3HG1      VAL  71  85.184  -2.714  10.635
  579   1HG2  VAL  71          1HG2      VAL  71  86.449  -6.051  10.164
  580   2HG2  VAL  71          2HG2      VAL  71  85.798  -5.859   8.537
  581   3HG2  VAL  71          3HG2      VAL  71  84.939  -6.846   9.719
  582    H    ILE  72           H        ILE  72  81.823  -4.034  10.464
  583    HA   ILE  72           HA       ILE  72  82.062  -1.489  11.875
  584    HB   ILE  72           HB       ILE  72  79.872  -2.704  10.150
  585   1HG1  ILE  72          2HG1      ILE  72  82.084  -0.752   9.428
  586   2HG1  ILE  72          1HG1      ILE  72  82.134  -2.479   9.076
  587   1HG2  ILE  72          1HG2      ILE  72  80.372   0.240  10.569
  588   2HG2  ILE  72          2HG2      ILE  72  79.359  -0.654  11.699
  589   3HG2  ILE  72          3HG2      ILE  72  78.910  -0.561   9.998
  590   1HD1  ILE  72          1HD1      ILE  72  81.273  -1.614   7.086
  591   2HD1  ILE  72          2HD1      ILE  72  80.344  -0.365   7.916
  592   3HD1  ILE  72          3HD1      ILE  72  79.800  -2.045   7.958
  593    H    GLY  73           H        GLY  73  80.540  -4.552  12.587
  594   1HA   GLY  73          2HA       GLY  73  79.472  -5.203  14.579
  595   2HA   GLY  73          1HA       GLY  73  79.713  -3.562  15.183
  596    H    ILE  74           H        ILE  74  78.030  -4.389  12.184
  597    HA   ILE  74           HA       ILE  74  75.736  -2.771  13.098
  598    HB   ILE  74           HB       ILE  74  76.355  -4.118  10.448
  599   1HG1  ILE  74          2HG1      ILE  74  78.123  -2.521  11.083
  600   2HG1  ILE  74          1HG1      ILE  74  77.167  -1.878   9.750
  601   1HG2  ILE  74          1HG2      ILE  74  74.078  -3.572  10.369
  602   2HG2  ILE  74          2HG2      ILE  74  74.839  -2.138   9.681
  603   3HG2  ILE  74          3HG2      ILE  74  74.290  -2.127  11.357
  604   1HD1  ILE  74          1HD1      ILE  74  77.135  -1.061  12.655
  605   2HD1  ILE  74          2HD1      ILE  74  75.767  -0.707  11.600
  606   3HD1  ILE  74          3HD1      ILE  74  77.360  -0.048  11.230
  607    H    LYS  75           H        LYS  75  73.693  -3.563  13.504
  608    HA   LYS  75           HA       LYS  75  73.282  -6.527  13.294
  609   1HB   LYS  75          2HB       LYS  75  72.277  -4.576  15.397
  610   2HB   LYS  75          1HB       LYS  75  72.080  -6.326  15.427
  611   1HG   LYS  75          2HG       LYS  75  74.732  -4.849  15.523
  612   2HG   LYS  75          1HG       LYS  75  73.937  -5.619  16.895
  613   1HD   LYS  75          2HD       LYS  75  73.972  -7.760  15.401
  614   2HD   LYS  75          1HD       LYS  75  75.215  -6.899  14.493
  615   1HE   LYS  75          2HE       LYS  75  76.657  -6.763  16.400
  616   2HE   LYS  75          1HE       LYS  75  75.358  -7.266  17.501
  617   1HZ   LYS  75          1HZ       LYS  75  75.262  -9.391  16.478
  618   2HZ   LYS  75          2HZ       LYS  75  76.898  -9.095  16.825
  619   3HZ   LYS  75          3HZ       LYS  75  76.320  -8.926  15.237
  620    HA   PRO  76           HA       PRO  76  69.512  -5.807  11.107
  621   1HB   PRO  76          2HB       PRO  76  67.718  -7.429  12.497
  622   2HB   PRO  76          1HB       PRO  76  68.802  -7.979  11.206
  623   1HG   PRO  76          2HG       PRO  76  69.088  -8.223  14.145
  624   2HG   PRO  76          1HG       PRO  76  69.598  -9.329  12.862
  625   1HD   PRO  76          2HD       PRO  76  71.332  -7.744  14.201
  626   2HD   PRO  76          1HD       PRO  76  71.573  -8.215  12.503
  627    H    GLY  77           H        GLY  77  67.957  -4.218  11.236
  628   1HA   GLY  77          2HA       GLY  77  66.168  -2.992  12.230
  629   2HA   GLY  77          1HA       GLY  77  66.605  -3.668  13.796
  630    H    GLU  78           H        GLU  78  69.479  -2.586  12.492
  631    HA   GLU  78           HA       GLU  78  69.318  -0.065  14.063
  632   1HB   GLU  78          2HB       GLU  78  71.403  -2.019  13.228
  633   2HB   GLU  78          1HB       GLU  78  71.915  -0.343  13.427
  634   1HG   GLU  78          2HG       GLU  78  70.843  -0.338  15.692
  635   2HG   GLU  78          1HG       GLU  78  70.508  -2.058  15.493
  636    H    VAL  79           H        VAL  79  69.431   1.907  13.086
  637    HA   VAL  79           HA       VAL  79  69.289   1.958  10.145
  638    HB   VAL  79           HB       VAL  79  67.645   3.086  11.601
  639   1HG1  VAL  79          1HG1      VAL  79  69.322   5.347  12.377
  640   2HG1  VAL  79          2HG1      VAL  79  69.897   3.843  13.092
  641   3HG1  VAL  79          3HG1      VAL  79  68.236   4.367  13.362
  642   1HG2  VAL  79          1HG2      VAL  79  67.586   5.194  10.416
  643   2HG2  VAL  79          2HG2      VAL  79  68.229   3.976   9.315
  644   3HG2  VAL  79          3HG2      VAL  79  69.320   5.119  10.099
  645    H    ILE  80           H        ILE  80  70.844   2.714   8.829
  646    HA   ILE  80           HA       ILE  80  73.160   4.230   9.974
  647    HB   ILE  80           HB       ILE  80  74.532   3.040   8.266
  648   1HG1  ILE  80          2HG1      ILE  80  71.993   1.477   7.701
  649   2HG1  ILE  80          1HG1      ILE  80  72.663   2.718   6.642
  650   1HG2  ILE  80          1HG2      ILE  80  73.925   2.093  10.628
  651   2HG2  ILE  80          2HG2      ILE  80  74.704   1.027   9.458
  652   3HG2  ILE  80          3HG2      ILE  80  72.964   0.922   9.724
  653   1HD1  ILE  80          1HD1      ILE  80  74.446   1.404   5.996
  654   2HD1  ILE  80          2HD1      ILE  80  73.266   0.134   6.314
  655   3HD1  ILE  80          3HD1      ILE  80  74.488   0.524   7.523
  656    H    GLU  81           H        GLU  81  74.096   5.757   8.400
  657    HA   GLU  81           HA       GLU  81  72.099   6.832   6.458
  658   1HB   GLU  81          2HB       GLU  81  73.096   8.269   8.265
  659   2HB   GLU  81          1HB       GLU  81  74.685   7.993   7.552
  660   1HG   GLU  81          2HG       GLU  81  73.870   8.972   5.415
  661   2HG   GLU  81          1HG       GLU  81  72.322   9.315   6.189
  662    H    VAL  82           H        VAL  82  72.489   6.576   4.314
  663    HA   VAL  82           HA       VAL  82  75.039   5.240   3.530
  664    HB   VAL  82           HB       VAL  82  72.212   5.150   2.416
  665   1HG1  VAL  82          1HG1      VAL  82  73.735   4.702   0.615
  666   2HG1  VAL  82          2HG1      VAL  82  73.141   3.137   1.174
  667   3HG1  VAL  82          3HG1      VAL  82  74.750   3.689   1.642
  668   1HG2  VAL  82          1HG2      VAL  82  73.792   3.469   4.331
  669   2HG2  VAL  82          2HG2      VAL  82  72.628   2.673   3.271
  670   3HG2  VAL  82          3HG2      VAL  82  72.089   3.925   4.390
  671    H    LEU  83           H        LEU  83  76.305   6.223   2.060
  672    HA   LEU  83           HA       LEU  83  75.228   8.537   0.477
  673   1HB   LEU  83          2HB       LEU  83  78.107   7.918   1.247
  674   2HB   LEU  83          1HB       LEU  83  77.488   9.430   0.600
  675    HG   LEU  83           HG       LEU  83  76.786   8.254   3.309
  676   1HD1  LEU  83          1HD1      LEU  83  78.154  10.010   4.233
  677   2HD1  LEU  83          2HD1      LEU  83  78.398  10.730   2.640
  678   3HD1  LEU  83          3HD1      LEU  83  79.123   9.166   3.023
  679   1HD2  LEU  83          1HD2      LEU  83  75.548  10.291   3.680
  680   2HD2  LEU  83          2HD2      LEU  83  74.998   9.603   2.152
  681   3HD2  LEU  83          3HD2      LEU  83  76.110  10.972   2.153
  682    H    LEU  84           H        LEU  84  75.290   8.224  -1.754
  683    HA   LEU  84           HA       LEU  84  76.612   5.846  -2.910
  684   1HB   LEU  84          2HB       LEU  84  74.836   8.078  -3.827
  685   2HB   LEU  84          1HB       LEU  84  75.788   7.204  -5.033
  686    HG   LEU  84           HG       LEU  84  74.313   5.584  -3.007
  687   1HD1  LEU  84          1HD1      LEU  84  72.989   7.521  -4.695
  688   2HD1  LEU  84          2HD1      LEU  84  72.278   6.381  -3.559
  689   3HD1  LEU  84          3HD1      LEU  84  72.564   5.896  -5.227
  690   1HD2  LEU  84          1HD2      LEU  84  75.368   5.361  -5.790
  691   2HD2  LEU  84          2HD2      LEU  84  73.954   4.388  -5.385
  692   3HD2  LEU  84          3HD2      LEU  84  75.446   4.201  -4.463
  693    H    LEU  85           H        LEU  85  78.554   5.910  -4.026
  694    HA   LEU  85           HA       LEU  85  80.098   8.455  -3.833
  695   1HB   LEU  85          2HB       LEU  85  80.647   5.533  -3.602
  696   2HB   LEU  85          1HB       LEU  85  81.951   6.551  -4.222
  697    HG   LEU  85           HG       LEU  85  80.429   7.271  -1.715
  698   1HD1  LEU  85          1HD1      LEU  85  82.311   6.240  -0.454
  699   2HD1  LEU  85          2HD1      LEU  85  82.942   5.590  -1.968
  700   3HD1  LEU  85          3HD1      LEU  85  81.381   5.043  -1.356
  701   1HD2  LEU  85          1HD2      LEU  85  81.710   9.088  -2.629
  702   2HD2  LEU  85          2HD2      LEU  85  83.093   8.038  -2.939
  703   3HD2  LEU  85          3HD2      LEU  85  82.650   8.446  -1.282
  704    H    GLY  86           H        GLY  86  79.193   5.847  -6.078
  705   1HA   GLY  86          2HA       GLY  86  79.666   7.562  -8.396
  706   2HA   GLY  86          1HA       GLY  86  80.925   6.347  -8.214
  707    H    HIS  87           H        HIS  87  79.837   5.886 -10.456
  708    HA   HIS  87           HA       HIS  87  77.845   3.691 -10.062
  709   1HB   HIS  87          2HB       HIS  87  76.521   4.655 -11.942
  710   2HB   HIS  87          1HB       HIS  87  76.622   5.764 -10.581
  711    HD1  HIS  87           HD1      HIS  87  77.851   5.274 -14.096
  712    HD2  HIS  87           HD2      HIS  87  78.146   8.119 -11.063
  713    HE1  HIS  87           HE1      HIS  87  78.865   7.341 -15.150
  714    H    TYR  88           H        TYR  88  77.833   2.145 -11.848
  715    HA   TYR  88           HA       TYR  88  79.938   2.478 -13.929
  716   1HB   TYR  88          2HB       TYR  88  79.620   0.169 -11.988
  717   2HB   TYR  88          1HB       TYR  88  80.655   0.110 -13.415
  718    HD1  TYR  88           HD1      TYR  88  80.269   1.389  -9.987
  719    HD2  TYR  88           HD2      TYR  88  82.618   1.691 -13.642
  720    HE1  TYR  88           HE1      TYR  88  82.100   2.556  -8.716
  721    HE2  TYR  88           HE2      TYR  88  84.448   2.856 -12.372
  722    HH   TYR  88           HH       TYR  88  85.226   2.952  -9.911
  723    H    LYS  89           H        LYS  89  79.414   1.398 -15.872
  724    HA   LYS  89           HA       LYS  89  76.689   0.146 -15.978
  725   1HB   LYS  89          2HB       LYS  89  78.365   1.609 -18.044
  726   2HB   LYS  89          1HB       LYS  89  76.780   0.905 -18.363
  727   1HG   LYS  89          2HG       LYS  89  76.027   2.335 -16.297
  728   2HG   LYS  89          1HG       LYS  89  77.487   3.264 -16.640
  729   1HD   LYS  89          2HD       LYS  89  75.354   2.644 -18.703
  730   2HD   LYS  89          1HD       LYS  89  75.436   4.153 -17.793
  731   1HE   LYS  89          2HE       LYS  89  77.952   3.303 -19.145
  732   2HE   LYS  89          1HE       LYS  89  76.637   3.871 -20.194
  733   1HZ   LYS  89          1HZ       LYS  89  78.089   5.677 -19.289
  734   2HZ   LYS  89          2HZ       LYS  89  77.504   5.298 -17.739
  735   3HZ   LYS  89          3HZ       LYS  89  76.440   5.859 -18.939
  736    HA   PRO  90           HA       PRO  90  78.331  -3.766 -17.248
  737   1HB   PRO  90          2HB       PRO  90  76.580  -3.522 -19.676
  738   2HB   PRO  90          1HB       PRO  90  76.714  -4.864 -18.518
  739   1HG   PRO  90          2HG       PRO  90  74.640  -3.292 -18.363
  740   2HG   PRO  90          1HG       PRO  90  75.504  -3.720 -16.873
  741   1HD   PRO  90          2HD       PRO  90  75.652  -1.180 -18.464
  742   2HD   PRO  90          1HD       PRO  90  75.522  -1.399 -16.700
  743    H    ARG  91           H        ARG  91  80.089  -4.444 -18.493
  744    HA   ARG  91           HA       ARG  91  80.803  -2.820 -20.912
  745   1HB   ARG  91          2HB       ARG  91  82.060  -2.199 -18.835
  746   2HB   ARG  91          1HB       ARG  91  82.651  -3.858 -18.739
  747   1HG   ARG  91          2HG       ARG  91  83.671  -3.606 -20.989
  748   2HG   ARG  91          1HG       ARG  91  83.125  -1.929 -21.032
  749   1HD   ARG  91          2HD       ARG  91  84.451  -1.485 -18.951
  750   2HD   ARG  91          1HD       ARG  91  85.087  -3.139 -19.051
  751    HE   ARG  91           HE       ARG  91  85.566  -2.200 -21.576
  752   1HH1  ARG  91          1HH1      ARG  91  86.267  -0.854 -18.410
  753   2HH1  ARG  91          2HH1      ARG  91  87.654   0.003 -18.981
  754   1HH2  ARG  91          1HH2      ARG  91  87.368  -1.073 -22.252
  755   2HH2  ARG  91          2HH2      ARG  91  88.272  -0.118 -21.125
  756    H    ASN  92           H        ASN  92  81.615  -4.027 -22.634
  757    HA   ASN  92           HA       ASN  92  81.944  -6.981 -22.207
  758   1HB   ASN  92          2HB       ASN  92  80.683  -5.434 -24.496
  759   2HB   ASN  92          1HB       ASN  92  80.925  -7.180 -24.488
  760   1HD2  ASN  92          1HD2      ASN  92  78.304  -5.907 -24.611
  761   2HD2  ASN  92          2HD2      ASN  92  77.468  -6.333 -23.196
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  82.580  13.033   1.106
    2   2H    MET   1          2H        MET   1  82.654  14.727   1.004
    3   3H    MET   1          3H        MET   1  84.057  13.831   1.343
    4    HA   MET   1           HA       MET   1  84.213  14.452  -0.930
    5   1HB   MET   1          2HB       MET   1  83.337  11.623  -0.324
    6   2HB   MET   1          1HB       MET   1  83.962  12.081  -1.910
    7   1HG   MET   1          2HG       MET   1  86.008  12.973  -0.797
    8   2HG   MET   1          1HG       MET   1  85.398  12.368   0.744
    9   1HE   MET   1          1HE       MET   1  84.801   9.988   1.240
   10   2HE   MET   1          2HE       MET   1  85.152   8.578   0.243
   11   3HE   MET   1          3HE       MET   1  83.888   9.703  -0.247
   12    H    ASP   2           H        ASP   2  83.097  13.423  -3.138
   13    HA   ASP   2           HA       ASP   2  80.566  14.855  -3.409
   14   1HB   ASP   2          2HB       ASP   2  82.138  12.999  -5.230
   15   2HB   ASP   2          1HB       ASP   2  80.757  13.965  -5.748
   16    H    VAL   3           H        VAL   3  78.497  13.957  -3.563
   17    HA   VAL   3           HA       VAL   3  78.260  10.997  -3.304
   18    HB   VAL   3           HB       VAL   3  77.935  12.475  -1.205
   19   1HG1  VAL   3          1HG1      VAL   3  76.498  14.187  -2.413
   20   2HG1  VAL   3          2HG1      VAL   3  75.835  13.590  -0.891
   21   3HG1  VAL   3          3HG1      VAL   3  75.214  12.973  -2.427
   22   1HG2  VAL   3          1HG2      VAL   3  77.250  10.170  -1.195
   23   2HG2  VAL   3          2HG2      VAL   3  75.820  10.536  -2.159
   24   3HG2  VAL   3          3HG2      VAL   3  75.930  11.110  -0.495
   25    H    LEU   4           H        LEU   4  76.800  10.101  -4.730
   26    HA   LEU   4           HA       LEU   4  75.508  11.855  -6.715
   27   1HB   LEU   4          2HB       LEU   4  75.400   8.839  -6.389
   28   2HB   LEU   4          1HB       LEU   4  75.052   9.752  -7.852
   29    HG   LEU   4           HG       LEU   4  77.749   9.438  -6.487
   30   1HD1  LEU   4          1HD1      LEU   4  76.509   8.446  -9.042
   31   2HD1  LEU   4          2HD1      LEU   4  77.384   7.538  -7.809
   32   3HD1  LEU   4          3HD1      LEU   4  78.259   8.611  -8.902
   33   1HD2  LEU   4          1HD2      LEU   4  77.894  11.649  -7.262
   34   2HD2  LEU   4          2HD2      LEU   4  76.821  11.342  -8.632
   35   3HD2  LEU   4          3HD2      LEU   4  78.477  10.736  -8.658
   36    H    ALA   5           H        ALA   5  74.632  10.227  -3.763
   37    HA   ALA   5           HA       ALA   5  72.065  11.499  -3.638
   38   1HB   ALA   5          1HB       ALA   5  71.632   8.566  -3.784
   39   2HB   ALA   5          2HB       ALA   5  72.047   9.334  -5.316
   40   3HB   ALA   5          3HB       ALA   5  70.634   9.877  -4.411
   41    H    LYS   6           H        LYS   6  71.104  11.127  -1.531
   42    HA   LYS   6           HA       LYS   6  72.695   9.385   0.319
   43   1HB   LYS   6          2HB       LYS   6  73.463  11.729   0.403
   44   2HB   LYS   6          1HB       LYS   6  71.813  12.262   0.725
   45   1HG   LYS   6          2HG       LYS   6  71.786  11.290   2.872
   46   2HG   LYS   6          1HG       LYS   6  73.155  10.239   2.512
   47   1HD   LYS   6          2HD       LYS   6  73.891  12.065   3.963
   48   2HD   LYS   6          1HD       LYS   6  74.623  12.247   2.369
   49   1HE   LYS   6          2HE       LYS   6  73.403  14.140   1.875
   50   2HE   LYS   6          1HE       LYS   6  71.997  13.605   2.817
   51   1HZ   LYS   6          1HZ       LYS   6  74.609  14.458   3.954
   52   2HZ   LYS   6          2HZ       LYS   6  73.255  13.950   4.846
   53   3HZ   LYS   6          3HZ       LYS   6  73.194  15.393   3.952
   54    H    PHE   7           H        PHE   7  71.382   8.094   1.514
   55    HA   PHE   7           HA       PHE   7  68.647   9.000   2.253
   56   1HB   PHE   7          2HB       PHE   7  67.667   6.987   1.207
   57   2HB   PHE   7          1HB       PHE   7  68.513   7.967   0.013
   58    HD1  PHE   7           HD1      PHE   7  68.200   4.683   1.480
   59    HD2  PHE   7           HD2      PHE   7  71.009   7.339  -0.531
   60    HE1  PHE   7           HE1      PHE   7  69.633   2.708   0.866
   61    HE2  PHE   7           HE2      PHE   7  72.441   5.362  -1.137
   62    HZ   PHE   7           HZ       PHE   7  71.752   3.044  -0.434
   63    H    HIS   8           H        HIS   8  67.637   7.466   3.842
   64    HA   HIS   8           HA       HIS   8  69.756   6.178   5.539
   65   1HB   HIS   8          2HB       HIS   8  67.072   7.456   6.167
   66   2HB   HIS   8          1HB       HIS   8  68.136   6.728   7.371
   67    HD1  HIS   8           HD1      HIS   8  67.776   9.723   5.158
   68    HD2  HIS   8           HD2      HIS   8  70.533   8.210   7.892
   69    HE1  HIS   8           HE1      HIS   8  69.403  11.601   5.647
   70    H    THR   9           H        THR   9  69.488   4.054   6.134
   71    HA   THR   9           HA       THR   9  66.858   2.725   5.912
   72    HB   THR   9           HB       THR   9  67.958   2.656   3.641
   73    HG1  THR   9           HG1      THR   9  66.549   0.998   4.391
   74   1HG2  THR   9          1HG2      THR   9  70.017   0.972   5.096
   75   2HG2  THR   9          2HG2      THR   9  70.304   2.552   4.362
   76   3HG2  THR   9          3HG2      THR   9  69.913   1.164   3.345
   77    H    THR  10           H        THR  10  66.968   0.502   6.938
   78    HA   THR  10           HA       THR  10  69.229   0.340   8.894
   79    HB   THR  10           HB       THR  10  66.825   0.711   9.707
   80    HG1  THR  10           HG1      THR  10  67.568  -0.144  11.437
   81   1HG2  THR  10          1HG2      THR  10  66.208  -1.401   8.027
   82   2HG2  THR  10          2HG2      THR  10  65.173  -0.788   9.319
   83   3HG2  THR  10          3HG2      THR  10  66.249  -2.156   9.623
   84    H    VAL  11           H        VAL  11  70.009  -1.839   9.391
   85    HA   VAL  11           HA       VAL  11  70.373  -3.406   6.956
   86    HB   VAL  11           HB       VAL  11  71.243  -3.868   9.831
   87   1HG1  VAL  11          1HG1      VAL  11  73.007  -5.274   8.809
   88   2HG1  VAL  11          2HG1      VAL  11  72.295  -5.003   7.218
   89   3HG1  VAL  11          3HG1      VAL  11  71.399  -5.900   8.443
   90   1HG2  VAL  11          1HG2      VAL  11  72.115  -1.995   7.747
   91   2HG2  VAL  11          2HG2      VAL  11  73.433  -3.013   8.322
   92   3HG2  VAL  11          3HG2      VAL  11  72.519  -2.030   9.463
   93    H    HIS  12           H        HIS  12  69.446  -5.344   6.435
   94    HA   HIS  12           HA       HIS  12  67.550  -6.587   8.398
   95   1HB   HIS  12          2HB       HIS  12  67.454  -6.106   5.438
   96   2HB   HIS  12          1HB       HIS  12  66.615  -7.512   6.098
   97    HD1  HIS  12           HD1      HIS  12  66.905  -3.807   7.027
   98    HD2  HIS  12           HD2      HIS  12  64.051  -6.839   6.835
   99    HE1  HIS  12           HE1      HIS  12  64.709  -2.771   7.745
  100    H    ARG  13           H        ARG  13  67.263  -8.992   7.863
  101    HA   ARG  13           HA       ARG  13  69.509 -10.477   8.461
  102   1HB   ARG  13          2HB       ARG  13  67.078 -11.139   6.789
  103   2HB   ARG  13          1HB       ARG  13  68.196 -12.376   7.377
  104   1HG   ARG  13          2HG       ARG  13  67.801 -11.555   9.707
  105   2HG   ARG  13          1HG       ARG  13  66.597 -10.433   9.072
  106   1HD   ARG  13          2HD       ARG  13  65.371 -12.415   8.094
  107   2HD   ARG  13          1HD       ARG  13  66.497 -13.466   8.975
  108    HE   ARG  13           HE       ARG  13  64.382 -11.836  10.173
  109   1HH1  ARG  13          1HH1      ARG  13  67.473 -13.405  10.719
  110   2HH1  ARG  13          2HH1      ARG  13  67.232 -13.488  12.429
  111   1HH2  ARG  13          1HH2      ARG  13  64.128 -11.971  12.385
  112   2HH2  ARG  13          2HH2      ARG  13  65.365 -12.688  13.362
  113    H    ILE  14           H        ILE  14  71.000 -11.774   7.282
  114    HA   ILE  14           HA       ILE  14  72.545 -12.277   5.586
  115    HB   ILE  14           HB       ILE  14  70.381 -11.240   3.725
  116   1HG1  ILE  14          2HG1      ILE  14  70.870 -14.107   4.568
  117   2HG1  ILE  14          1HG1      ILE  14  69.675 -13.079   5.361
  118   1HG2  ILE  14          1HG2      ILE  14  72.946 -12.728   3.397
  119   2HG2  ILE  14          2HG2      ILE  14  72.200 -11.528   2.342
  120   3HG2  ILE  14          3HG2      ILE  14  71.594 -13.184   2.360
  121   1HD1  ILE  14          1HD1      ILE  14  69.656 -14.233   2.612
  122   2HD1  ILE  14          2HD1      ILE  14  68.963 -12.623   2.817
  123   3HD1  ILE  14          3HD1      ILE  14  68.319 -13.985   3.736
  124    H    GLY  15           H        GLY  15  71.811  -9.182   6.475
  125   1HA   GLY  15          2HA       GLY  15  73.118  -7.239   6.249
  126   2HA   GLY  15          1HA       GLY  15  74.141  -8.110   5.112
  127    H    ARG  16           H        ARG  16  70.766  -8.236   4.367
  128    HA   ARG  16           HA       ARG  16  71.238  -6.682   1.921
  129   1HB   ARG  16          2HB       ARG  16  70.019  -8.838   1.973
  130   2HB   ARG  16          1HB       ARG  16  68.811  -8.127   3.042
  131   1HG   ARG  16          2HG       ARG  16  68.163  -6.527   1.318
  132   2HG   ARG  16          1HG       ARG  16  69.441  -7.111   0.254
  133   1HD   ARG  16          2HD       ARG  16  67.377  -8.173  -0.450
  134   2HD   ARG  16          1HD       ARG  16  68.338  -9.411   0.384
  135    HE   ARG  16           HE       ARG  16  66.913  -8.309   2.447
  136   1HH1  ARG  16          1HH1      ARG  16  65.926  -9.528  -0.693
  137   2HH1  ARG  16          2HH1      ARG  16  64.361  -9.990  -0.124
  138   1HH2  ARG  16          1HH2      ARG  16  64.879  -8.927   3.123
  139   2HH2  ARG  16          2HH2      ARG  16  63.773  -9.655   2.007
  140    H    ILE  17           H        ILE  17  70.256  -4.711   1.428
  141    HA   ILE  17           HA       ILE  17  68.369  -3.539   3.420
  142    HB   ILE  17           HB       ILE  17  69.524  -1.360   3.162
  143   1HG1  ILE  17          2HG1      ILE  17  71.658  -2.876   1.632
  144   2HG1  ILE  17          1HG1      ILE  17  70.406  -1.921   0.840
  145   1HG2  ILE  17          1HG2      ILE  17  71.451  -1.867   4.503
  146   2HG2  ILE  17          2HG2      ILE  17  71.537  -3.509   3.863
  147   3HG2  ILE  17          3HG2      ILE  17  70.208  -3.045   4.926
  148   1HD1  ILE  17          1HD1      ILE  17  71.807  -0.512   3.026
  149   2HD1  ILE  17          2HD1      ILE  17  71.377   0.058   1.412
  150   3HD1  ILE  17          3HD1      ILE  17  72.827  -0.920   1.646
  151    H    ILE  18           H        ILE  18  66.842  -2.035   2.412
  152    HA   ILE  18           HA       ILE  18  66.728  -2.274  -0.582
  153    HB   ILE  18           HB       ILE  18  64.470  -1.872   1.411
  154   1HG1  ILE  18          2HG1      ILE  18  65.441  -4.117   1.668
  155   2HG1  ILE  18          1HG1      ILE  18  63.866  -4.227   0.887
  156   1HG2  ILE  18          1HG2      ILE  18  64.642  -2.107  -1.578
  157   2HG2  ILE  18          2HG2      ILE  18  63.666  -1.011  -0.595
  158   3HG2  ILE  18          3HG2      ILE  18  63.206  -2.709  -0.746
  159   1HD1  ILE  18          1HD1      ILE  18  66.568  -4.801  -0.206
  160   2HD1  ILE  18          2HD1      ILE  18  65.445  -3.995  -1.303
  161   3HD1  ILE  18          3HD1      ILE  18  65.017  -5.549  -0.588
  162    H    ILE  19           H        ILE  19  66.912  -0.360  -1.657
  163    HA   ILE  19           HA       ILE  19  66.977   2.193  -0.183
  164    HB   ILE  19           HB       ILE  19  67.118   1.521  -3.158
  165   1HG1  ILE  19          2HG1      ILE  19  69.250   1.906  -1.013
  166   2HG1  ILE  19          1HG1      ILE  19  68.921   0.434  -1.913
  167   1HG2  ILE  19          1HG2      ILE  19  66.488   3.908  -2.476
  168   2HG2  ILE  19          2HG2      ILE  19  67.946   3.763  -3.456
  169   3HG2  ILE  19          3HG2      ILE  19  68.077   4.020  -1.717
  170   1HD1  ILE  19          1HD1      ILE  19  70.446   1.088  -3.433
  171   2HD1  ILE  19          2HD1      ILE  19  70.640   2.638  -2.613
  172   3HD1  ILE  19          3HD1      ILE  19  69.395   2.443  -3.848
  173    HA   PRO  20           HA       PRO  20  62.635   3.107  -0.827
  174   1HB   PRO  20          2HB       PRO  20  62.784   5.841  -0.907
  175   2HB   PRO  20          1HB       PRO  20  62.870   4.925   0.607
  176   1HG   PRO  20          2HG       PRO  20  65.119   5.953  -1.090
  177   2HG   PRO  20          1HG       PRO  20  64.877   6.139   0.659
  178   1HD   PRO  20          2HD       PRO  20  66.526   4.277  -0.226
  179   2HD   PRO  20          1HD       PRO  20  65.386   3.881   1.088
  180    H    ALA  21           H        ALA  21  61.407   3.485  -2.680
  181    HA   ALA  21           HA       ALA  21  62.603   3.370  -5.241
  182   1HB   ALA  21          1HB       ALA  21  60.373   3.551  -6.027
  183   2HB   ALA  21          2HB       ALA  21  59.901   4.606  -4.693
  184   3HB   ALA  21          3HB       ALA  21  60.193   2.891  -4.401
  185    H    GLY  22           H        GLY  22  61.845   6.145  -3.217
  186   1HA   GLY  22          2HA       GLY  22  61.858   8.167  -5.255
  187   2HA   GLY  22          1HA       GLY  22  62.188   8.450  -3.546
  188    H    THR  23           H        THR  23  64.467   6.888  -3.185
  189    HA   THR  23           HA       THR  23  66.522   8.618  -4.255
  190    HB   THR  23           HB       THR  23  66.711   5.893  -2.927
  191    HG1  THR  23           HG1      THR  23  66.784   7.067  -1.036
  192   1HG2  THR  23          1HG2      THR  23  68.730   7.236  -4.131
  193   2HG2  THR  23          2HG2      THR  23  68.958   6.255  -2.684
  194   3HG2  THR  23          3HG2      THR  23  68.765   8.001  -2.542
  195    H    ARG  24           H        ARG  24  65.365   5.363  -5.121
  196    HA   ARG  24           HA       ARG  24  67.385   4.609  -6.993
  197   1HB   ARG  24          2HB       ARG  24  64.414   4.121  -7.346
  198   2HB   ARG  24          1HB       ARG  24  65.738   3.098  -7.885
  199   1HG   ARG  24          2HG       ARG  24  66.290   3.030  -5.286
  200   2HG   ARG  24          1HG       ARG  24  64.577   3.411  -5.155
  201   1HD   ARG  24          2HD       ARG  24  64.371   1.453  -6.961
  202   2HD   ARG  24          1HD       ARG  24  65.882   0.940  -6.177
  203    HE   ARG  24           HE       ARG  24  64.338   1.536  -4.021
  204   1HH1  ARG  24          1HH1      ARG  24  63.645  -0.389  -6.872
  205   2HH1  ARG  24          2HH1      ARG  24  62.522  -1.394  -6.028
  206   1HH2  ARG  24          1HH2      ARG  24  62.901   0.207  -2.988
  207   2HH2  ARG  24          2HH2      ARG  24  62.101  -1.063  -3.853
  208    H    LYS  25           H        LYS  25  64.446   6.570  -7.415
  209    HA   LYS  25           HA       LYS  25  64.647   6.912 -10.259
  210   1HB   LYS  25          2HB       LYS  25  62.614   7.302  -8.923
  211   2HB   LYS  25          1HB       LYS  25  63.403   8.633  -8.081
  212   1HG   LYS  25          2HG       LYS  25  61.942   9.506  -9.851
  213   2HG   LYS  25          1HG       LYS  25  63.629   9.840 -10.243
  214   1HD   LYS  25          2HD       LYS  25  63.707   7.921 -11.732
  215   2HD   LYS  25          1HD       LYS  25  62.058   7.475 -11.293
  216   1HE   LYS  25          2HE       LYS  25  61.157   9.468 -12.324
  217   2HE   LYS  25          1HE       LYS  25  62.784  10.138 -12.564
  218   1HZ   LYS  25          1HZ       LYS  25  63.336   8.270 -13.967
  219   2HZ   LYS  25          2HZ       LYS  25  61.945   9.035 -14.573
  220   3HZ   LYS  25          3HZ       LYS  25  61.809   7.575 -13.713
  221    H    PHE  26           H        PHE  26  65.602   9.062  -7.597
  222    HA   PHE  26           HA       PHE  26  66.684  11.203  -9.103
  223   1HB   PHE  26          2HB       PHE  26  66.226  11.156  -6.657
  224   2HB   PHE  26          1HB       PHE  26  67.602  10.076  -6.435
  225    HD1  PHE  26           HD1      PHE  26  69.837  10.916  -6.261
  226    HD2  PHE  26           HD2      PHE  26  66.626  13.496  -7.679
  227    HE1  PHE  26           HE1      PHE  26  71.385  12.898  -6.162
  228    HE2  PHE  26           HE2      PHE  26  68.173  15.478  -7.578
  229    HZ   PHE  26           HZ       PHE  26  70.552  15.178  -6.820
  230    H    TYR  27           H        TYR  27  68.212   8.181  -8.060
  231    HA   TYR  27           HA       TYR  27  70.849   8.964  -9.120
  232   1HB   TYR  27          2HB       TYR  27  70.438   7.684  -7.022
  233   2HB   TYR  27          1HB       TYR  27  69.786   6.365  -7.977
  234    HD1  TYR  27           HD1      TYR  27  72.770   7.875  -6.606
  235    HD2  TYR  27           HD2      TYR  27  71.342   5.287  -9.800
  236    HE1  TYR  27           HE1      TYR  27  75.087   6.941  -6.893
  237    HE2  TYR  27           HE2      TYR  27  73.654   4.351 -10.081
  238    HH   TYR  27           HH       TYR  27  76.148   4.875  -7.777
  239    H    GLY  28           H        GLY  28  68.028   7.386 -10.407
  240   1HA   GLY  28          2HA       GLY  28  67.672   6.575 -12.585
  241   2HA   GLY  28          1HA       GLY  28  69.351   6.968 -12.956
  242    H    ILE  29           H        ILE  29  68.076   4.808 -10.414
  243    HA   ILE  29           HA       ILE  29  70.020   2.746 -11.211
  244    HB   ILE  29           HB       ILE  29  67.932   2.878  -9.003
  245   1HG1  ILE  29          2HG1      ILE  29  70.920   3.402  -8.948
  246   2HG1  ILE  29          1HG1      ILE  29  69.677   4.646  -8.926
  247   1HG2  ILE  29          1HG2      ILE  29  68.417   0.644  -8.922
  248   2HG2  ILE  29          2HG2      ILE  29  69.872   1.200  -8.096
  249   3HG2  ILE  29          3HG2      ILE  29  69.921   0.832  -9.820
  250   1HD1  ILE  29          1HD1      ILE  29  70.659   2.964  -6.741
  251   2HD1  ILE  29          2HD1      ILE  29  68.898   2.943  -6.872
  252   3HD1  ILE  29          3HD1      ILE  29  69.749   4.476  -6.672
  253    H    GLU  30           H        GLU  30  69.552   1.066 -12.495
  254    HA   GLU  30           HA       GLU  30  66.742   0.038 -12.605
  255   1HB   GLU  30          2HB       GLU  30  67.410   1.316 -14.670
  256   2HB   GLU  30          1HB       GLU  30  68.730   0.169 -14.901
  257   1HG   GLU  30          2HG       GLU  30  67.062  -1.685 -14.967
  258   2HG   GLU  30          1HG       GLU  30  65.771  -0.494 -14.845
  259    H    GLN  31           H        GLN  31  66.679  -2.317 -12.865
  260    HA   GLN  31           HA       GLN  31  68.544  -3.772 -11.330
  261   1HB   GLN  31          2HB       GLN  31  66.642  -4.595 -13.541
  262   2HB   GLN  31          1HB       GLN  31  67.471  -5.756 -12.503
  263   1HG   GLN  31          2HG       GLN  31  66.447  -4.784 -10.518
  264   2HG   GLN  31          1HG       GLN  31  65.698  -3.515 -11.488
  265   1HE2  GLN  31          1HE2      GLN  31  63.838  -4.856 -10.125
  266   2HE2  GLN  31          2HE2      GLN  31  63.036  -6.021 -11.063
  267    H    GLY  32           H        GLY  32  70.466  -4.800 -11.776
  268   1HA   GLY  32          2HA       GLY  32  72.086  -5.895 -13.164
  269   2HA   GLY  32          1HA       GLY  32  71.319  -5.184 -14.581
  270    H    ASP  33           H        ASP  33  71.410  -2.505 -12.836
  271    HA   ASP  33           HA       ASP  33  73.920  -1.535 -13.995
  272   1HB   ASP  33          2HB       ASP  33  71.852  -0.379 -12.100
  273   2HB   ASP  33          1HB       ASP  33  73.208   0.546 -12.742
  274    H    PHE  34           H        PHE  34  75.708  -0.657 -12.682
  275    HA   PHE  34           HA       PHE  34  75.944  -1.970  -9.995
  276   1HB   PHE  34          2HB       PHE  34  77.953  -1.153 -12.110
  277   2HB   PHE  34          1HB       PHE  34  78.428  -1.629 -10.478
  278    HD1  PHE  34           HD1      PHE  34  76.937  -2.782 -13.691
  279    HD2  PHE  34           HD2      PHE  34  78.201  -3.951  -9.688
  280    HE1  PHE  34           HE1      PHE  34  76.777  -5.205 -14.347
  281    HE2  PHE  34           HE2      PHE  34  78.039  -6.374 -10.345
  282    HZ   PHE  34           HZ       PHE  34  77.326  -7.001 -12.674
  283    H    VAL  35           H        VAL  35  76.316  -0.624  -8.257
  284    HA   VAL  35           HA       VAL  35  77.017   2.228  -8.814
  285    HB   VAL  35           HB       VAL  35  75.414   2.869  -7.021
  286   1HG1  VAL  35          1HG1      VAL  35  74.074   1.130  -9.116
  287   2HG1  VAL  35          2HG1      VAL  35  74.740   2.728  -9.454
  288   3HG1  VAL  35          3HG1      VAL  35  73.400   2.553  -8.322
  289   1HG2  VAL  35          1HG2      VAL  35  75.366   0.870  -5.670
  290   2HG2  VAL  35          2HG2      VAL  35  74.824  -0.107  -7.035
  291   3HG2  VAL  35          3HG2      VAL  35  73.741   1.093  -6.324
  292    H    GLU  36           H        GLU  36  78.285   3.197  -7.093
  293    HA   GLU  36           HA       GLU  36  79.578   1.183  -5.279
  294   1HB   GLU  36          2HB       GLU  36  80.950   2.179  -7.141
  295   2HB   GLU  36          1HB       GLU  36  80.664   3.774  -6.444
  296   1HG   GLU  36          2HG       GLU  36  81.701   2.990  -4.314
  297   2HG   GLU  36          1HG       GLU  36  82.063   1.450  -5.086
  298    H    ILE  37           H        ILE  37  79.109   1.538  -3.176
  299    HA   ILE  37           HA       ILE  37  78.227   4.279  -2.361
  300    HB   ILE  37           HB       ILE  37  76.387   2.810  -3.102
  301   1HG1  ILE  37          2HG1      ILE  37  76.158   2.855  -0.111
  302   2HG1  ILE  37          1HG1      ILE  37  76.300   4.376  -0.989
  303   1HG2  ILE  37          1HG2      ILE  37  77.381   0.959  -0.915
  304   2HG2  ILE  37          2HG2      ILE  37  77.405   0.636  -2.649
  305   3HG2  ILE  37          3HG2      ILE  37  75.866   0.757  -1.795
  306   1HD1  ILE  37          1HD1      ILE  37  74.084   4.260  -1.391
  307   2HD1  ILE  37          2HD1      ILE  37  73.999   2.625  -0.741
  308   3HD1  ILE  37          3HD1      ILE  37  74.402   2.878  -2.438
  309    H    LYS  38           H        LYS  38  78.230   4.619  -0.017
  310    HA   LYS  38           HA       LYS  38  79.843   2.655   1.561
  311   1HB   LYS  38          2HB       LYS  38  81.128   4.663   0.659
  312   2HB   LYS  38          1HB       LYS  38  80.113   5.670   1.700
  313   1HG   LYS  38          2HG       LYS  38  80.844   4.402   3.669
  314   2HG   LYS  38          1HG       LYS  38  81.831   3.360   2.645
  315   1HD   LYS  38          2HD       LYS  38  83.118   5.374   1.910
  316   2HD   LYS  38          1HD       LYS  38  82.178   6.349   3.039
  317   1HE   LYS  38          2HE       LYS  38  83.027   4.321   4.683
  318   2HE   LYS  38          1HE       LYS  38  84.410   4.493   3.585
  319   1HZ   LYS  38          1HZ       LYS  38  84.635   6.085   5.348
  320   2HZ   LYS  38          2HZ       LYS  38  83.059   6.667   5.094
  321   3HZ   LYS  38          3HZ       LYS  38  84.261   6.920   3.920
  322    H    ILE  39           H        ILE  39  79.227   2.487   3.744
  323    HA   ILE  39           HA       ILE  39  76.789   4.048   4.555
  324    HB   ILE  39           HB       ILE  39  76.327   2.051   5.996
  325   1HG1  ILE  39          2HG1      ILE  39  78.536   0.681   4.447
  326   2HG1  ILE  39          1HG1      ILE  39  78.806   1.381   6.043
  327   1HG2  ILE  39          1HG2      ILE  39  75.071   1.783   4.121
  328   2HG2  ILE  39          2HG2      ILE  39  76.192   0.456   3.812
  329   3HG2  ILE  39          3HG2      ILE  39  76.442   2.020   3.037
  330   1HD1  ILE  39          1HD1      ILE  39  76.648  -0.015   6.667
  331   2HD1  ILE  39          2HD1      ILE  39  78.233  -0.786   6.629
  332   3HD1  ILE  39          3HD1      ILE  39  77.127  -0.975   5.268
  333    H    VAL  40           H        VAL  40  76.716   4.819   6.716
  334    HA   VAL  40           HA       VAL  40  79.164   4.481   8.390
  335    HB   VAL  40           HB       VAL  40  77.787   7.108   7.718
  336   1HG1  VAL  40          1HG1      VAL  40  79.143   8.146   9.263
  337   2HG1  VAL  40          2HG1      VAL  40  80.445   6.975   9.064
  338   3HG1  VAL  40          3HG1      VAL  40  79.038   6.569  10.044
  339   1HG2  VAL  40          1HG2      VAL  40  80.284   7.474   6.850
  340   2HG2  VAL  40          2HG2      VAL  40  79.064   6.728   5.817
  341   3HG2  VAL  40          3HG2      VAL  40  80.229   5.719   6.675
  342    H    LYS  41           H        LYS  41  78.519   3.869  10.392
  343    HA   LYS  41           HA       LYS  41  75.961   4.947  11.509
  344   1HB   LYS  41          2HB       LYS  41  75.829   2.541  10.678
  345   2HB   LYS  41          1HB       LYS  41  77.014   2.136  11.918
  346   1HG   LYS  41          2HG       LYS  41  75.488   3.077  13.645
  347   2HG   LYS  41          1HG       LYS  41  74.286   3.373  12.389
  348   1HD   LYS  41          2HD       LYS  41  73.664   1.285  13.331
  349   2HD   LYS  41          1HD       LYS  41  74.501   0.866  11.837
  350   1HE   LYS  41          2HE       LYS  41  75.505  -0.576  13.418
  351   2HE   LYS  41          1HE       LYS  41  76.639   0.789  13.372
  352   1HZ   LYS  41          1HZ       LYS  41  74.351   0.538  15.253
  353   2HZ   LYS  41          2HZ       LYS  41  75.492   1.797  15.221
  354   3HZ   LYS  41          3HZ       LYS  41  75.969   0.225  15.655
  355    H    TYR  42           H        TYR  42  76.154   5.533  13.693
  356    HA   TYR  42           HA       TYR  42  78.927   5.433  14.810
  357   1HB   TYR  42          2HB       TYR  42  77.675   7.598  14.360
  358   2HB   TYR  42          1HB       TYR  42  76.562   7.133  15.648
  359    HD1  TYR  42           HD1      TYR  42  80.166   7.853  14.875
  360    HD2  TYR  42           HD2      TYR  42  77.143   7.393  17.976
  361    HE1  TYR  42           HE1      TYR  42  81.789   8.727  16.583
  362    HE2  TYR  42           HE2      TYR  42  78.766   8.269  19.687
  363    HH   TYR  42           HH       TYR  42  81.528   9.933  18.942
  364    H    GLU  43           H        GLU  43  79.327   4.194  16.608
  365    HA   GLU  43           HA       GLU  43  77.027   3.463  18.378
  366   1HB   GLU  43          2HB       GLU  43  77.943   1.152  18.450
  367   2HB   GLU  43          1HB       GLU  43  77.479   1.615  16.814
  368   1HG   GLU  43          2HG       GLU  43  79.849   2.210  16.337
  369   2HG   GLU  43          1HG       GLU  43  80.291   1.655  17.953
  370    H    GLY  44           H        GLY  44  77.516   3.810  20.504
  371   1HA   GLY  44          2HA       GLY  44  78.744   4.349  22.427
  372   2HA   GLY  44          1HA       GLY  44  80.044   3.368  21.751
  373    H    GLU  45           H        GLU  45  81.871   4.571  21.736
  374    HA   GLU  45           HA       GLU  45  81.692   7.471  21.046
  375   1HB   GLU  45          2HB       GLU  45  83.829   7.645  22.220
  376   2HB   GLU  45          1HB       GLU  45  82.674   6.781  23.228
  377   1HG   GLU  45          2HG       GLU  45  83.667   4.629  22.541
  378   2HG   GLU  45          1HG       GLU  45  84.807   5.481  21.500
  379    H    GLU  46           H        GLU  46  82.025   4.826  19.236
  380    HA   GLU  46           HA       GLU  46  84.207   6.011  17.569
  381   1HB   GLU  46          2HB       GLU  46  84.948   3.701  17.107
  382   2HB   GLU  46          1HB       GLU  46  84.974   4.042  18.835
  383   1HG   GLU  46          2HG       GLU  46  82.655   2.982  18.953
  384   2HG   GLU  46          1HG       GLU  46  82.920   2.433  17.299
  385    HA   PRO  47           HA       PRO  47  80.966   5.519  14.447
  386   1HB   PRO  47          2HB       PRO  47  82.792   6.590  12.468
  387   2HB   PRO  47          1HB       PRO  47  81.364   7.363  13.174
  388   1HG   PRO  47          2HG       PRO  47  83.960   8.150  13.611
  389   2HG   PRO  47          1HG       PRO  47  82.590   8.528  14.663
  390   1HD   PRO  47          2HD       PRO  47  84.734   6.505  15.014
  391   2HD   PRO  47          1HD       PRO  47  83.846   7.446  16.232
  392    H    LYS  48           H        LYS  48  80.648   3.781  13.070
  393    HA   LYS  48           HA       LYS  48  83.045   2.232  12.146
  394   1HB   LYS  48          2HB       LYS  48  80.168   1.382  12.627
  395   2HB   LYS  48          1HB       LYS  48  81.460   0.323  12.064
  396   1HG   LYS  48          2HG       LYS  48  81.536   1.847  14.682
  397   2HG   LYS  48          1HG       LYS  48  81.057   0.155  14.531
  398   1HD   LYS  48          2HD       LYS  48  83.285  -0.284  13.424
  399   2HD   LYS  48          1HD       LYS  48  83.752   1.360  13.859
  400   1HE   LYS  48          2HE       LYS  48  83.114   0.727  16.278
  401   2HE   LYS  48          1HE       LYS  48  83.136  -0.954  15.707
  402   1HZ   LYS  48          1HZ       LYS  48  85.356  -0.514  14.762
  403   2HZ   LYS  48          2HZ       LYS  48  85.328  -0.364  16.454
  404   3HZ   LYS  48          3HZ       LYS  48  85.342   1.025  15.476
  405    H    GLU  49           H        GLU  49  83.259   1.993   9.923
  406    HA   GLU  49           HA       GLU  49  81.013   2.948   8.181
  407   1HB   GLU  49          2HB       GLU  49  83.961   3.667   8.074
  408   2HB   GLU  49          1HB       GLU  49  82.754   4.185   6.897
  409   1HG   GLU  49          2HG       GLU  49  81.480   5.295   8.724
  410   2HG   GLU  49          1HG       GLU  49  82.745   4.832   9.860
  411    H    GLY  50           H        GLY  50  81.295   2.258   5.893
  412   1HA   GLY  50          2HA       GLY  50  83.230   0.147   5.288
  413   2HA   GLY  50          1HA       GLY  50  81.563  -0.418   5.408
  414    H    THR  51           H        THR  51  83.609   0.124   3.095
  415    HA   THR  51           HA       THR  51  81.602   1.482   1.315
  416    HB   THR  51           HB       THR  51  84.586   1.399   0.839
  417    HG1  THR  51           HG1      THR  51  84.802   3.239   2.003
  418   1HG2  THR  51          1HG2      THR  51  82.865   3.704   0.107
  419   2HG2  THR  51          2HG2      THR  51  82.555   2.201  -0.760
  420   3HG2  THR  51          3HG2      THR  51  84.160   2.931  -0.806
  421    H    PHE  52           H        PHE  52  81.039   0.288  -0.511
  422    HA   PHE  52           HA       PHE  52  82.839  -1.804  -1.524
  423   1HB   PHE  52          2HB       PHE  52  81.417  -3.670  -1.034
  424   2HB   PHE  52          1HB       PHE  52  81.539  -2.751   0.460
  425    HD1  PHE  52           HD1      PHE  52  79.313  -4.233  -1.939
  426    HD2  PHE  52           HD2      PHE  52  79.617  -0.976   0.936
  427    HE1  PHE  52           HE1      PHE  52  76.810  -4.039  -1.901
  428    HE2  PHE  52           HE2      PHE  52  77.106  -0.782   0.975
  429    HZ   PHE  52           HZ       PHE  52  75.705  -2.314  -0.452
  430    H    THR  53           H        THR  53  81.733  -2.957  -3.457
  431    HA   THR  53           HA       THR  53  80.028  -1.003  -4.965
  432    HB   THR  53           HB       THR  53  81.811  -3.263  -5.937
  433    HG1  THR  53           HG1      THR  53  83.353  -1.855  -5.912
  434   1HG2  THR  53          1HG2      THR  53  80.259  -1.087  -7.355
  435   2HG2  THR  53          2HG2      THR  53  80.080  -2.832  -7.546
  436   3HG2  THR  53          3HG2      THR  53  81.535  -2.025  -8.131
  437    H    ALA  54           H        ALA  54  78.045  -1.750  -5.743
  438    HA   ALA  54           HA       ALA  54  77.331  -4.617  -5.293
  439   1HB   ALA  54          1HB       ALA  54  76.764  -2.554  -3.547
  440   2HB   ALA  54          2HB       ALA  54  75.848  -4.057  -3.651
  441   3HB   ALA  54          3HB       ALA  54  75.299  -2.625  -4.523
  442    H    ARG  55           H        ARG  55  75.731  -5.397  -6.700
  443    HA   ARG  55           HA       ARG  55  74.960  -3.628  -8.971
  444   1HB   ARG  55          2HB       ARG  55  75.954  -6.007  -9.157
  445   2HB   ARG  55          1HB       ARG  55  74.376  -6.572  -8.606
  446   1HG   ARG  55          2HG       ARG  55  73.295  -5.365 -10.477
  447   2HG   ARG  55          1HG       ARG  55  74.880  -4.835 -11.040
  448   1HD   ARG  55          2HD       ARG  55  74.399  -6.763 -12.358
  449   2HD   ARG  55          1HD       ARG  55  75.477  -7.369 -11.085
  450    HE   ARG  55           HE       ARG  55  72.630  -7.422 -10.376
  451   1HH1  ARG  55          1HH1      ARG  55  75.289  -9.214 -11.806
  452   2HH1  ARG  55          2HH1      ARG  55  74.551 -10.742 -11.485
  453   1HH2  ARG  55          1HH2      ARG  55  71.726  -9.425  -9.994
  454   2HH2  ARG  55          2HH2      ARG  55  72.561 -10.864 -10.475
  455    H    VAL  56           H        VAL  56  72.782  -3.170  -9.387
  456    HA   VAL  56           HA       VAL  56  70.965  -3.229  -7.102
  457    HB   VAL  56           HB       VAL  56  70.702  -2.338  -9.994
  458   1HG1  VAL  56          1HG1      VAL  56  68.609  -2.771  -8.203
  459   2HG1  VAL  56          2HG1      VAL  56  68.563  -1.712  -9.613
  460   3HG1  VAL  56          3HG1      VAL  56  68.949  -1.051  -8.024
  461   1HG2  VAL  56          1HG2      VAL  56  71.493  -0.282  -9.308
  462   2HG2  VAL  56          2HG2      VAL  56  72.350  -1.304  -8.154
  463   3HG2  VAL  56          3HG2      VAL  56  70.871  -0.476  -7.669
  464    H    GLY  57           H        GLY  57  69.548  -4.817  -6.668
  465   1HA   GLY  57          2HA       GLY  57  68.931  -6.830  -8.781
  466   2HA   GLY  57          1HA       GLY  57  68.798  -7.119  -7.046
  467    H    GLU  58           H        GLU  58  66.620  -7.878  -7.766
  468    HA   GLU  58           HA       GLU  58  64.600  -6.157  -8.813
  469   1HB   GLU  58          2HB       GLU  58  64.551  -8.658  -8.603
  470   2HB   GLU  58          1HB       GLU  58  64.327  -8.469  -6.863
  471   1HG   GLU  58          2HG       GLU  58  62.260  -7.156  -7.300
  472   2HG   GLU  58          1HG       GLU  58  62.465  -7.437  -9.024
  473    H    GLN  59           H        GLN  59  62.916  -5.011  -7.713
  474    HA   GLN  59           HA       GLN  59  62.085  -3.511  -6.104
  475   1HB   GLN  59          2HB       GLN  59  63.105  -5.862  -4.509
  476   2HB   GLN  59          1HB       GLN  59  62.284  -4.509  -3.730
  477   1HG   GLN  59          2HG       GLN  59  60.321  -4.840  -5.153
  478   2HG   GLN  59          1HG       GLN  59  61.139  -6.143  -6.013
  479   1HE2  GLN  59          1HE2      GLN  59  61.151  -8.225  -5.047
  480   2HE2  GLN  59          2HE2      GLN  59  60.433  -8.563  -3.548
  481    H    GLY  60           H        GLY  60  65.145  -3.400  -6.858
  482   1HA   GLY  60          2HA       GLY  60  66.737  -1.740  -6.383
  483   2HA   GLY  60          1HA       GLY  60  65.590  -1.078  -5.222
  484    H    SER  61           H        SER  61  66.501  -4.403  -4.803
  485    HA   SER  61           HA       SER  61  67.542  -3.814  -2.150
  486   1HB   SER  61          2HB       SER  61  67.581  -6.404  -3.731
  487   2HB   SER  61          1HB       SER  61  67.629  -6.235  -1.978
  488    HG   SER  61           HG       SER  61  65.513  -6.442  -3.521
  489    H    VAL  62           H        VAL  62  69.680  -3.998  -1.438
  490    HA   VAL  62           HA       VAL  62  71.786  -4.764  -3.402
  491    HB   VAL  62           HB       VAL  62  71.551  -2.307  -3.437
  492   1HG1  VAL  62          1HG1      VAL  62  71.966  -0.989  -1.404
  493   2HG1  VAL  62          2HG1      VAL  62  72.132  -2.473  -0.465
  494   3HG1  VAL  62          3HG1      VAL  62  70.575  -2.049  -1.177
  495   1HG2  VAL  62          1HG2      VAL  62  74.015  -2.799  -1.795
  496   2HG2  VAL  62          2HG2      VAL  62  73.827  -1.839  -3.263
  497   3HG2  VAL  62          3HG2      VAL  62  73.849  -3.599  -3.358
  498    H    ILE  63           H        ILE  63  73.569  -5.807  -2.395
  499    HA   ILE  63           HA       ILE  63  73.118  -6.520   0.480
  500    HB   ILE  63           HB       ILE  63  74.603  -7.966  -1.741
  501   1HG1  ILE  63          2HG1      ILE  63  72.193  -7.825  -2.236
  502   2HG1  ILE  63          1HG1      ILE  63  72.631  -9.473  -1.796
  503   1HG2  ILE  63          1HG2      ILE  63  74.040  -9.900  -0.005
  504   2HG2  ILE  63          2HG2      ILE  63  74.044  -8.556   1.137
  505   3HG2  ILE  63          3HG2      ILE  63  75.484  -8.903   0.178
  506   1HD1  ILE  63          1HD1      ILE  63  71.813  -9.089   0.499
  507   2HD1  ILE  63          2HD1      ILE  63  70.537  -8.772  -0.678
  508   3HD1  ILE  63          3HD1      ILE  63  71.396  -7.429   0.076
  509    H    ILE  64           H        ILE  64  74.591  -5.766   1.920
  510    HA   ILE  64           HA       ILE  64  77.205  -4.662   1.099
  511    HB   ILE  64           HB       ILE  64  75.908  -5.218   3.795
  512   1HG1  ILE  64          2HG1      ILE  64  76.229  -2.564   2.375
  513   2HG1  ILE  64          1HG1      ILE  64  74.786  -3.561   2.192
  514   1HG2  ILE  64          1HG2      ILE  64  78.253  -3.414   3.133
  515   2HG2  ILE  64          2HG2      ILE  64  78.415  -5.025   3.832
  516   3HG2  ILE  64          3HG2      ILE  64  77.596  -3.752   4.734
  517   1HD1  ILE  64          1HD1      ILE  64  74.720  -1.752   4.022
  518   2HD1  ILE  64          2HD1      ILE  64  75.841  -2.783   4.913
  519   3HD1  ILE  64          3HD1      ILE  64  74.235  -3.381   4.494
  520    HA   PRO  65           HA       PRO  65  79.331  -8.567   1.410
  521   1HB   PRO  65          2HB       PRO  65  81.825  -7.718   2.143
  522   2HB   PRO  65          1HB       PRO  65  81.187  -7.508   0.496
  523   1HG   PRO  65          2HG       PRO  65  81.168  -5.560   2.775
  524   2HG   PRO  65          1HG       PRO  65  81.727  -5.311   1.108
  525   1HD   PRO  65          2HD       PRO  65  79.319  -4.478   1.815
  526   2HD   PRO  65          1HD       PRO  65  79.539  -5.307   0.252
  527    H    LYS  66           H        LYS  66  79.501 -10.058   3.059
  528    HA   LYS  66           HA       LYS  66  78.719  -9.546   5.728
  529   1HB   LYS  66          2HB       LYS  66  78.763 -11.743   4.550
  530   2HB   LYS  66          1HB       LYS  66  80.524 -11.743   4.660
  531   1HG   LYS  66          2HG       LYS  66  79.791 -13.046   6.511
  532   2HG   LYS  66          1HG       LYS  66  80.207 -11.473   7.193
  533   1HD   LYS  66          2HD       LYS  66  77.853 -10.800   7.153
  534   2HD   LYS  66          1HD       LYS  66  77.409 -12.328   6.394
  535   1HE   LYS  66          2HE       LYS  66  77.539 -13.484   8.367
  536   2HE   LYS  66          1HE       LYS  66  78.969 -12.582   8.907
  537   1HZ   LYS  66          1HZ       LYS  66  77.087 -11.923  10.231
  538   2HZ   LYS  66          2HZ       LYS  66  76.168 -11.589   8.843
  539   3HZ   LYS  66          3HZ       LYS  66  77.519 -10.631   9.220
  540    H    ALA  67           H        ALA  67  81.946  -9.555   4.284
  541    HA   ALA  67           HA       ALA  67  83.545  -9.559   6.635
  542   1HB   ALA  67          1HB       ALA  67  83.810  -8.494   3.832
  543   2HB   ALA  67          2HB       ALA  67  84.663  -9.838   4.592
  544   3HB   ALA  67          3HB       ALA  67  85.088  -8.178   5.007
  545    H    LEU  68           H        LEU  68  81.952  -6.874   4.940
  546    HA   LEU  68           HA       LEU  68  83.078  -4.819   6.682
  547   1HB   LEU  68          2HB       LEU  68  80.846  -4.892   4.632
  548   2HB   LEU  68          1HB       LEU  68  81.339  -3.417   5.463
  549    HG   LEU  68           HG       LEU  68  83.144  -5.163   3.753
  550   1HD1  LEU  68          1HD1      LEU  68  82.847  -3.657   2.029
  551   2HD1  LEU  68          2HD1      LEU  68  82.500  -2.316   3.121
  552   3HD1  LEU  68          3HD1      LEU  68  81.260  -3.526   2.787
  553   1HD2  LEU  68          1HD2      LEU  68  83.608  -2.673   5.400
  554   2HD2  LEU  68          2HD2      LEU  68  84.627  -3.043   4.010
  555   3HD2  LEU  68          3HD2      LEU  68  84.554  -4.161   5.372
  556    H    ARG  69           H        ARG  69  80.072  -6.721   6.617
  557    HA   ARG  69           HA       ARG  69  78.520  -5.227   8.494
  558   1HB   ARG  69          2HB       ARG  69  78.763  -8.244   8.197
  559   2HB   ARG  69          1HB       ARG  69  77.395  -7.383   8.887
  560   1HG   ARG  69          2HG       ARG  69  77.118  -6.244   6.631
  561   2HG   ARG  69          1HG       ARG  69  78.302  -7.395   6.004
  562   1HD   ARG  69          2HD       ARG  69  76.724  -9.155   7.246
  563   2HD   ARG  69          1HD       ARG  69  75.511  -7.896   6.955
  564    HE   ARG  69           HE       ARG  69  76.743  -8.050   4.521
  565   1HH1  ARG  69          1HH1      ARG  69  75.428 -10.531   6.633
  566   2HH1  ARG  69          2HH1      ARG  69  75.073 -11.591   5.316
  567   1HH2  ARG  69          1HH2      ARG  69  76.251  -9.463   2.868
  568   2HH2  ARG  69          2HH2      ARG  69  75.530 -10.998   3.214
  569    H    ASP  70           H        ASP  70  80.869  -7.853   9.001
  570    HA   ASP  70           HA       ASP  70  80.579  -7.962  11.863
  571   1HB   ASP  70          2HB       ASP  70  82.804  -8.833   9.989
  572   2HB   ASP  70          1HB       ASP  70  82.661  -9.340  11.671
  573    H    VAL  71           H        VAL  71  83.092  -6.474   9.788
  574    HA   VAL  71           HA       VAL  71  84.748  -5.464  11.881
  575    HB   VAL  71           HB       VAL  71  84.166  -4.461   9.069
  576   1HG1  VAL  71          1HG1      VAL  71  86.388  -3.381   9.199
  577   2HG1  VAL  71          2HG1      VAL  71  86.519  -3.867  10.890
  578   3HG1  VAL  71          3HG1      VAL  71  85.276  -2.716  10.397
  579   1HG2  VAL  71          1HG2      VAL  71  85.801  -5.941   8.330
  580   2HG2  VAL  71          2HG2      VAL  71  85.089  -6.872   9.647
  581   3HG2  VAL  71          3HG2      VAL  71  86.602  -6.001   9.900
  582    H    ILE  72           H        ILE  72  81.920  -4.059  10.277
  583    HA   ILE  72           HA       ILE  72  82.163  -1.493  11.643
  584    HB   ILE  72           HB       ILE  72  79.972  -2.750   9.953
  585   1HG1  ILE  72          2HG1      ILE  72  82.154  -0.779   9.200
  586   2HG1  ILE  72          1HG1      ILE  72  82.225  -2.511   8.870
  587   1HG2  ILE  72          1HG2      ILE  72  79.408  -0.705  11.469
  588   2HG2  ILE  72          2HG2      ILE  72  78.994  -0.610   9.759
  589   3HG2  ILE  72          3HG2      ILE  72  80.435   0.204  10.362
  590   1HD1  ILE  72          1HD1      ILE  72  80.464  -0.419   7.654
  591   2HD1  ILE  72          2HD1      ILE  72  79.845  -2.068   7.788
  592   3HD1  ILE  72          3HD1      ILE  72  81.322  -1.750   6.876
  593    H    GLY  73           H        GLY  73  80.661  -4.546  12.432
  594   1HA   GLY  73          2HA       GLY  73  79.618  -5.155  14.454
  595   2HA   GLY  73          1HA       GLY  73  79.848  -3.498  15.012
  596    H    ILE  74           H        ILE  74  78.147  -4.422  12.051
  597    HA   ILE  74           HA       ILE  74  75.860  -2.777  12.916
  598    HB   ILE  74           HB       ILE  74  76.448  -4.273  10.339
  599   1HG1  ILE  74          2HG1      ILE  74  78.206  -2.628  10.859
  600   2HG1  ILE  74          1HG1      ILE  74  77.230  -2.070   9.503
  601   1HG2  ILE  74          1HG2      ILE  74  74.295  -2.413  11.221
  602   2HG2  ILE  74          2HG2      ILE  74  74.227  -3.751  10.074
  603   3HG2  ILE  74          3HG2      ILE  74  74.918  -2.203   9.585
  604   1HD1  ILE  74          1HD1      ILE  74  77.379  -0.147  10.840
  605   2HD1  ILE  74          2HD1      ILE  74  77.272  -1.065  12.342
  606   3HD1  ILE  74          3HD1      ILE  74  75.836  -0.834  11.346
  607    H    LYS  75           H        LYS  75  73.791  -3.531  13.321
  608    HA   LYS  75           HA       LYS  75  73.348  -6.501  13.253
  609   1HB   LYS  75          2HB       LYS  75  72.772  -4.391  15.343
  610   2HB   LYS  75          1HB       LYS  75  71.995  -5.975  15.376
  611   1HG   LYS  75          2HG       LYS  75  73.846  -6.465  16.657
  612   2HG   LYS  75          1HG       LYS  75  74.527  -6.787  15.063
  613   1HD   LYS  75          2HD       LYS  75  75.842  -4.912  15.091
  614   2HD   LYS  75          1HD       LYS  75  74.662  -3.971  16.003
  615   1HE   LYS  75          2HE       LYS  75  76.359  -4.290  17.602
  616   2HE   LYS  75          1HE       LYS  75  75.285  -5.659  17.952
  617   1HZ   LYS  75          1HZ       LYS  75  77.574  -6.404  17.657
  618   2HZ   LYS  75          2HZ       LYS  75  77.614  -5.717  16.105
  619   3HZ   LYS  75          3HZ       LYS  75  76.576  -7.022  16.432
  620    HA   PRO  76           HA       PRO  76  69.552  -5.767  11.066
  621   1HB   PRO  76          2HB       PRO  76  68.145  -7.486  13.031
  622   2HB   PRO  76          1HB       PRO  76  68.286  -7.667  11.273
  623   1HG   PRO  76          2HG       PRO  76  69.621  -9.231  13.007
  624   2HG   PRO  76          1HG       PRO  76  70.251  -8.807  11.410
  625   1HD   PRO  76          2HD       PRO  76  71.084  -7.835  14.078
  626   2HD   PRO  76          1HD       PRO  76  72.022  -7.990  12.578
  627    H    GLY  77           H        GLY  77  68.039  -4.144  11.235
  628   1HA   GLY  77          2HA       GLY  77  66.276  -2.911  12.266
  629   2HA   GLY  77          1HA       GLY  77  66.742  -3.588  13.822
  630    H    GLU  78           H        GLU  78  69.592  -2.512  12.463
  631    HA   GLU  78           HA       GLU  78  69.477   0.005  14.041
  632   1HB   GLU  78          2HB       GLU  78  71.545  -1.924  13.105
  633   2HB   GLU  78          1HB       GLU  78  72.051  -0.244  13.292
  634   1HG   GLU  78          2HG       GLU  78  71.073  -0.262  15.598
  635   2HG   GLU  78          1HG       GLU  78  70.747  -1.984  15.405
  636    H    VAL  79           H        VAL  79  69.473   1.969  13.068
  637    HA   VAL  79           HA       VAL  79  69.247   2.036  10.133
  638    HB   VAL  79           HB       VAL  79  67.623   3.123  11.643
  639   1HG1  VAL  79          1HG1      VAL  79  68.239   4.404  13.397
  640   2HG1  VAL  79          2HG1      VAL  79  69.276   5.412  12.390
  641   3HG1  VAL  79          3HG1      VAL  79  69.901   3.913  13.075
  642   1HG2  VAL  79          1HG2      VAL  79  67.704   5.415  10.582
  643   2HG2  VAL  79          2HG2      VAL  79  67.843   4.082   9.436
  644   3HG2  VAL  79          3HG2      VAL  79  69.281   4.985   9.916
  645    H    ILE  80           H        ILE  80  70.772   2.795   8.784
  646    HA   ILE  80           HA       ILE  80  73.092   4.335   9.886
  647    HB   ILE  80           HB       ILE  80  74.448   3.132   8.178
  648   1HG1  ILE  80          2HG1      ILE  80  71.901   1.567   7.647
  649   2HG1  ILE  80          1HG1      ILE  80  72.566   2.798   6.572
  650   1HG2  ILE  80          1HG2      ILE  80  72.972   0.937   9.567
  651   2HG2  ILE  80          2HG2      ILE  80  73.709   2.187  10.568
  652   3HG2  ILE  80          3HG2      ILE  80  74.707   1.237   9.466
  653   1HD1  ILE  80          1HD1      ILE  80  73.628   1.012   5.618
  654   2HD1  ILE  80          2HD1      ILE  80  73.497   0.027   7.075
  655   3HD1  ILE  80          3HD1      ILE  80  74.767   1.243   6.944
  656    H    GLU  81           H        GLU  81  74.017   5.840   8.302
  657    HA   GLU  81           HA       GLU  81  72.038   6.879   6.326
  658   1HB   GLU  81          2HB       GLU  81  73.021   8.381   8.078
  659   2HB   GLU  81          1HB       GLU  81  74.623   8.055   7.413
  660   1HG   GLU  81          2HG       GLU  81  73.848   8.940   5.211
  661   2HG   GLU  81          1HG       GLU  81  72.304   9.356   5.953
  662    H    VAL  82           H        VAL  82  72.447   6.561   4.191
  663    HA   VAL  82           HA       VAL  82  74.997   5.190   3.465
  664    HB   VAL  82           HB       VAL  82  72.183   5.101   2.320
  665   1HG1  VAL  82          1HG1      VAL  82  74.728   3.642   1.579
  666   2HG1  VAL  82          2HG1      VAL  82  73.687   4.605   0.531
  667   3HG1  VAL  82          3HG1      VAL  82  73.127   3.046   1.136
  668   1HG2  VAL  82          1HG2      VAL  82  72.524   2.651   3.217
  669   2HG2  VAL  82          2HG2      VAL  82  72.073   3.931   4.344
  670   3HG2  VAL  82          3HG2      VAL  82  73.752   3.400   4.238
  671    H    LEU  83           H        LEU  83  76.305   6.191   2.046
  672    HA   LEU  83           HA       LEU  83  75.261   8.496   0.433
  673   1HB   LEU  83          2HB       LEU  83  78.115   7.864   1.285
  674   2HB   LEU  83          1HB       LEU  83  77.523   9.381   0.618
  675    HG   LEU  83           HG       LEU  83  76.712   8.206   3.295
  676   1HD1  LEU  83          1HD1      LEU  83  78.379  10.665   2.709
  677   2HD1  LEU  83          2HD1      LEU  83  79.076   9.088   3.086
  678   3HD1  LEU  83          3HD1      LEU  83  78.078   9.923   4.281
  679   1HD2  LEU  83          1HD2      LEU  83  76.121  10.932   2.110
  680   2HD2  LEU  83          2HD2      LEU  83  75.503  10.275   3.626
  681   3HD2  LEU  83          3HD2      LEU  83  74.986   9.583   2.088
  682    H    LEU  84           H        LEU  84  75.320   8.163  -1.789
  683    HA   LEU  84           HA       LEU  84  76.690   5.815  -2.936
  684   1HB   LEU  84          2HB       LEU  84  74.892   8.026  -3.868
  685   2HB   LEU  84          1HB       LEU  84  75.835   7.133  -5.065
  686    HG   LEU  84           HG       LEU  84  74.378   5.551  -2.997
  687   1HD1  LEU  84          1HD1      LEU  84  72.330   6.293  -3.561
  688   2HD1  LEU  84          2HD1      LEU  84  72.629   5.832  -5.235
  689   3HD1  LEU  84          3HD1      LEU  84  73.031   7.456  -4.682
  690   1HD2  LEU  84          1HD2      LEU  84  74.005   4.328  -5.379
  691   2HD2  LEU  84          2HD2      LEU  84  75.465   4.109  -4.415
  692   3HD2  LEU  84          3HD2      LEU  84  75.458   5.254  -5.756
  693    H    LEU  85           H        LEU  85  78.627   5.900  -4.052
  694    HA   LEU  85           HA       LEU  85  80.139   8.467  -3.864
  695   1HB   LEU  85          2HB       LEU  85  80.716   5.557  -3.557
  696   2HB   LEU  85          1HB       LEU  85  82.022   6.578  -4.164
  697    HG   LEU  85           HG       LEU  85  80.434   7.373  -1.728
  698   1HD1  LEU  85          1HD1      LEU  85  83.017   5.797  -1.669
  699   2HD1  LEU  85          2HD1      LEU  85  81.435   5.040  -1.489
  700   3HD1  LEU  85          3HD1      LEU  85  81.984   6.227  -0.306
  701   1HD2  LEU  85          1HD2      LEU  85  81.857   9.075  -2.779
  702   2HD2  LEU  85          2HD2      LEU  85  83.234   7.974  -2.736
  703   3HD2  LEU  85          3HD2      LEU  85  82.550   8.590  -1.232
  704    H    GLY  86           H        GLY  86  79.244   5.839  -6.075
  705   1HA   GLY  86          2HA       GLY  86  79.842   7.494  -8.414
  706   2HA   GLY  86          1HA       GLY  86  81.036   6.223  -8.178
  707    H    HIS  87           H        HIS  87  79.928   5.828 -10.454
  708    HA   HIS  87           HA       HIS  87  77.876   3.690 -10.065
  709   1HB   HIS  87          2HB       HIS  87  76.549   4.721 -11.905
  710   2HB   HIS  87          1HB       HIS  87  76.712   5.812 -10.536
  711    HD1  HIS  87           HD1      HIS  87  77.788   5.348 -14.092
  712    HD2  HIS  87           HD2      HIS  87  78.376   8.091 -11.009
  713    HE1  HIS  87           HE1      HIS  87  78.868   7.384 -15.142
  714    H    TYR  88           H        TYR  88  77.860   2.119 -11.796
  715    HA   TYR  88           HA       TYR  88  79.929   2.438 -13.926
  716   1HB   TYR  88          2HB       TYR  88  79.507   0.098 -12.040
  717   2HB   TYR  88          1HB       TYR  88  80.524   0.020 -13.481
  718    HD1  TYR  88           HD1      TYR  88  80.185   1.366 -10.048
  719    HD2  TYR  88           HD2      TYR  88  82.619   1.367 -13.661
  720    HE1  TYR  88           HE1      TYR  88  82.086   2.404  -8.768
  721    HE2  TYR  88           HE2      TYR  88  84.519   2.404 -12.381
  722    HH   TYR  88           HH       TYR  88  84.657   3.908 -10.163
  723    H    LYS  89           H        LYS  89  79.232   1.650 -15.913
  724    HA   LYS  89           HA       LYS  89  76.587   0.226 -15.978
  725   1HB   LYS  89          2HB       LYS  89  77.665   2.649 -17.307
  726   2HB   LYS  89          1HB       LYS  89  76.744   1.566 -18.352
  727   1HG   LYS  89          2HG       LYS  89  74.972   1.564 -16.472
  728   2HG   LYS  89          1HG       LYS  89  75.831   2.969 -15.840
  729   1HD   LYS  89          2HD       LYS  89  74.964   2.836 -18.727
  730   2HD   LYS  89          1HD       LYS  89  73.868   3.405 -17.467
  731   1HE   LYS  89          2HE       LYS  89  75.396   5.190 -16.852
  732   2HE   LYS  89          1HE       LYS  89  76.638   4.559 -17.952
  733   1HZ   LYS  89          1HZ       LYS  89  73.943   5.563 -18.701
  734   2HZ   LYS  89          2HZ       LYS  89  75.005   4.788 -19.776
  735   3HZ   LYS  89          3HZ       LYS  89  75.432   6.279 -19.082
  736    HA   PRO  90           HA       PRO  90  78.383  -3.014 -18.393
  737   1HB   PRO  90          2HB       PRO  90  76.255  -2.452 -20.435
  738   2HB   PRO  90          1HB       PRO  90  76.700  -3.995 -19.670
  739   1HG   PRO  90          2HG       PRO  90  74.534  -2.790 -18.866
  740   2HG   PRO  90          1HG       PRO  90  75.659  -3.432 -17.651
  741   1HD   PRO  90          2HD       PRO  90  75.309  -0.597 -18.575
  742   2HD   PRO  90          1HD       PRO  90  75.475  -1.230 -16.918
  743    H    ARG  91           H        ARG  91  79.859  -3.245 -20.126
  744    HA   ARG  91           HA       ARG  91  80.173  -0.873 -21.944
  745   1HB   ARG  91          2HB       ARG  91  82.174  -2.662 -20.537
  746   2HB   ARG  91          1HB       ARG  91  82.633  -1.557 -21.833
  747   1HG   ARG  91          2HG       ARG  91  81.140  -0.661 -19.357
  748   2HG   ARG  91          1HG       ARG  91  82.898  -0.626 -19.484
  749   1HD   ARG  91          2HD       ARG  91  82.671   0.795 -21.545
  750   2HD   ARG  91          1HD       ARG  91  80.924   0.867 -21.247
  751    HE   ARG  91           HE       ARG  91  82.997   2.208 -19.663
  752   1HH1  ARG  91          1HH1      ARG  91  79.712   0.969 -19.675
  753   2HH1  ARG  91          2HH1      ARG  91  79.220   2.008 -18.386
  754   1HH2  ARG  91          1HH2      ARG  91  82.302   3.520 -18.001
  755   2HH2  ARG  91          2HH2      ARG  91  80.663   3.432 -17.447
  756    H    ASN  92           H        ASN  92  80.653  -1.349 -24.127
  757    HA   ASN  92           HA       ASN  92  80.564  -2.603 -26.126
  758   1HB   ASN  92          2HB       ASN  92  81.929  -4.541 -24.229
  759   2HB   ASN  92          1HB       ASN  92  81.914  -4.710 -25.984
  760   1HD2  ASN  92          1HD2      ASN  92  84.342  -4.323 -24.416
  761   2HD2  ASN  92          2HD2      ASN  92  85.010  -2.834 -24.880
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1  83.406  14.288   0.901
    2   2H    MET   1          2H        MET   1  84.798  13.321   1.008
    3   3H    MET   1          3H        MET   1  83.272  12.600   0.817
    4    HA   MET   1           HA       MET   1  84.755  14.220  -1.187
    5   1HB   MET   1          2HB       MET   1  83.923  11.336  -0.819
    6   2HB   MET   1          1HB       MET   1  84.411  11.969  -2.392
    7   1HG   MET   1          2HG       MET   1  86.548  12.749  -1.365
    8   2HG   MET   1          1HG       MET   1  86.072  11.963   0.141
    9   1HE   MET   1          1HE       MET   1  84.755   8.859  -1.360
   10   2HE   MET   1          2HE       MET   1  84.934   9.861   0.079
   11   3HE   MET   1          3HE       MET   1  86.018   8.496  -0.175
   12    H    ASP   2           H        ASP   2  83.435  13.402  -3.384
   13    HA   ASP   2           HA       ASP   2  80.899  14.853  -3.265
   14   1HB   ASP   2          2HB       ASP   2  82.308  13.247  -5.424
   15   2HB   ASP   2          1HB       ASP   2  80.889  14.256  -5.702
   16    H    VAL   3           H        VAL   3  78.822  13.961  -3.348
   17    HA   VAL   3           HA       VAL   3  78.613  10.989  -3.413
   18    HB   VAL   3           HB       VAL   3  78.465  12.191  -1.143
   19   1HG1  VAL   3          1HG1      VAL   3  75.662  12.866  -2.051
   20   2HG1  VAL   3          2HG1      VAL   3  76.971  14.052  -2.033
   21   3HG1  VAL   3          3HG1      VAL   3  76.441  13.303  -0.526
   22   1HG2  VAL   3          1HG2      VAL   3  77.744   9.934  -1.259
   23   2HG2  VAL   3          2HG2      VAL   3  76.319  10.356  -2.208
   24   3HG2  VAL   3          3HG2      VAL   3  76.404  10.795  -0.501
   25    H    LEU   4           H        LEU   4  76.899  10.201  -4.642
   26    HA   LEU   4           HA       LEU   4  75.643  12.132  -6.481
   27   1HB   LEU   4          2HB       LEU   4  75.451   9.109  -6.354
   28   2HB   LEU   4          1HB       LEU   4  75.099  10.123  -7.746
   29    HG   LEU   4           HG       LEU   4  77.814   9.680  -6.455
   30   1HD1  LEU   4          1HD1      LEU   4  78.284   8.895  -8.869
   31   2HD1  LEU   4          2HD1      LEU   4  76.529   8.835  -9.049
   32   3HD1  LEU   4          3HD1      LEU   4  77.328   7.830  -7.836
   33   1HD2  LEU   4          1HD2      LEU   4  78.493  11.041  -8.618
   34   2HD2  LEU   4          2HD2      LEU   4  78.007  11.902  -7.154
   35   3HD2  LEU   4          3HD2      LEU   4  76.858  11.691  -8.478
   36    H    ALA   5           H        ALA   5  74.741  10.374  -3.616
   37    HA   ALA   5           HA       ALA   5  72.159  11.659  -3.490
   38   1HB   ALA   5          1HB       ALA   5  72.156   9.550  -5.192
   39   2HB   ALA   5          2HB       ALA   5  70.748   9.985  -4.222
   40   3HB   ALA   5          3HB       ALA   5  71.832   8.704  -3.679
   41    H    LYS   6           H        LYS   6  71.130  11.216  -1.422
   42    HA   LYS   6           HA       LYS   6  72.745   9.549   0.482
   43   1HB   LYS   6          2HB       LYS   6  73.300  11.968   0.620
   44   2HB   LYS   6          1HB       LYS   6  71.598  12.334   0.904
   45   1HG   LYS   6          2HG       LYS   6  71.714  10.793   2.918
   46   2HG   LYS   6          1HG       LYS   6  73.461  10.751   2.689
   47   1HD   LYS   6          2HD       LYS   6  71.871  13.308   3.013
   48   2HD   LYS   6          1HD       LYS   6  72.694  12.490   4.341
   49   1HE   LYS   6          2HE       LYS   6  74.835  12.644   2.968
   50   2HE   LYS   6          1HE       LYS   6  73.951  13.730   1.876
   51   1HZ   LYS   6          1HZ       LYS   6  75.088  14.934   3.685
   52   2HZ   LYS   6          2HZ       LYS   6  74.150  14.087   4.820
   53   3HZ   LYS   6          3HZ       LYS   6  73.406  15.148   3.721
   54    H    PHE   7           H        PHE   7  71.425   8.118   1.553
   55    HA   PHE   7           HA       PHE   7  68.667   8.939   2.280
   56   1HB   PHE   7          2HB       PHE   7  67.693   6.972   1.179
   57   2HB   PHE   7          1HB       PHE   7  68.573   7.947   0.007
   58    HD1  PHE   7           HD1      PHE   7  68.129   4.649   1.349
   59    HD2  PHE   7           HD2      PHE   7  71.115   7.288  -0.411
   60    HE1  PHE   7           HE1      PHE   7  69.537   2.655   0.742
   61    HE2  PHE   7           HE2      PHE   7  72.521   5.292  -1.010
   62    HZ   PHE   7           HZ       PHE   7  71.733   2.971  -0.428
   63    H    HIS   8           H        HIS   8  67.684   7.384   3.844
   64    HA   HIS   8           HA       HIS   8  69.813   6.076   5.512
   65   1HB   HIS   8          2HB       HIS   8  67.129   7.339   6.173
   66   2HB   HIS   8          1HB       HIS   8  68.201   6.598   7.360
   67    HD1  HIS   8           HD1      HIS   8  67.865   9.601   5.136
   68    HD2  HIS   8           HD2      HIS   8  70.548   8.103   7.953
   69    HE1  HIS   8           HE1      HIS   8  69.472  11.486   5.666
   70    H    THR   9           H        THR   9  69.537   3.949   6.100
   71    HA   THR   9           HA       THR   9  66.901   2.633   5.867
   72    HB   THR   9           HB       THR   9  68.009   2.552   3.600
   73    HG1  THR   9           HG1      THR   9  66.849   0.827   3.577
   74   1HG2  THR   9          1HG2      THR   9  69.949   1.002   3.340
   75   2HG2  THR   9          2HG2      THR   9  70.068   0.910   5.099
   76   3HG2  THR   9          3HG2      THR   9  70.348   2.445   4.276
   77    H    THR  10           H        THR  10  66.998   0.413   6.903
   78    HA   THR  10           HA       THR  10  69.235   0.273   8.885
   79    HB   THR  10           HB       THR  10  66.815   0.643   9.654
   80    HG1  THR  10           HG1      THR  10  68.097  -1.697  10.582
   81   1HG2  THR  10          1HG2      THR  10  66.258  -2.229   9.609
   82   2HG2  THR  10          2HG2      THR  10  66.241  -1.503   7.998
   83   3HG2  THR  10          3HG2      THR  10  65.180  -0.873   9.260
   84    H    VAL  11           H        VAL  11  70.018  -1.897   9.423
   85    HA   VAL  11           HA       VAL  11  70.403  -3.517   7.024
   86    HB   VAL  11           HB       VAL  11  71.236  -3.925   9.920
   87   1HG1  VAL  11          1HG1      VAL  11  72.931  -5.424   9.026
   88   2HG1  VAL  11          2HG1      VAL  11  72.424  -5.075   7.375
   89   3HG1  VAL  11          3HG1      VAL  11  71.351  -5.962   8.458
   90   1HG2  VAL  11          1HG2      VAL  11  73.463  -3.119   8.487
   91   2HG2  VAL  11          2HG2      VAL  11  72.485  -2.069   9.510
   92   3HG2  VAL  11          3HG2      VAL  11  72.181  -2.139   7.773
   93    H    HIS  12           H        HIS  12  69.419  -5.424   6.525
   94    HA   HIS  12           HA       HIS  12  67.567  -6.652   8.538
   95   1HB   HIS  12          2HB       HIS  12  67.431  -6.258   5.566
   96   2HB   HIS  12          1HB       HIS  12  66.620  -7.654   6.282
   97    HD1  HIS  12           HD1      HIS  12  66.867  -3.915   7.078
   98    HD2  HIS  12           HD2      HIS  12  64.060  -6.997   7.049
   99    HE1  HIS  12           HE1      HIS  12  64.672  -2.889   7.807
  100    H    ARG  13           H        ARG  13  67.330  -9.078   8.067
  101    HA   ARG  13           HA       ARG  13  69.630 -10.486   8.668
  102   1HB   ARG  13          2HB       ARG  13  67.184 -11.258   7.066
  103   2HB   ARG  13          1HB       ARG  13  68.345 -12.448   7.665
  104   1HG   ARG  13          2HG       ARG  13  67.977 -11.569   9.979
  105   2HG   ARG  13          1HG       ARG  13  66.731 -10.497   9.338
  106   1HD   ARG  13          2HD       ARG  13  65.544 -12.547   8.438
  107   2HD   ARG  13          1HD       ARG  13  66.709 -13.533   9.342
  108    HE   ARG  13           HE       ARG  13  65.610 -11.515  11.073
  109   1HH1  ARG  13          1HH1      ARG  13  64.743 -14.539   9.514
  110   2HH1  ARG  13          2HH1      ARG  13  63.584 -14.939  10.732
  111   1HH2  ARG  13          1HH2      ARG  13  64.104 -12.086  12.612
  112   2HH2  ARG  13          2HH2      ARG  13  63.225 -13.571  12.464
  113    H    ILE  14           H        ILE  14  71.143 -11.761   7.490
  114    HA   ILE  14           HA       ILE  14  72.667 -12.251   5.771
  115    HB   ILE  14           HB       ILE  14  70.414 -11.363   3.938
  116   1HG1  ILE  14          2HG1      ILE  14  71.045 -14.181   4.849
  117   2HG1  ILE  14          1HG1      ILE  14  69.833 -13.179   5.650
  118   1HG2  ILE  14          1HG2      ILE  14  73.030 -12.752   3.585
  119   2HG2  ILE  14          2HG2      ILE  14  72.206 -11.618   2.513
  120   3HG2  ILE  14          3HG2      ILE  14  71.673 -13.297   2.600
  121   1HD1  ILE  14          1HD1      ILE  14  69.779 -14.414   2.936
  122   2HD1  ILE  14          2HD1      ILE  14  69.029 -12.826   3.115
  123   3HD1  ILE  14          3HD1      ILE  14  68.467 -14.184   4.094
  124    H    GLY  15           H        GLY  15  71.847  -9.164   6.595
  125   1HA   GLY  15          2HA       GLY  15  73.084  -7.185   6.275
  126   2HA   GLY  15          1HA       GLY  15  74.088  -8.050   5.118
  127    H    ARG  16           H        ARG  16  70.695  -8.297   4.513
  128    HA   ARG  16           HA       ARG  16  71.037  -6.878   1.976
  129   1HB   ARG  16          2HB       ARG  16  69.817  -9.034   2.301
  130   2HB   ARG  16          1HB       ARG  16  68.626  -8.182   3.283
  131   1HG   ARG  16          2HG       ARG  16  68.124  -6.707   1.337
  132   2HG   ARG  16          1HG       ARG  16  69.244  -7.659   0.363
  133   1HD   ARG  16          2HD       ARG  16  67.862  -9.713   0.972
  134   2HD   ARG  16          1HD       ARG  16  66.655  -8.591   1.632
  135    HE   ARG  16           HE       ARG  16  67.560  -7.913  -1.071
  136   1HH1  ARG  16          1HH1      ARG  16  65.210  -9.701   0.825
  137   2HH1  ARG  16          2HH1      ARG  16  64.054  -9.724  -0.459
  138   1HH2  ARG  16          1HH2      ARG  16  66.030  -7.977  -2.693
  139   2HH2  ARG  16          2HH2      ARG  16  64.510  -8.763  -2.425
  140    H    ILE  17           H        ILE  17  70.123  -4.889   1.428
  141    HA   ILE  17           HA       ILE  17  68.276  -3.598   3.389
  142    HB   ILE  17           HB       ILE  17  69.502  -1.469   3.085
  143   1HG1  ILE  17          2HG1      ILE  17  71.611  -3.060   1.603
  144   2HG1  ILE  17          1HG1      ILE  17  70.364  -2.136   0.767
  145   1HG2  ILE  17          1HG2      ILE  17  71.443  -2.022   4.409
  146   2HG2  ILE  17          2HG2      ILE  17  71.425  -3.688   3.830
  147   3HG2  ILE  17          3HG2      ILE  17  70.140  -3.108   4.890
  148   1HD1  ILE  17          1HD1      ILE  17  72.785  -1.109   1.550
  149   2HD1  ILE  17          2HD1      ILE  17  71.750  -0.635   2.897
  150   3HD1  ILE  17          3HD1      ILE  17  71.343  -0.139   1.252
  151    H    ILE  18           H        ILE  18  66.821  -2.042   2.361
  152    HA   ILE  18           HA       ILE  18  66.695  -2.291  -0.631
  153    HB   ILE  18           HB       ILE  18  64.442  -1.813   1.350
  154   1HG1  ILE  18          2HG1      ILE  18  65.333  -4.090   1.619
  155   2HG1  ILE  18          1HG1      ILE  18  63.761  -4.148   0.830
  156   1HG2  ILE  18          1HG2      ILE  18  63.166  -2.615  -0.816
  157   2HG2  ILE  18          2HG2      ILE  18  64.627  -2.060  -1.637
  158   3HG2  ILE  18          3HG2      ILE  18  63.678  -0.932  -0.664
  159   1HD1  ILE  18          1HD1      ILE  18  66.447  -4.823  -0.242
  160   2HD1  ILE  18          2HD1      ILE  18  65.364  -3.977  -1.350
  161   3HD1  ILE  18          3HD1      ILE  18  64.871  -5.513  -0.637
  162    H    ILE  19           H        ILE  19  66.911  -0.372  -1.706
  163    HA   ILE  19           HA       ILE  19  67.068   2.171  -0.220
  164    HB   ILE  19           HB       ILE  19  67.150   1.517  -3.201
  165   1HG1  ILE  19          2HG1      ILE  19  69.324   1.811  -1.083
  166   2HG1  ILE  19          1HG1      ILE  19  68.938   0.362  -1.998
  167   1HG2  ILE  19          1HG2      ILE  19  68.148   3.739  -3.435
  168   2HG2  ILE  19          2HG2      ILE  19  68.105   3.983  -1.688
  169   3HG2  ILE  19          3HG2      ILE  19  66.601   3.897  -2.605
  170   1HD1  ILE  19          1HD1      ILE  19  69.435   2.302  -3.953
  171   2HD1  ILE  19          2HD1      ILE  19  70.523   1.000  -3.467
  172   3HD1  ILE  19          3HD1      ILE  19  70.660   2.591  -2.715
  173    HA   PRO  20           HA       PRO  20  62.752   3.220  -0.809
  174   1HB   PRO  20          2HB       PRO  20  62.977   5.946  -0.954
  175   2HB   PRO  20          1HB       PRO  20  63.068   5.060   0.578
  176   1HG   PRO  20          2HG       PRO  20  65.310   5.985  -1.185
  177   2HG   PRO  20          1HG       PRO  20  65.110   6.215   0.563
  178   1HD   PRO  20          2HD       PRO  20  66.685   4.287  -0.313
  179   2HD   PRO  20          1HD       PRO  20  65.560   3.951   1.031
  180    H    ALA  21           H        ALA  21  61.495   3.587  -2.639
  181    HA   ALA  21           HA       ALA  21  62.636   3.393  -5.223
  182   1HB   ALA  21          1HB       ALA  21  59.984   4.014  -4.020
  183   2HB   ALA  21          2HB       ALA  21  60.421   2.772  -5.193
  184   3HB   ALA  21          3HB       ALA  21  60.187   4.439  -5.718
  185    H    GLY  22           H        GLY  22  61.955   6.224  -3.245
  186   1HA   GLY  22          2HA       GLY  22  61.949   8.196  -5.341
  187   2HA   GLY  22          1HA       GLY  22  62.306   8.520  -3.641
  188    H    THR  23           H        THR  23  64.587   6.911  -3.300
  189    HA   THR  23           HA       THR  23  66.645   8.605  -4.435
  190    HB   THR  23           HB       THR  23  66.826   5.895  -3.075
  191    HG1  THR  23           HG1      THR  23  66.991   8.502  -1.976
  192   1HG2  THR  23          1HG2      THR  23  68.832   7.208  -4.344
  193   2HG2  THR  23          2HG2      THR  23  69.082   6.228  -2.899
  194   3HG2  THR  23          3HG2      THR  23  68.916   7.978  -2.759
  195    H    ARG  24           H        ARG  24  65.462   5.326  -5.200
  196    HA   ARG  24           HA       ARG  24  67.397   4.570  -7.175
  197   1HB   ARG  24          2HB       ARG  24  64.427   4.040  -7.427
  198   2HB   ARG  24          1HB       ARG  24  65.754   3.011  -7.942
  199   1HG   ARG  24          2HG       ARG  24  66.323   2.995  -5.355
  200   2HG   ARG  24          1HG       ARG  24  64.620   3.412  -5.208
  201   1HD   ARG  24          2HD       ARG  24  64.348   1.417  -6.963
  202   2HD   ARG  24          1HD       ARG  24  65.861   0.892  -6.190
  203    HE   ARG  24           HE       ARG  24  64.377   1.556  -4.021
  204   1HH1  ARG  24          1HH1      ARG  24  63.551  -0.381  -6.829
  205   2HH1  ARG  24          2HH1      ARG  24  62.412  -1.333  -5.946
  206   1HH2  ARG  24          1HH2      ARG  24  62.915   0.291  -2.940
  207   2HH2  ARG  24          2HH2      ARG  24  62.052  -0.960  -3.771
  208    H    LYS  25           H        LYS  25  64.400   6.441  -7.443
  209    HA   LYS  25           HA       LYS  25  64.413   6.780 -10.288
  210   1HB   LYS  25          2HB       LYS  25  62.467   7.059  -8.776
  211   2HB   LYS  25          1HB       LYS  25  63.227   8.481  -8.064
  212   1HG   LYS  25          2HG       LYS  25  63.190   9.603 -10.254
  213   2HG   LYS  25          1HG       LYS  25  62.428   8.183 -10.971
  214   1HD   LYS  25          2HD       LYS  25  60.538   8.448  -9.344
  215   2HD   LYS  25          1HD       LYS  25  61.277   9.954  -8.798
  216   1HE   LYS  25          2HE       LYS  25  61.227  10.660 -11.294
  217   2HE   LYS  25          1HE       LYS  25  60.067   9.332 -11.495
  218   1HZ   LYS  25          1HZ       LYS  25  59.032  11.501 -10.876
  219   2HZ   LYS  25          2HZ       LYS  25  59.841  11.408  -9.385
  220   3HZ   LYS  25          3HZ       LYS  25  58.686  10.235  -9.803
  221    H    PHE  26           H        PHE  26  65.413   9.006  -7.683
  222    HA   PHE  26           HA       PHE  26  66.356  11.157  -9.291
  223   1HB   PHE  26          2HB       PHE  26  65.975  11.185  -6.839
  224   2HB   PHE  26          1HB       PHE  26  67.362  10.121  -6.618
  225    HD1  PHE  26           HD1      PHE  26  69.587  10.985  -6.489
  226    HD2  PHE  26           HD2      PHE  26  66.344  13.495  -7.959
  227    HE1  PHE  26           HE1      PHE  26  71.123  12.978  -6.477
  228    HE2  PHE  26           HE2      PHE  26  67.878  15.487  -7.945
  229    HZ   PHE  26           HZ       PHE  26  70.268  15.229  -7.204
  230    H    TYR  27           H        TYR  27  67.960   8.186  -8.250
  231    HA   TYR  27           HA       TYR  27  70.578   9.026  -9.280
  232   1HB   TYR  27          2HB       TYR  27  70.072   7.709  -7.189
  233   2HB   TYR  27          1HB       TYR  27  69.615   6.360  -8.214
  234    HD1  TYR  27           HD1      TYR  27  71.435   5.542  -9.993
  235    HD2  TYR  27           HD2      TYR  27  72.288   8.014  -6.517
  236    HE1  TYR  27           HE1      TYR  27  73.843   4.832 -10.082
  237    HE2  TYR  27           HE2      TYR  27  74.694   7.308  -6.611
  238    HH   TYR  27           HH       TYR  27  75.858   4.852  -7.843
  239    H    GLY  28           H        GLY  28  67.829   7.378 -10.633
  240   1HA   GLY  28          2HA       GLY  28  67.540   6.561 -12.818
  241   2HA   GLY  28          1HA       GLY  28  69.203   7.038 -13.161
  242    H    ILE  29           H        ILE  29  68.031   4.794 -10.648
  243    HA   ILE  29           HA       ILE  29  70.049   2.822 -11.526
  244    HB   ILE  29           HB       ILE  29  68.101   2.889  -9.190
  245   1HG1  ILE  29          2HG1      ILE  29  71.064   3.527  -9.306
  246   2HG1  ILE  29          1HG1      ILE  29  69.782   4.732  -9.276
  247   1HG2  ILE  29          1HG2      ILE  29  70.102   1.315  -8.341
  248   2HG2  ILE  29          2HG2      ILE  29  70.217   0.969 -10.067
  249   3HG2  ILE  29          3HG2      ILE  29  68.710   0.662  -9.204
  250   1HD1  ILE  29          1HD1      ILE  29  69.986   4.640  -7.019
  251   2HD1  ILE  29          2HD1      ILE  29  70.878   3.117  -7.079
  252   3HD1  ILE  29          3HD1      ILE  29  69.113   3.111  -7.139
  253    H    GLU  30           H        GLU  30  69.592   0.993 -12.618
  254    HA   GLU  30           HA       GLU  30  66.779  -0.031 -12.654
  255   1HB   GLU  30          2HB       GLU  30  68.752   0.129 -14.963
  256   2HB   GLU  30          1HB       GLU  30  67.163  -0.632 -15.040
  257   1HG   GLU  30          2HG       GLU  30  66.117   1.545 -14.442
  258   2HG   GLU  30          1HG       GLU  30  67.711   2.293 -14.452
  259    H    GLN  31           H        GLN  31  66.734  -2.416 -12.960
  260    HA   GLN  31           HA       GLN  31  68.612  -3.834 -11.370
  261   1HB   GLN  31          2HB       GLN  31  66.279  -4.510 -12.042
  262   2HB   GLN  31          1HB       GLN  31  66.917  -4.917 -13.634
  263   1HG   GLN  31          2HG       GLN  31  68.515  -6.495 -12.553
  264   2HG   GLN  31          1HG       GLN  31  67.763  -6.145 -10.996
  265   1HE2  GLN  31          1HE2      GLN  31  66.201  -7.657 -10.433
  266   2HE2  GLN  31          2HE2      GLN  31  65.239  -8.526 -11.530
  267    H    GLY  32           H        GLY  32  70.493  -4.924 -11.847
  268   1HA   GLY  32          2HA       GLY  32  72.107  -5.994 -13.266
  269   2HA   GLY  32          1HA       GLY  32  71.345  -5.243 -14.664
  270    H    ASP  33           H        ASP  33  71.446  -2.601 -12.885
  271    HA   ASP  33           HA       ASP  33  73.971  -1.639 -14.017
  272   1HB   ASP  33          2HB       ASP  33  71.876  -0.472 -12.161
  273   2HB   ASP  33          1HB       ASP  33  73.243   0.449 -12.786
  274    H    PHE  34           H        PHE  34  75.723  -0.720 -12.680
  275    HA   PHE  34           HA       PHE  34  75.947  -2.014  -9.980
  276   1HB   PHE  34          2HB       PHE  34  77.977  -1.183 -12.075
  277   2HB   PHE  34          1HB       PHE  34  78.431  -1.665 -10.440
  278    HD1  PHE  34           HD1      PHE  34  77.016  -2.808 -13.685
  279    HD2  PHE  34           HD2      PHE  34  78.185  -3.993  -9.659
  280    HE1  PHE  34           HE1      PHE  34  76.881  -5.228 -14.359
  281    HE2  PHE  34           HE2      PHE  34  78.049  -6.414 -10.332
  282    HZ   PHE  34           HZ       PHE  34  77.397  -7.031 -12.682
  283    H    VAL  35           H        VAL  35  76.333  -0.639  -8.247
  284    HA   VAL  35           HA       VAL  35  76.968   2.219  -8.855
  285    HB   VAL  35           HB       VAL  35  75.376   2.852  -7.050
  286   1HG1  VAL  35          1HG1      VAL  35  73.314   2.367  -8.293
  287   2HG1  VAL  35          2HG1      VAL  35  74.122   1.063  -9.162
  288   3HG1  VAL  35          3HG1      VAL  35  74.619   2.735  -9.421
  289   1HG2  VAL  35          1HG2      VAL  35  75.399   0.876  -5.666
  290   2HG2  VAL  35          2HG2      VAL  35  74.853  -0.135  -7.005
  291   3HG2  VAL  35          3HG2      VAL  35  73.759   1.054  -6.294
  292    H    GLU  36           H        GLU  36  78.209   3.254  -7.124
  293    HA   GLU  36           HA       GLU  36  79.613   1.273  -5.355
  294   1HB   GLU  36          2HB       GLU  36  80.900   2.317  -7.250
  295   2HB   GLU  36          1HB       GLU  36  80.589   3.899  -6.536
  296   1HG   GLU  36          2HG       GLU  36  81.709   3.136  -4.441
  297   2HG   GLU  36          1HG       GLU  36  82.094   1.611  -5.233
  298    H    ILE  37           H        ILE  37  79.199   1.612  -3.233
  299    HA   ILE  37           HA       ILE  37  78.251   4.322  -2.391
  300    HB   ILE  37           HB       ILE  37  76.445   2.798  -3.103
  301   1HG1  ILE  37          2HG1      ILE  37  76.205   2.796  -0.125
  302   2HG1  ILE  37          1HG1      ILE  37  76.405   4.347  -0.940
  303   1HG2  ILE  37          1HG2      ILE  37  76.005   0.734  -1.784
  304   2HG2  ILE  37          2HG2      ILE  37  77.529   0.979  -0.932
  305   3HG2  ILE  37          3HG2      ILE  37  77.531   0.655  -2.666
  306   1HD1  ILE  37          1HD1      ILE  37  74.203   4.310  -1.403
  307   2HD1  ILE  37          2HD1      ILE  37  74.050   2.668  -0.788
  308   3HD1  ILE  37          3HD1      ILE  37  74.492   2.940  -2.473
  309    H    LYS  38           H        LYS  38  78.288   4.657  -0.055
  310    HA   LYS  38           HA       LYS  38  79.956   2.725   1.504
  311   1HB   LYS  38          2HB       LYS  38  81.205   4.752   0.604
  312   2HB   LYS  38          1HB       LYS  38  80.170   5.746   1.637
  313   1HG   LYS  38          2HG       LYS  38  80.927   4.515   3.616
  314   2HG   LYS  38          1HG       LYS  38  81.924   3.471   2.604
  315   1HD   LYS  38          2HD       LYS  38  83.175   5.499   1.831
  316   2HD   LYS  38          1HD       LYS  38  82.238   6.467   2.969
  317   1HE   LYS  38          2HE       LYS  38  83.140   4.443   4.600
  318   2HE   LYS  38          1HE       LYS  38  84.507   4.653   3.489
  319   1HZ   LYS  38          1HZ       LYS  38  84.280   7.083   3.838
  320   2HZ   LYS  38          2HZ       LYS  38  84.731   6.243   5.244
  321   3HZ   LYS  38          3HZ       LYS  38  83.130   6.776   5.045
  322    H    ILE  39           H        ILE  39  79.345   2.528   3.685
  323    HA   ILE  39           HA       ILE  39  76.871   4.028   4.504
  324    HB   ILE  39           HB       ILE  39  76.457   2.010   5.931
  325   1HG1  ILE  39          2HG1      ILE  39  78.694   0.697   4.374
  326   2HG1  ILE  39          1HG1      ILE  39  78.959   1.407   5.967
  327   1HG2  ILE  39          1HG2      ILE  39  76.592   1.994   2.970
  328   2HG2  ILE  39          2HG2      ILE  39  75.214   1.742   4.043
  329   3HG2  ILE  39          3HG2      ILE  39  76.353   0.428   3.746
  330   1HD1  ILE  39          1HD1      ILE  39  76.791  -0.048   6.550
  331   2HD1  ILE  39          2HD1      ILE  39  78.415  -0.734   6.615
  332   3HD1  ILE  39          3HD1      ILE  39  77.394  -1.017   5.206
  333    H    VAL  40           H        VAL  40  76.766   4.779   6.672
  334    HA   VAL  40           HA       VAL  40  79.211   4.488   8.355
  335    HB   VAL  40           HB       VAL  40  77.801   7.087   7.649
  336   1HG1  VAL  40          1HG1      VAL  40  79.947   7.972   8.871
  337   2HG1  VAL  40          2HG1      VAL  40  79.978   6.369   9.606
  338   3HG1  VAL  40          3HG1      VAL  40  78.581   7.420   9.839
  339   1HG2  VAL  40          1HG2      VAL  40  80.575   6.051   6.957
  340   2HG2  VAL  40          2HG2      VAL  40  79.951   7.653   6.555
  341   3HG2  VAL  40          3HG2      VAL  40  79.228   6.217   5.828
  342    H    LYS  41           H        LYS  41  78.589   3.873  10.350
  343    HA   LYS  41           HA       LYS  41  76.017   4.881  11.484
  344   1HB   LYS  41          2HB       LYS  41  75.661   2.591  10.715
  345   2HB   LYS  41          1HB       LYS  41  77.131   2.054  11.519
  346   1HG   LYS  41          2HG       LYS  41  75.194   1.442  12.880
  347   2HG   LYS  41          1HG       LYS  41  76.126   2.683  13.713
  348   1HD   LYS  41          2HD       LYS  41  74.563   4.406  12.766
  349   2HD   LYS  41          1HD       LYS  41  73.582   3.091  12.121
  350   1HE   LYS  41          2HE       LYS  41  73.843   2.271  14.711
  351   2HE   LYS  41          1HE       LYS  41  73.843   4.035  14.916
  352   1HZ   LYS  41          1HZ       LYS  41  71.581   3.260  14.853
  353   2HZ   LYS  41          2HZ       LYS  41  71.856   2.429  13.397
  354   3HZ   LYS  41          3HZ       LYS  41  71.897   4.127  13.431
  355    H    TYR  42           H        TYR  42  76.149   5.272  13.742
  356    HA   TYR  42           HA       TYR  42  78.937   5.376  14.820
  357   1HB   TYR  42          2HB       TYR  42  77.394   7.407  14.579
  358   2HB   TYR  42          1HB       TYR  42  76.436   6.707  15.884
  359    HD1  TYR  42           HD1      TYR  42  79.970   7.695  15.000
  360    HD2  TYR  42           HD2      TYR  42  77.033   7.093  18.160
  361    HE1  TYR  42           HE1      TYR  42  81.588   8.633  16.680
  362    HE2  TYR  42           HE2      TYR  42  78.651   8.032  19.842
  363    HH   TYR  42           HH       TYR  42  81.006   8.434  20.126
  364    H    GLU  43           H        GLU  43  79.506   3.975  16.438
  365    HA   GLU  43           HA       GLU  43  77.343   2.800  18.148
  366   1HB   GLU  43          2HB       GLU  43  79.665   1.387  16.792
  367   2HB   GLU  43          1HB       GLU  43  78.539   0.624  17.916
  368   1HG   GLU  43          2HG       GLU  43  76.660   1.227  16.394
  369   2HG   GLU  43          1HG       GLU  43  77.825   1.892  15.254
  370    H    GLY  44           H        GLY  44  77.873   2.833  20.305
  371   1HA   GLY  44          2HA       GLY  44  79.100   3.233  22.264
  372   2HA   GLY  44          1HA       GLY  44  80.490   2.564  21.408
  373    H    GLU  45           H        GLU  45  82.134   4.000  21.549
  374    HA   GLU  45           HA       GLU  45  81.537   6.916  21.313
  375   1HB   GLU  45          2HB       GLU  45  83.676   7.217  22.454
  376   2HB   GLU  45          1HB       GLU  45  82.694   6.060  23.346
  377   1HG   GLU  45          2HG       GLU  45  83.942   4.194  22.310
  378   2HG   GLU  45          1HG       GLU  45  84.915   5.348  21.401
  379    H    GLU  46           H        GLU  46  82.215   4.580  19.152
  380    HA   GLU  46           HA       GLU  46  84.110   6.311  17.610
  381   1HB   GLU  46          2HB       GLU  46  85.179   4.211  16.853
  382   2HB   GLU  46          1HB       GLU  46  85.232   4.366  18.606
  383   1HG   GLU  46          2HG       GLU  46  82.796   3.044  18.045
  384   2HG   GLU  46          1HG       GLU  46  83.988   2.299  16.986
  385    HA   PRO  47           HA       PRO  47  81.005   5.666  14.402
  386   1HB   PRO  47          2HB       PRO  47  82.780   6.815  12.430
  387   2HB   PRO  47          1HB       PRO  47  81.343   7.543  13.166
  388   1HG   PRO  47          2HG       PRO  47  83.942   8.366  13.582
  389   2HG   PRO  47          1HG       PRO  47  82.563   8.742  14.622
  390   1HD   PRO  47          2HD       PRO  47  84.741   6.776  15.020
  391   2HD   PRO  47          1HD       PRO  47  83.789   7.682  16.216
  392    H    LYS  48           H        LYS  48  80.745   3.964  12.973
  393    HA   LYS  48           HA       LYS  48  83.187   2.497  12.031
  394   1HB   LYS  48          2HB       LYS  48  80.352   1.523  12.538
  395   2HB   LYS  48          1HB       LYS  48  81.691   0.522  11.979
  396   1HG   LYS  48          2HG       LYS  48  81.724   2.066  14.585
  397   2HG   LYS  48          1HG       LYS  48  81.273   0.365  14.456
  398   1HD   LYS  48          2HD       LYS  48  83.500  -0.056  13.349
  399   2HD   LYS  48          1HD       LYS  48  83.943   1.604  13.747
  400   1HE   LYS  48          2HE       LYS  48  84.745   0.624  15.673
  401   2HE   LYS  48          1HE       LYS  48  83.047   0.729  16.179
  402   1HZ   LYS  48          1HZ       LYS  48  82.635  -1.443  15.286
  403   2HZ   LYS  48          2HZ       LYS  48  83.961  -1.549  16.344
  404   3HZ   LYS  48          3HZ       LYS  48  84.209  -1.547  14.663
  405    H    GLU  49           H        GLU  49  83.363   2.270   9.796
  406    HA   GLU  49           HA       GLU  49  81.011   3.020   8.107
  407   1HB   GLU  49          2HB       GLU  49  82.543   4.458   6.780
  408   2HB   GLU  49          1HB       GLU  49  82.443   4.990   8.457
  409   1HG   GLU  49          2HG       GLU  49  84.533   3.678   8.933
  410   2HG   GLU  49          1HG       GLU  49  84.660   3.342   7.208
  411    H    GLY  50           H        GLY  50  81.374   2.391   5.786
  412   1HA   GLY  50          2HA       GLY  50  83.459   0.421   5.195
  413   2HA   GLY  50          1HA       GLY  50  81.837  -0.260   5.326
  414    H    THR  51           H        THR  51  83.832   0.397   2.997
  415    HA   THR  51           HA       THR  51  81.749   1.643   1.223
  416    HB   THR  51           HB       THR  51  84.742   1.611   0.756
  417    HG1  THR  51           HG1      THR  51  84.903   3.468   1.850
  418   1HG2  THR  51          1HG2      THR  51  82.361   2.775  -0.547
  419   2HG2  THR  51          2HG2      THR  51  83.945   2.391  -1.223
  420   3HG2  THR  51          3HG2      THR  51  83.706   3.898  -0.339
  421    H    PHE  52           H        PHE  52  81.189   0.419  -0.585
  422    HA   PHE  52           HA       PHE  52  82.994  -1.676  -1.580
  423   1HB   PHE  52          2HB       PHE  52  81.563  -3.538  -1.059
  424   2HB   PHE  52          1HB       PHE  52  81.740  -2.610   0.425
  425    HD1  PHE  52           HD1      PHE  52  79.427  -4.072  -1.910
  426    HD2  PHE  52           HD2      PHE  52  79.852  -0.822   0.959
  427    HE1  PHE  52           HE1      PHE  52  76.928  -3.847  -1.798
  428    HE2  PHE  52           HE2      PHE  52  77.347  -0.598   1.072
  429    HZ   PHE  52           HZ       PHE  52  75.887  -2.112  -0.315
  430    H    THR  53           H        THR  53  81.841  -2.887  -3.465
  431    HA   THR  53           HA       THR  53  80.138  -0.956  -5.006
  432    HB   THR  53           HB       THR  53  81.838  -3.302  -5.919
  433    HG1  THR  53           HG1      THR  53  83.381  -1.920  -5.676
  434   1HG2  THR  53          1HG2      THR  53  80.285  -1.164  -7.389
  435   2HG2  THR  53          2HG2      THR  53  80.096  -2.913  -7.514
  436   3HG2  THR  53          3HG2      THR  53  81.541  -2.134  -8.159
  437    H    ALA  54           H        ALA  54  78.116  -1.680  -5.703
  438    HA   ALA  54           HA       ALA  54  77.338  -4.502  -5.092
  439   1HB   ALA  54          1HB       ALA  54  75.390  -2.388  -4.413
  440   2HB   ALA  54          2HB       ALA  54  76.862  -2.356  -3.445
  441   3HB   ALA  54          3HB       ALA  54  75.866  -3.810  -3.487
  442    H    ARG  55           H        ARG  55  75.728  -5.327  -6.442
  443    HA   ARG  55           HA       ARG  55  75.008  -3.701  -8.828
  444   1HB   ARG  55          2HB       ARG  55  75.938  -6.083  -8.877
  445   2HB   ARG  55          1HB       ARG  55  74.392  -6.600  -8.202
  446   1HG   ARG  55          2HG       ARG  55  73.249  -5.460 -10.133
  447   2HG   ARG  55          1HG       ARG  55  74.840  -5.176 -10.838
  448   1HD   ARG  55          2HD       ARG  55  75.238  -7.691 -10.675
  449   2HD   ARG  55          1HD       ARG  55  73.512  -7.844 -10.294
  450    HE   ARG  55           HE       ARG  55  74.035  -6.192 -12.650
  451   1HH1  ARG  55          1HH1      ARG  55  73.481  -9.461 -11.492
  452   2HH1  ARG  55          2HH1      ARG  55  72.925 -10.011 -13.034
  453   1HH2  ARG  55          1HH2      ARG  55  73.308  -6.960 -14.613
  454   2HH2  ARG  55          2HH2      ARG  55  72.827  -8.616 -14.778
  455    H    VAL  56           H        VAL  56  72.845  -3.216  -9.307
  456    HA   VAL  56           HA       VAL  56  70.949  -3.171  -7.073
  457    HB   VAL  56           HB       VAL  56  70.800  -2.352  -9.995
  458   1HG1  VAL  56          1HG1      VAL  56  68.648  -2.731  -8.247
  459   2HG1  VAL  56          2HG1      VAL  56  68.643  -1.736  -9.704
  460   3HG1  VAL  56          3HG1      VAL  56  68.978  -1.002  -8.136
  461   1HG2  VAL  56          1HG2      VAL  56  71.584  -0.288  -9.338
  462   2HG2  VAL  56          2HG2      VAL  56  72.377  -1.271  -8.107
  463   3HG2  VAL  56          3HG2      VAL  56  70.881  -0.421  -7.726
  464    H    GLY  57           H        GLY  57  69.536  -4.759  -6.657
  465   1HA   GLY  57          2HA       GLY  57  69.000  -6.826  -8.735
  466   2HA   GLY  57          1HA       GLY  57  68.765  -7.051  -7.001
  467    H    GLU  58           H        GLU  58  66.605  -7.808  -7.980
  468    HA   GLU  58           HA       GLU  58  64.682  -5.957  -9.023
  469   1HB   GLU  58          2HB       GLU  58  64.646  -8.518  -8.918
  470   2HB   GLU  58          1HB       GLU  58  64.136  -8.344  -7.238
  471   1HG   GLU  58          2HG       GLU  58  62.222  -6.929  -8.020
  472   2HG   GLU  58          1HG       GLU  58  62.697  -7.267  -9.680
  473    H    GLN  59           H        GLN  59  62.912  -4.930  -7.881
  474    HA   GLN  59           HA       GLN  59  62.037  -3.540  -6.199
  475   1HB   GLN  59          2HB       GLN  59  63.237  -5.763  -4.520
  476   2HB   GLN  59          1HB       GLN  59  62.099  -4.559  -3.918
  477   1HG   GLN  59          2HG       GLN  59  61.546  -6.463  -6.212
  478   2HG   GLN  59          1HG       GLN  59  60.975  -6.688  -4.562
  479   1HE2  GLN  59          1HE2      GLN  59  59.702  -5.848  -7.385
  480   2HE2  GLN  59          2HE2      GLN  59  58.639  -4.608  -6.924
  481    H    GLY  60           H        GLY  60  65.109  -3.357  -6.975
  482   1HA   GLY  60          2HA       GLY  60  66.682  -1.688  -6.471
  483   2HA   GLY  60          1HA       GLY  60  65.522  -1.050  -5.309
  484    H    SER  61           H        SER  61  66.458  -4.373  -4.923
  485    HA   SER  61           HA       SER  61  67.482  -3.807  -2.259
  486   1HB   SER  61          2HB       SER  61  67.481  -6.356  -3.908
  487   2HB   SER  61          1HB       SER  61  67.652  -6.251  -2.159
  488    HG   SER  61           HG       SER  61  65.419  -6.189  -3.699
  489    H    VAL  62           H        VAL  62  69.618  -4.012  -1.532
  490    HA   VAL  62           HA       VAL  62  71.729  -4.765  -3.488
  491    HB   VAL  62           HB       VAL  62  71.520  -2.307  -3.504
  492   1HG1  VAL  62          1HG1      VAL  62  71.941  -1.007  -1.464
  493   2HG1  VAL  62          2HG1      VAL  62  72.094  -2.497  -0.533
  494   3HG1  VAL  62          3HG1      VAL  62  70.541  -2.059  -1.243
  495   1HG2  VAL  62          1HG2      VAL  62  73.964  -3.250  -1.973
  496   2HG2  VAL  62          2HG2      VAL  62  73.847  -1.763  -2.914
  497   3HG2  VAL  62          3HG2      VAL  62  73.765  -3.327  -3.724
  498    H    ILE  63           H        ILE  63  73.511  -5.808  -2.474
  499    HA   ILE  63           HA       ILE  63  72.976  -6.638   0.349
  500    HB   ILE  63           HB       ILE  63  74.671  -7.915  -1.826
  501   1HG1  ILE  63          2HG1      ILE  63  72.321  -7.853  -2.538
  502   2HG1  ILE  63          1HG1      ILE  63  72.767  -9.498  -2.097
  503   1HG2  ILE  63          1HG2      ILE  63  74.963  -9.716  -0.410
  504   2HG2  ILE  63          2HG2      ILE  63  73.477  -9.396   0.483
  505   3HG2  ILE  63          3HG2      ILE  63  74.908  -8.408   0.770
  506   1HD1  ILE  63          1HD1      ILE  63  71.834  -8.276   0.283
  507   2HD1  ILE  63          2HD1      ILE  63  71.030  -9.527  -0.665
  508   3HD1  ILE  63          3HD1      ILE  63  70.694  -7.827  -0.986
  509    H    ILE  64           H        ILE  64  74.328  -5.831   1.890
  510    HA   ILE  64           HA       ILE  64  76.929  -4.599   1.229
  511    HB   ILE  64           HB       ILE  64  75.533  -5.248   3.854
  512   1HG1  ILE  64          2HG1      ILE  64  75.733  -2.615   2.358
  513   2HG1  ILE  64          1HG1      ILE  64  74.322  -3.670   2.307
  514   1HG2  ILE  64          1HG2      ILE  64  77.802  -3.312   3.299
  515   2HG2  ILE  64          2HG2      ILE  64  78.018  -4.910   4.012
  516   3HG2  ILE  64          3HG2      ILE  64  77.088  -3.681   4.870
  517   1HD1  ILE  64          1HD1      ILE  64  74.095  -3.493   4.757
  518   2HD1  ILE  64          2HD1      ILE  64  74.031  -1.902   4.001
  519   3HD1  ILE  64          3HD1      ILE  64  75.504  -2.435   4.811
  520    HA   PRO  65           HA       PRO  65  79.185  -8.428   1.599
  521   1HB   PRO  65          2HB       PRO  65  81.640  -7.467   2.320
  522   2HB   PRO  65          1HB       PRO  65  80.998  -7.304   0.670
  523   1HG   PRO  65          2HG       PRO  65  80.895  -5.328   2.923
  524   2HG   PRO  65          1HG       PRO  65  81.448  -5.079   1.253
  525   1HD   PRO  65          2HD       PRO  65  79.006  -4.336   1.950
  526   2HD   PRO  65          1HD       PRO  65  79.266  -5.165   0.393
  527    H    LYS  66           H        LYS  66  79.241  -9.862   3.293
  528    HA   LYS  66           HA       LYS  66  78.534  -9.231   5.956
  529   1HB   LYS  66          2HB       LYS  66  79.256 -11.548   6.412
  530   2HB   LYS  66          1HB       LYS  66  78.394 -11.456   4.878
  531   1HG   LYS  66          2HG       LYS  66  80.602 -11.311   3.702
  532   2HG   LYS  66          1HG       LYS  66  81.401 -11.554   5.256
  533   1HD   LYS  66          2HD       LYS  66  80.042 -13.693   5.488
  534   2HD   LYS  66          1HD       LYS  66  79.572 -13.478   3.802
  535   1HE   LYS  66          2HE       LYS  66  81.485 -14.896   3.701
  536   2HE   LYS  66          1HE       LYS  66  82.130 -13.282   3.339
  537   1HZ   LYS  66          1HZ       LYS  66  83.350 -14.513   5.128
  538   2HZ   LYS  66          2HZ       LYS  66  81.953 -14.392   6.086
  539   3HZ   LYS  66          3HZ       LYS  66  82.769 -12.987   5.590
  540    H    ALA  67           H        ALA  67  81.716  -9.378   4.447
  541    HA   ALA  67           HA       ALA  67  83.379  -9.428   6.755
  542   1HB   ALA  67          1HB       ALA  67  84.206  -9.744   4.485
  543   2HB   ALA  67          2HB       ALA  67  85.031  -8.353   5.186
  544   3HB   ALA  67          3HB       ALA  67  83.712  -8.111   4.040
  545    H    LEU  68           H        LEU  68  81.809  -6.710   5.101
  546    HA   LEU  68           HA       LEU  68  82.988  -4.678   6.844
  547   1HB   LEU  68          2HB       LEU  68  80.718  -4.702   4.832
  548   2HB   LEU  68          1HB       LEU  68  81.268  -3.243   5.655
  549    HG   LEU  68           HG       LEU  68  82.988  -5.029   3.898
  550   1HD1  LEU  68          1HD1      LEU  68  82.401  -2.168   3.279
  551   2HD1  LEU  68          2HD1      LEU  68  81.118  -3.342   2.984
  552   3HD1  LEU  68          3HD1      LEU  68  82.679  -3.520   2.181
  553   1HD2  LEU  68          1HD2      LEU  68  84.532  -2.955   4.120
  554   2HD2  LEU  68          2HD2      LEU  68  84.451  -4.057   5.495
  555   3HD2  LEU  68          3HD2      LEU  68  83.549  -2.543   5.526
  556    H    ARG  69           H        ARG  69  79.976  -6.568   6.777
  557    HA   ARG  69           HA       ARG  69  78.439  -5.111   8.696
  558   1HB   ARG  69          2HB       ARG  69  78.697  -8.124   8.380
  559   2HB   ARG  69          1HB       ARG  69  77.328  -7.270   9.076
  560   1HG   ARG  69          2HG       ARG  69  77.015  -6.148   6.822
  561   2HG   ARG  69          1HG       ARG  69  78.218  -7.273   6.186
  562   1HD   ARG  69          2HD       ARG  69  76.687  -9.068   7.440
  563   2HD   ARG  69          1HD       ARG  69  75.445  -7.835   7.157
  564    HE   ARG  69           HE       ARG  69  76.652  -7.966   4.711
  565   1HH1  ARG  69          1HH1      ARG  69  75.418 -10.472   6.844
  566   2HH1  ARG  69          2HH1      ARG  69  75.097 -11.552   5.534
  567   1HH2  ARG  69          1HH2      ARG  69  76.205  -9.408   3.070
  568   2HH2  ARG  69          2HH2      ARG  69  75.534 -10.961   3.428
  569    H    ASP  70           H        ASP  70  80.803  -7.735   9.132
  570    HA   ASP  70           HA       ASP  70  80.540  -7.907  11.990
  571   1HB   ASP  70          2HB       ASP  70  81.416  -9.654  10.410
  572   2HB   ASP  70          1HB       ASP  70  82.877  -8.683  10.214
  573    H    VAL  71           H        VAL  71  83.039  -6.368   9.936
  574    HA   VAL  71           HA       VAL  71  84.697  -5.394  12.044
  575    HB   VAL  71           HB       VAL  71  84.107  -4.341   9.253
  576   1HG1  VAL  71          1HG1      VAL  71  85.210  -2.614  10.606
  577   2HG1  VAL  71          2HG1      VAL  71  86.328  -3.256   9.401
  578   3HG1  VAL  71          3HG1      VAL  71  86.458  -3.767  11.084
  579   1HG2  VAL  71          1HG2      VAL  71  85.836  -5.750   8.505
  580   2HG2  VAL  71          2HG2      VAL  71  84.998  -6.750   9.694
  581   3HG2  VAL  71          3HG2      VAL  71  86.506  -5.942  10.125
  582    H    ILE  72           H        ILE  72  81.861  -3.966  10.477
  583    HA   ILE  72           HA       ILE  72  82.103  -1.426  11.898
  584    HB   ILE  72           HB       ILE  72  79.907  -2.640  10.181
  585   1HG1  ILE  72          2HG1      ILE  72  82.110  -0.681   9.454
  586   2HG1  ILE  72          1HG1      ILE  72  82.163  -2.407   9.099
  587   1HG2  ILE  72          1HG2      ILE  72  80.370   0.307  10.509
  588   2HG2  ILE  72          2HG2      ILE  72  79.474  -0.545  11.761
  589   3HG2  ILE  72          3HG2      ILE  72  78.885  -0.549  10.103
  590   1HD1  ILE  72          1HD1      ILE  72  81.305  -1.498   7.113
  591   2HD1  ILE  72          2HD1      ILE  72  80.328  -0.306   7.972
  592   3HD1  ILE  72          3HD1      ILE  72  79.848  -2.006   7.970
  593    H    GLY  73           H        GLY  73  80.598  -4.496  12.615
  594   1HA   GLY  73          2HA       GLY  73  79.558  -5.150  14.622
  595   2HA   GLY  73          1HA       GLY  73  79.787  -3.505  15.217
  596    H    ILE  74           H        ILE  74  78.084  -4.364  12.238
  597    HA   ILE  74           HA       ILE  74  75.796  -2.741  13.130
  598    HB   ILE  74           HB       ILE  74  76.375  -4.213  10.536
  599   1HG1  ILE  74          2HG1      ILE  74  78.127  -2.564  11.069
  600   2HG1  ILE  74          1HG1      ILE  74  77.148  -2.005   9.717
  601   1HG2  ILE  74          1HG2      ILE  74  74.217  -2.368  11.446
  602   2HG2  ILE  74          2HG2      ILE  74  74.148  -3.698  10.289
  603   3HG2  ILE  74          3HG2      ILE  74  74.831  -2.144   9.807
  604   1HD1  ILE  74          1HD1      ILE  74  77.476  -0.841  12.399
  605   2HD1  ILE  74          2HD1      ILE  74  75.792  -0.970  11.888
  606   3HD1  ILE  74          3HD1      ILE  74  76.948  -0.077  10.900
  607    H    LYS  75           H        LYS  75  73.699  -3.492  13.452
  608    HA   LYS  75           HA       LYS  75  73.289  -6.468  13.445
  609   1HB   LYS  75          2HB       LYS  75  72.736  -4.324  15.498
  610   2HB   LYS  75          1HB       LYS  75  71.886  -5.869  15.543
  611   1HG   LYS  75          2HG       LYS  75  73.762  -7.040  16.149
  612   2HG   LYS  75          1HG       LYS  75  74.841  -5.994  15.225
  613   1HD   LYS  75          2HD       LYS  75  74.691  -4.255  16.912
  614   2HD   LYS  75          1HD       LYS  75  73.467  -5.165  17.797
  615   1HE   LYS  75          2HE       LYS  75  76.159  -6.412  17.244
  616   2HE   LYS  75          1HE       LYS  75  75.937  -5.323  18.627
  617   1HZ   LYS  75          1HZ       LYS  75  74.009  -6.642  19.293
  618   2HZ   LYS  75          2HZ       LYS  75  75.418  -7.591  19.263
  619   3HZ   LYS  75          3HZ       LYS  75  74.281  -7.712  18.006
  620    HA   PRO  76           HA       PRO  76  69.499  -5.831  11.225
  621   1HB   PRO  76          2HB       PRO  76  68.087  -7.473  13.253
  622   2HB   PRO  76          1HB       PRO  76  68.225  -7.718  11.502
  623   1HG   PRO  76          2HG       PRO  76  69.561  -9.218  13.290
  624   2HG   PRO  76          1HG       PRO  76  70.190  -8.851  11.678
  625   1HD   PRO  76          2HD       PRO  76  71.028  -7.788  14.308
  626   2HD   PRO  76          1HD       PRO  76  71.961  -7.989  12.811
  627    H    GLY  77           H        GLY  77  68.016  -4.179  11.319
  628   1HA   GLY  77          2HA       GLY  77  66.239  -2.906  12.271
  629   2HA   GLY  77          1HA       GLY  77  66.666  -3.541  13.858
  630    H    GLU  78           H        GLU  78  69.547  -2.510  12.516
  631    HA   GLU  78           HA       GLU  78  69.417   0.046  14.029
  632   1HB   GLU  78          2HB       GLU  78  71.488  -1.914  13.177
  633   2HB   GLU  78          1HB       GLU  78  72.001  -0.231  13.306
  634   1HG   GLU  78          2HG       GLU  78  70.997  -0.162  15.604
  635   2HG   GLU  78          1HG       GLU  78  70.683  -1.892  15.471
  636    H    VAL  79           H        VAL  79  69.418   1.986  13.001
  637    HA   VAL  79           HA       VAL  79  69.243   1.978  10.061
  638    HB   VAL  79           HB       VAL  79  67.595   3.105  11.512
  639   1HG1  VAL  79          1HG1      VAL  79  68.183   4.425  13.246
  640   2HG1  VAL  79          2HG1      VAL  79  69.236   5.410  12.232
  641   3HG1  VAL  79          3HG1      VAL  79  69.850   3.929  12.964
  642   1HG2  VAL  79          1HG2      VAL  79  67.809   4.022   9.307
  643   2HG2  VAL  79          2HG2      VAL  79  69.290   4.877   9.737
  644   3HG2  VAL  79          3HG2      VAL  79  67.746   5.396  10.410
  645    H    ILE  80           H        ILE  80  70.831   2.641   8.735
  646    HA   ILE  80           HA       ILE  80  73.140   4.193   9.846
  647    HB   ILE  80           HB       ILE  80  74.474   3.019   8.103
  648   1HG1  ILE  80          2HG1      ILE  80  71.922   1.479   7.537
  649   2HG1  ILE  80          1HG1      ILE  80  72.570   2.751   6.501
  650   1HG2  ILE  80          1HG2      ILE  80  72.960   0.817   9.449
  651   2HG2  ILE  80          2HG2      ILE  80  73.768   2.013  10.462
  652   3HG2  ILE  80          3HG2      ILE  80  74.701   1.060   9.310
  653   1HD1  ILE  80          1HD1      ILE  80  74.212   0.344   7.307
  654   2HD1  ILE  80          2HD1      ILE  80  74.529   1.490   6.003
  655   3HD1  ILE  80          3HD1      ILE  80  73.194   0.345   5.867
  656    H    GLU  81           H        GLU  81  74.067   5.728   8.294
  657    HA   GLU  81           HA       GLU  81  72.091   6.822   6.344
  658   1HB   GLU  81          2HB       GLU  81  73.079   8.283   8.128
  659   2HB   GLU  81          1HB       GLU  81  74.679   7.966   7.455
  660   1HG   GLU  81          2HG       GLU  81  73.913   8.902   5.275
  661   2HG   GLU  81          1HG       GLU  81  72.363   9.294   6.013
  662    H    VAL  82           H        VAL  82  72.496   6.526   4.206
  663    HA   VAL  82           HA       VAL  82  75.052   5.182   3.458
  664    HB   VAL  82           HB       VAL  82  72.242   5.104   2.301
  665   1HG1  VAL  82          1HG1      VAL  82  73.175   3.100   1.059
  666   2HG1  VAL  82          2HG1      VAL  82  74.781   3.626   1.564
  667   3HG1  VAL  82          3HG1      VAL  82  73.801   4.660   0.524
  668   1HG2  VAL  82          1HG2      VAL  82  73.807   3.371   4.195
  669   2HG2  VAL  82          2HG2      VAL  82  72.582   2.641   3.156
  670   3HG2  VAL  82          3HG2      VAL  82  72.128   3.899   4.304
  671    H    LEU  83           H        LEU  83  76.355   6.201   2.048
  672    HA   LEU  83           HA       LEU  83  75.302   8.532   0.478
  673   1HB   LEU  83          2HB       LEU  83  78.163   7.898   1.309
  674   2HB   LEU  83          1HB       LEU  83  77.563   9.423   0.668
  675    HG   LEU  83           HG       LEU  83  76.775   8.203   3.333
  676   1HD1  LEU  83          1HD1      LEU  83  78.141   9.898   4.339
  677   2HD1  LEU  83          2HD1      LEU  83  78.401  10.697   2.788
  678   3HD1  LEU  83          3HD1      LEU  83  79.132   9.121   3.102
  679   1HD2  LEU  83          1HD2      LEU  83  75.641  10.365   3.695
  680   2HD2  LEU  83          2HD2      LEU  83  74.984   9.534   2.285
  681   3HD2  LEU  83          3HD2      LEU  83  76.103  10.881   2.073
  682    H    LEU  84           H        LEU  84  75.392   8.260  -1.751
  683    HA   LEU  84           HA       LEU  84  76.709   5.900  -2.938
  684   1HB   LEU  84          2HB       LEU  84  74.965   8.172  -3.820
  685   2HB   LEU  84          1HB       LEU  84  75.896   7.292  -5.038
  686    HG   LEU  84           HG       LEU  84  74.403   5.677  -3.022
  687   1HD1  LEU  84          1HD1      LEU  84  72.611   5.994  -5.168
  688   2HD1  LEU  84          2HD1      LEU  84  73.122   7.632  -4.764
  689   3HD1  LEU  84          3HD1      LEU  84  72.406   6.604  -3.527
  690   1HD2  LEU  84          1HD2      LEU  84  75.420   5.478  -5.826
  691   2HD2  LEU  84          2HD2      LEU  84  74.007   4.508  -5.402
  692   3HD2  LEU  84          3HD2      LEU  84  75.516   4.304  -4.511
  693    H    LEU  85           H        LEU  85  78.632   5.966  -4.102
  694    HA   LEU  85           HA       LEU  85  80.189   8.511  -3.926
  695   1HB   LEU  85          2HB       LEU  85  80.748   5.597  -3.626
  696   2HB   LEU  85          1HB       LEU  85  82.045   6.603  -4.279
  697    HG   LEU  85           HG       LEU  85  80.538   7.403  -1.790
  698   1HD1  LEU  85          1HD1      LEU  85  82.129   6.263  -0.425
  699   2HD1  LEU  85          2HD1      LEU  85  83.148   5.874  -1.811
  700   3HD1  LEU  85          3HD1      LEU  85  81.588   5.075  -1.611
  701   1HD2  LEU  85          1HD2      LEU  85  83.218   8.084  -3.030
  702   2HD2  LEU  85          2HD2      LEU  85  82.779   8.550  -1.387
  703   3HD2  LEU  85          3HD2      LEU  85  81.854   9.167  -2.756
  704    H    GLY  86           H        GLY  86  79.212   5.883  -6.109
  705   1HA   GLY  86          2HA       GLY  86  79.690   7.547  -8.457
  706   2HA   GLY  86          1HA       GLY  86  80.925   6.309  -8.282
  707    H    HIS  87           H        HIS  87  79.793   5.839 -10.495
  708    HA   HIS  87           HA       HIS  87  77.841   3.632 -10.037
  709   1HB   HIS  87          2HB       HIS  87  76.406   4.570 -11.849
  710   2HB   HIS  87          1HB       HIS  87  76.531   5.665 -10.479
  711    HD1  HIS  87           HD1      HIS  87  77.441   5.319 -14.077
  712    HD2  HIS  87           HD2      HIS  87  78.135   8.011 -10.970
  713    HE1  HIS  87           HE1      HIS  87  78.389   7.412 -15.142
  714    H    TYR  88           H        TYR  88  77.829   2.072 -11.788
  715    HA   TYR  88           HA       TYR  88  79.855   2.479 -13.946
  716   1HB   TYR  88          2HB       TYR  88  79.530   0.118 -12.070
  717   2HB   TYR  88          1HB       TYR  88  80.524   0.072 -13.526
  718    HD1  TYR  88           HD1      TYR  88  80.198   1.423 -10.090
  719    HD2  TYR  88           HD2      TYR  88  82.583   1.458 -13.735
  720    HE1  TYR  88           HE1      TYR  88  82.089   2.516  -8.843
  721    HE2  TYR  88           HE2      TYR  88  84.475   2.551 -12.489
  722    HH   TYR  88           HH       TYR  88  84.818   3.899 -10.452
  723    H    LYS  89           H        LYS  89  79.191   1.642 -15.931
  724    HA   LYS  89           HA       LYS  89  76.465   0.406 -16.017
  725   1HB   LYS  89          2HB       LYS  89  76.463   1.312 -18.342
  726   2HB   LYS  89          1HB       LYS  89  76.734   2.572 -17.141
  727   1HG   LYS  89          2HG       LYS  89  78.970   2.836 -17.719
  728   2HG   LYS  89          1HG       LYS  89  79.115   1.192 -18.340
  729   1HD   LYS  89          2HD       LYS  89  79.098   2.512 -20.292
  730   2HD   LYS  89          1HD       LYS  89  77.429   1.955 -20.159
  731   1HE   LYS  89          2HE       LYS  89  76.956   4.195 -20.396
  732   2HE   LYS  89          1HE       LYS  89  77.326   4.247 -18.661
  733   1HZ   LYS  89          1HZ       LYS  89  79.309   4.586 -20.848
  734   2HZ   LYS  89          2HZ       LYS  89  79.639   4.656 -19.183
  735   3HZ   LYS  89          3HZ       LYS  89  78.671   5.846 -19.911
  736    HA   PRO  90           HA       PRO  90  77.914  -3.472 -17.565
  737   1HB   PRO  90          2HB       PRO  90  76.135  -3.004 -19.940
  738   2HB   PRO  90          1HB       PRO  90  76.239  -4.424 -18.876
  739   1HG   PRO  90          2HG       PRO  90  74.231  -2.789 -18.575
  740   2HG   PRO  90          1HG       PRO  90  75.103  -3.348 -17.134
  741   1HD   PRO  90          2HD       PRO  90  75.314  -0.714 -18.554
  742   2HD   PRO  90          1HD       PRO  90  75.219  -1.048 -16.806
  743    H    ARG  91           H        ARG  91  79.571  -4.195 -18.939
  744    HA   ARG  91           HA       ARG  91  80.438  -2.324 -21.123
  745   1HB   ARG  91          2HB       ARG  91  82.029  -3.959 -19.120
  746   2HB   ARG  91          1HB       ARG  91  82.749  -3.035 -20.439
  747   1HG   ARG  91          2HG       ARG  91  81.668  -0.975 -19.536
  748   2HG   ARG  91          1HG       ARG  91  81.074  -1.920 -18.170
  749   1HD   ARG  91          2HD       ARG  91  84.006  -1.571 -18.904
  750   2HD   ARG  91          1HD       ARG  91  83.175  -0.752 -17.568
  751    HE   ARG  91           HE       ARG  91  83.990  -3.554 -17.606
  752   1HH1  ARG  91          1HH1      ARG  91  81.671  -1.268 -16.296
  753   2HH1  ARG  91          2HH1      ARG  91  81.333  -2.258 -14.920
  754   1HH2  ARG  91          1HH2      ARG  91  83.511  -4.789 -15.809
  755   2HH2  ARG  91          2HH2      ARG  91  82.359  -4.225 -14.646
  756    H    ASN  92           H        ASN  92  81.231  -3.315 -23.027
  757    HA   ASN  92           HA       ASN  92  80.147  -5.843 -23.806
  758   1HB   ASN  92          2HB       ASN  92  80.937  -3.856 -25.218
  759   2HB   ASN  92          1HB       ASN  92  82.575  -4.472 -24.991
  760   1HD2  ASN  92          1HD2      ASN  92  83.237  -5.862 -26.627
  761   2HD2  ASN  92          2HD2      ASN  92  82.207  -6.827 -27.569
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1  85.756  13.874  -0.305
    2   2H    MET   1          2H        MET   1  84.137  13.653   0.163
    3   3H    MET   1          3H        MET   1  84.628  15.121  -0.536
    4    HA   MET   1           HA       MET   1  85.172  13.894  -2.616
    5   1HB   MET   1          2HB       MET   1  84.034  11.728  -0.841
    6   2HB   MET   1          1HB       MET   1  84.060  11.563  -2.598
    7   1HG   MET   1          2HG       MET   1  86.511  11.969  -2.574
    8   2HG   MET   1          1HG       MET   1  86.464  12.038  -0.813
    9   1HE   MET   1          1HE       MET   1  88.337  10.684  -1.495
   10   2HE   MET   1          2HE       MET   1  88.318   9.062  -2.180
   11   3HE   MET   1          3HE       MET   1  88.130   9.278  -0.441
   12    H    ASP   2           H        ASP   2  83.170  12.909  -3.993
   13    HA   ASP   2           HA       ASP   2  80.850  14.713  -3.434
   14   1HB   ASP   2          2HB       ASP   2  82.230  14.740  -5.600
   15   2HB   ASP   2          1HB       ASP   2  81.503  13.172  -5.959
   16    H    VAL   3           H        VAL   3  78.729  13.840  -3.388
   17    HA   VAL   3           HA       VAL   3  78.530  10.865  -3.439
   18    HB   VAL   3           HB       VAL   3  78.402  12.101  -1.189
   19   1HG1  VAL   3          1HG1      VAL   3  75.597  12.777  -2.100
   20   2HG1  VAL   3          2HG1      VAL   3  76.911  13.958  -2.089
   21   3HG1  VAL   3          3HG1      VAL   3  76.373  13.224  -0.577
   22   1HG2  VAL   3          1HG2      VAL   3  77.661   9.828  -1.336
   23   2HG2  VAL   3          2HG2      VAL   3  76.180  10.299  -2.169
   24   3HG2  VAL   3          3HG2      VAL   3  76.404  10.709  -0.468
   25    H    LEU   4           H        LEU   4  76.904  10.058  -4.730
   26    HA   LEU   4           HA       LEU   4  75.590  11.943  -6.554
   27   1HB   LEU   4          2HB       LEU   4  75.375   8.923  -6.386
   28   2HB   LEU   4          1HB       LEU   4  75.057   9.926  -7.795
   29    HG   LEU   4           HG       LEU   4  77.746   9.418  -6.474
   30   1HD1  LEU   4          1HD1      LEU   4  78.204   8.707  -8.935
   31   2HD1  LEU   4          2HD1      LEU   4  76.447   8.628  -9.069
   32   3HD1  LEU   4          3HD1      LEU   4  77.290   7.615  -7.895
   33   1HD2  LEU   4          1HD2      LEU   4  76.868  11.533  -8.409
   34   2HD2  LEU   4          2HD2      LEU   4  78.452  10.796  -8.652
   35   3HD2  LEU   4          3HD2      LEU   4  78.086  11.619  -7.131
   36    H    ALA   5           H        ALA   5  74.714  10.246  -3.646
   37    HA   ALA   5           HA       ALA   5  72.149  11.555  -3.513
   38   1HB   ALA   5          1HB       ALA   5  72.094   9.421  -5.178
   39   2HB   ALA   5          2HB       ALA   5  70.707   9.885  -4.192
   40   3HB   ALA   5          3HB       ALA   5  71.786   8.600  -3.648
   41    H    LYS   6           H        LYS   6  71.132  11.146  -1.427
   42    HA   LYS   6           HA       LYS   6  72.761   9.501   0.486
   43   1HB   LYS   6          2HB       LYS   6  73.306  11.928   0.588
   44   2HB   LYS   6          1HB       LYS   6  71.606  12.283   0.893
   45   1HG   LYS   6          2HG       LYS   6  71.771  10.737   2.911
   46   2HG   LYS   6          1HG       LYS   6  73.517  10.746   2.664
   47   1HD   LYS   6          2HD       LYS   6  71.868  13.266   2.976
   48   2HD   LYS   6          1HD       LYS   6  72.684  12.468   4.320
   49   1HE   LYS   6          2HE       LYS   6  74.764  13.160   3.632
   50   2HE   LYS   6          1HE       LYS   6  74.357  12.994   1.912
   51   1HZ   LYS   6          1HZ       LYS   6  74.536  15.339   2.653
   52   2HZ   LYS   6          2HZ       LYS   6  73.225  15.078   3.702
   53   3HZ   LYS   6          3HZ       LYS   6  73.011  14.950   2.021
   54    H    PHE   7           H        PHE   7  71.450   8.079   1.581
   55    HA   PHE   7           HA       PHE   7  68.688   8.886   2.300
   56   1HB   PHE   7          2HB       PHE   7  67.739   6.898   1.197
   57   2HB   PHE   7          1HB       PHE   7  68.591   7.907   0.033
   58    HD1  PHE   7           HD1      PHE   7  68.267   4.592   1.407
   59    HD2  PHE   7           HD2      PHE   7  71.109   7.306  -0.474
   60    HE1  PHE   7           HE1      PHE   7  69.715   2.635   0.769
   61    HE2  PHE   7           HE2      PHE   7  72.558   5.349  -1.105
   62    HZ   PHE   7           HZ       PHE   7  71.861   3.011  -0.478
   63    H    HIS   8           H        HIS   8  67.709   7.325   3.861
   64    HA   HIS   8           HA       HIS   8  69.840   6.018   5.527
   65   1HB   HIS   8          2HB       HIS   8  67.145   7.259   6.183
   66   2HB   HIS   8          1HB       HIS   8  68.216   6.516   7.371
   67    HD1  HIS   8           HD1      HIS   8  67.852   9.543   5.191
   68    HD2  HIS   8           HD2      HIS   8  70.573   8.022   7.959
   69    HE1  HIS   8           HE1      HIS   8  69.451  11.430   5.734
   70    H    THR   9           H        THR   9  69.567   3.887   6.118
   71    HA   THR   9           HA       THR   9  66.945   2.552   5.824
   72    HB   THR   9           HB       THR   9  68.110   2.494   3.584
   73    HG1  THR   9           HG1      THR   9  67.818   0.248   3.344
   74   1HG2  THR   9          1HG2      THR   9  70.130   0.811   5.095
   75   2HG2  THR   9          2HG2      THR   9  70.435   2.392   4.370
   76   3HG2  THR   9          3HG2      THR   9  70.075   1.004   3.341
   77    H    THR  10           H        THR  10  67.032   0.328   6.847
   78    HA   THR  10           HA       THR  10  69.241   0.170   8.861
   79    HB   THR  10           HB       THR  10  66.818   0.559   9.612
   80    HG1  THR  10           HG1      THR  10  67.516  -0.284  11.368
   81   1HG2  THR  10          1HG2      THR  10  65.171  -0.935   9.198
   82   2HG2  THR  10          2HG2      THR  10  66.231  -2.305   9.545
   83   3HG2  THR  10          3HG2      THR  10  66.236  -1.569   7.940
   84    H    VAL  11           H        VAL  11  69.983  -2.020   9.399
   85    HA   VAL  11           HA       VAL  11  70.409  -3.598   6.984
   86    HB   VAL  11           HB       VAL  11  71.180  -4.061   9.888
   87   1HG1  VAL  11          1HG1      VAL  11  72.889  -5.551   9.005
   88   2HG1  VAL  11          2HG1      VAL  11  72.414  -5.176   7.349
   89   3HG1  VAL  11          3HG1      VAL  11  71.318  -6.077   8.397
   90   1HG2  VAL  11          1HG2      VAL  11  72.425  -2.190   9.519
   91   2HG2  VAL  11          2HG2      VAL  11  72.184  -2.261   7.773
   92   3HG2  VAL  11          3HG2      VAL  11  73.439  -3.241   8.531
   93    H    HIS  12           H        HIS  12  69.426  -5.478   6.412
   94    HA   HIS  12           HA       HIS  12  67.543  -6.770   8.354
   95   1HB   HIS  12          2HB       HIS  12  67.437  -6.259   5.398
   96   2HB   HIS  12          1HB       HIS  12  66.608  -7.675   6.052
   97    HD1  HIS  12           HD1      HIS  12  66.872  -3.964   6.965
   98    HD2  HIS  12           HD2      HIS  12  64.052  -7.031   6.842
   99    HE1  HIS  12           HE1      HIS  12  64.678  -2.948   7.714
  100    H    ARG  13           H        ARG  13  67.304  -9.177   7.777
  101    HA   ARG  13           HA       ARG  13  69.581 -10.617   8.360
  102   1HB   ARG  13          2HB       ARG  13  67.174 -11.308   6.666
  103   2HB   ARG  13          1HB       ARG  13  68.317 -12.529   7.234
  104   1HG   ARG  13          2HG       ARG  13  67.900 -11.761   9.577
  105   2HG   ARG  13          1HG       ARG  13  66.672 -10.655   8.961
  106   1HD   ARG  13          2HD       ARG  13  65.496 -12.649   7.940
  107   2HD   ARG  13          1HD       ARG  13  66.641 -13.687   8.813
  108    HE   ARG  13           HE       ARG  13  65.760 -12.024  10.800
  109   1HH1  ARG  13          1HH1      ARG  13  64.034 -13.927   8.407
  110   2HH1  ARG  13          2HH1      ARG  13  62.655 -14.129   9.429
  111   1HH2  ARG  13          1HH2      ARG  13  63.953 -12.320  12.073
  112   2HH2  ARG  13          2HH2      ARG  13  62.607 -13.233  11.476
  113    H    ILE  14           H        ILE  14  71.128 -11.835   7.174
  114    HA   ILE  14           HA       ILE  14  72.704 -12.250   5.482
  115    HB   ILE  14           HB       ILE  14  70.512 -11.277   3.619
  116   1HG1  ILE  14          2HG1      ILE  14  71.120 -14.134   4.421
  117   2HG1  ILE  14          1HG1      ILE  14  69.875 -13.171   5.221
  118   1HG2  ILE  14          1HG2      ILE  14  71.818 -13.143   2.234
  119   2HG2  ILE  14          2HG2      ILE  14  73.141 -12.645   3.288
  120   3HG2  ILE  14          3HG2      ILE  14  72.351 -11.462   2.246
  121   1HD1  ILE  14          1HD1      ILE  14  69.169 -12.707   2.672
  122   2HD1  ILE  14          2HD1      ILE  14  68.567 -14.100   3.573
  123   3HD1  ILE  14          3HD1      ILE  14  69.921 -14.290   2.460
  124    H    GLY  15           H        GLY  15  71.842  -9.204   6.417
  125   1HA   GLY  15          2HA       GLY  15  73.070  -7.206   6.233
  126   2HA   GLY  15          1HA       GLY  15  74.133  -8.013   5.086
  127    H    ARG  16           H        ARG  16  70.770  -8.260   4.321
  128    HA   ARG  16           HA       ARG  16  71.205  -6.685   1.887
  129   1HB   ARG  16          2HB       ARG  16  70.039  -8.872   1.948
  130   2HB   ARG  16          1HB       ARG  16  68.804  -8.180   2.998
  131   1HG   ARG  16          2HG       ARG  16  68.109  -6.633   1.263
  132   2HG   ARG  16          1HG       ARG  16  69.439  -7.142   0.223
  133   1HD   ARG  16          2HD       ARG  16  67.393  -8.283  -0.498
  134   2HD   ARG  16          1HD       ARG  16  68.470  -9.478   0.250
  135    HE   ARG  16           HE       ARG  16  66.976  -9.632   2.077
  136   1HH1  ARG  16          1HH1      ARG  16  66.210  -6.806   0.144
  137   2HH1  ARG  16          2HH1      ARG  16  64.758  -6.483   1.024
  138   1HH2  ARG  16          1HH2      ARG  16  65.091  -9.165   3.177
  139   2HH2  ARG  16          2HH2      ARG  16  64.131  -7.799   2.718
  140    H    ILE  17           H        ILE  17  70.196  -4.726   1.391
  141    HA   ILE  17           HA       ILE  17  68.289  -3.575   3.377
  142    HB   ILE  17           HB       ILE  17  69.448  -1.394   3.138
  143   1HG1  ILE  17          2HG1      ILE  17  71.609  -2.898   1.637
  144   2HG1  ILE  17          1HG1      ILE  17  70.356  -1.968   0.817
  145   1HG2  ILE  17          1HG2      ILE  17  71.312  -3.663   3.898
  146   2HG2  ILE  17          2HG2      ILE  17  70.115  -2.919   4.959
  147   3HG2  ILE  17          3HG2      ILE  17  71.492  -1.977   4.386
  148   1HD1  ILE  17          1HD1      ILE  17  72.761  -0.938   1.690
  149   2HD1  ILE  17          2HD1      ILE  17  71.669  -0.492   3.001
  150   3HD1  ILE  17          3HD1      ILE  17  71.320   0.019   1.347
  151    H    ILE  18           H        ILE  18  66.817  -1.989   2.371
  152    HA   ILE  18           HA       ILE  18  66.691  -2.228  -0.622
  153    HB   ILE  18           HB       ILE  18  64.449  -1.764   1.377
  154   1HG1  ILE  18          2HG1      ILE  18  65.352  -4.040   1.616
  155   2HG1  ILE  18          1HG1      ILE  18  63.771  -4.096   0.842
  156   1HG2  ILE  18          1HG2      ILE  18  64.606  -1.981  -1.614
  157   2HG2  ILE  18          2HG2      ILE  18  63.660  -0.869  -0.620
  158   3HG2  ILE  18          3HG2      ILE  18  63.156  -2.553  -0.785
  159   1HD1  ILE  18          1HD1      ILE  18  64.849  -5.425  -0.670
  160   2HD1  ILE  18          2HD1      ILE  18  66.437  -4.778  -0.253
  161   3HD1  ILE  18          3HD1      ILE  18  65.379  -3.883  -1.346
  162    H    ILE  19           H        ILE  19  66.899  -0.314  -1.703
  163    HA   ILE  19           HA       ILE  19  67.058   2.234  -0.231
  164    HB   ILE  19           HB       ILE  19  67.116   1.565  -3.208
  165   1HG1  ILE  19          2HG1      ILE  19  69.302   1.887  -1.110
  166   2HG1  ILE  19          1HG1      ILE  19  68.922   0.431  -2.015
  167   1HG2  ILE  19          1HG2      ILE  19  68.187   4.035  -1.802
  168   2HG2  ILE  19          2HG2      ILE  19  66.561   3.968  -2.481
  169   3HG2  ILE  19          3HG2      ILE  19  67.964   3.785  -3.534
  170   1HD1  ILE  19          1HD1      ILE  19  70.415   1.062  -3.573
  171   2HD1  ILE  19          2HD1      ILE  19  70.687   2.586  -2.727
  172   3HD1  ILE  19          3HD1      ILE  19  69.404   2.464  -3.933
  173    HA   PRO  20           HA       PRO  20  62.730   3.270  -0.791
  174   1HB   PRO  20          2HB       PRO  20  62.954   5.997  -0.931
  175   2HB   PRO  20          1HB       PRO  20  63.048   5.107   0.600
  176   1HG   PRO  20          2HG       PRO  20  65.290   6.034  -1.165
  177   2HG   PRO  20          1HG       PRO  20  65.090   6.261   0.585
  178   1HD   PRO  20          2HD       PRO  20  66.663   4.335  -0.297
  179   2HD   PRO  20          1HD       PRO  20  65.539   3.997   1.046
  180    H    ALA  21           H        ALA  21  61.474   3.627  -2.622
  181    HA   ALA  21           HA       ALA  21  62.611   3.457  -5.210
  182   1HB   ALA  21          1HB       ALA  21  60.406   2.847  -5.254
  183   2HB   ALA  21          2HB       ALA  21  60.137   4.547  -5.639
  184   3HB   ALA  21          3HB       ALA  21  59.970   3.983  -3.977
  185    H    GLY  22           H        GLY  22  61.915   6.267  -3.209
  186   1HA   GLY  22          2HA       GLY  22  61.890   8.257  -5.276
  187   2HA   GLY  22          1HA       GLY  22  62.262   8.565  -3.579
  188    H    THR  23           H        THR  23  64.541   6.988  -3.258
  189    HA   THR  23           HA       THR  23  66.580   8.694  -4.395
  190    HB   THR  23           HB       THR  23  66.731   6.007  -2.980
  191    HG1  THR  23           HG1      THR  23  65.713   7.842  -1.883
  192   1HG2  THR  23          1HG2      THR  23  68.779   7.887  -3.998
  193   2HG2  THR  23          2HG2      THR  23  68.908   6.164  -3.638
  194   3HG2  THR  23          3HG2      THR  23  69.015   7.347  -2.335
  195    H    ARG  24           H        ARG  24  65.391   5.428  -5.185
  196    HA   ARG  24           HA       ARG  24  67.354   4.647  -7.105
  197   1HB   ARG  24          2HB       ARG  24  64.372   4.172  -7.373
  198   2HB   ARG  24          1HB       ARG  24  65.675   3.137  -7.938
  199   1HG   ARG  24          2HG       ARG  24  66.295   3.090  -5.352
  200   2HG   ARG  24          1HG       ARG  24  64.587   3.479  -5.182
  201   1HD   ARG  24          2HD       ARG  24  64.331   1.508  -6.970
  202   2HD   ARG  24          1HD       ARG  24  65.858   0.994  -6.219
  203    HE   ARG  24           HE       ARG  24  64.368   1.608  -4.029
  204   1HH1  ARG  24          1HH1      ARG  24  63.602  -0.329  -6.855
  205   2HH1  ARG  24          2HH1      ARG  24  62.499  -1.329  -5.978
  206   1HH2  ARG  24          1HH2      ARG  24  62.956   0.282  -2.955
  207   2HH2  ARG  24          2HH2      ARG  24  62.136  -0.993  -3.795
  208    H    LYS  25           H        LYS  25  64.407   6.609  -7.475
  209    HA   LYS  25           HA       LYS  25  64.543   6.907 -10.328
  210   1HB   LYS  25          2HB       LYS  25  62.533   7.289  -8.958
  211   2HB   LYS  25          1HB       LYS  25  63.321   8.641  -8.149
  212   1HG   LYS  25          2HG       LYS  25  61.812   9.470  -9.900
  213   2HG   LYS  25          1HG       LYS  25  63.486   9.825 -10.329
  214   1HD   LYS  25          2HD       LYS  25  63.564   7.890 -11.798
  215   2HD   LYS  25          1HD       LYS  25  61.932   7.422 -11.320
  216   1HE   LYS  25          2HE       LYS  25  61.272   9.829 -12.140
  217   2HE   LYS  25          1HE       LYS  25  62.800   9.739 -13.039
  218   1HZ   LYS  25          1HZ       LYS  25  60.588   7.755 -13.109
  219   2HZ   LYS  25          2HZ       LYS  25  62.093   7.547 -13.868
  220   3HZ   LYS  25          3HZ       LYS  25  61.049   8.790 -14.371
  221    H    PHE  26           H        PHE  26  65.526   9.117  -7.722
  222    HA   PHE  26           HA       PHE  26  66.567  11.233  -9.300
  223   1HB   PHE  26          2HB       PHE  26  66.139  11.247  -6.847
  224   2HB   PHE  26          1HB       PHE  26  67.528  10.185  -6.615
  225    HD1  PHE  26           HD1      PHE  26  69.781  11.034  -6.578
  226    HD2  PHE  26           HD2      PHE  26  66.481  13.576  -7.857
  227    HE1  PHE  26           HE1      PHE  26  71.310  13.031  -6.556
  228    HE2  PHE  26           HE2      PHE  26  68.011  15.573  -7.833
  229    HZ   PHE  26           HZ       PHE  26  70.425  15.300  -7.184
  230    H    TYR  27           H        TYR  27  68.106   8.241  -8.207
  231    HA   TYR  27           HA       TYR  27  70.742   9.006  -9.274
  232   1HB   TYR  27          2HB       TYR  27  70.278   7.753  -7.153
  233   2HB   TYR  27          1HB       TYR  27  69.690   6.408  -8.114
  234    HD1  TYR  27           HD1      TYR  27  72.552   7.921  -6.582
  235    HD2  TYR  27           HD2      TYR  27  71.363   5.435  -9.951
  236    HE1  TYR  27           HE1      TYR  27  74.897   7.037  -6.766
  237    HE2  TYR  27           HE2      TYR  27  73.708   4.553 -10.131
  238    HH   TYR  27           HH       TYR  27  75.927   4.728  -7.760
  239    H    GLY  28           H        GLY  28  67.927   7.407 -10.551
  240   1HA   GLY  28          2HA       GLY  28  67.577   6.570 -12.719
  241   2HA   GLY  28          1HA       GLY  28  69.249   6.989 -13.095
  242    H    ILE  29           H        ILE  29  68.031   4.819 -10.539
  243    HA   ILE  29           HA       ILE  29  69.996   2.784 -11.373
  244    HB   ILE  29           HB       ILE  29  68.002   2.910  -9.079
  245   1HG1  ILE  29          2HG1      ILE  29  70.977   3.500  -9.146
  246   2HG1  ILE  29          1HG1      ILE  29  69.711   4.722  -9.120
  247   1HG2  ILE  29          1HG2      ILE  29  70.053   0.923  -9.924
  248   2HG2  ILE  29          2HG2      ILE  29  68.556   0.682  -9.025
  249   3HG2  ILE  29          3HG2      ILE  29  69.988   1.302  -8.202
  250   1HD1  ILE  29          1HD1      ILE  29  69.890   4.616  -6.865
  251   2HD1  ILE  29          2HD1      ILE  29  70.767   3.083  -6.924
  252   3HD1  ILE  29          3HD1      ILE  29  69.003   3.098  -7.000
  253    H    GLU  30           H        GLU  30  69.507   1.027 -12.553
  254    HA   GLU  30           HA       GLU  30  66.696   0.000 -12.559
  255   1HB   GLU  30          2HB       GLU  30  68.631   0.206 -14.896
  256   2HB   GLU  30          1HB       GLU  30  67.043  -0.559 -14.962
  257   1HG   GLU  30          2HG       GLU  30  66.002   1.604 -14.303
  258   2HG   GLU  30          1HG       GLU  30  67.595   2.357 -14.331
  259    H    GLN  31           H        GLN  31  66.647  -2.377 -12.918
  260    HA   GLN  31           HA       GLN  31  68.546  -3.838 -11.391
  261   1HB   GLN  31          2HB       GLN  31  66.619  -4.660 -13.585
  262   2HB   GLN  31          1HB       GLN  31  67.449  -5.810 -12.537
  263   1HG   GLN  31          2HG       GLN  31  66.425  -4.811 -10.560
  264   2HG   GLN  31          1HG       GLN  31  65.666  -3.565 -11.550
  265   1HE2  GLN  31          1HE2      GLN  31  63.799  -4.869 -10.185
  266   2HE2  GLN  31          2HE2      GLN  31  63.015  -6.067 -11.094
  267    H    GLY  32           H        GLY  32  70.458  -4.870 -11.914
  268   1HA   GLY  32          2HA       GLY  32  72.038  -5.918 -13.392
  269   2HA   GLY  32          1HA       GLY  32  71.239  -5.146 -14.758
  270    H    ASP  33           H        ASP  33  71.369  -2.534 -12.937
  271    HA   ASP  33           HA       ASP  33  73.878  -1.544 -14.087
  272   1HB   ASP  33          2HB       ASP  33  71.810  -0.417 -12.176
  273   2HB   ASP  33          1HB       ASP  33  73.166   0.516 -12.807
  274    H    PHE  34           H        PHE  34  75.666  -0.691 -12.760
  275    HA   PHE  34           HA       PHE  34  75.891  -2.028 -10.081
  276   1HB   PHE  34          2HB       PHE  34  77.904  -1.216 -12.195
  277   2HB   PHE  34          1HB       PHE  34  78.382  -1.677 -10.562
  278    HD1  PHE  34           HD1      PHE  34  76.920  -2.863 -13.770
  279    HD2  PHE  34           HD2      PHE  34  78.132  -3.992  -9.740
  280    HE1  PHE  34           HE1      PHE  34  76.765  -5.293 -14.403
  281    HE2  PHE  34           HE2      PHE  34  77.976  -6.421 -10.375
  282    HZ   PHE  34           HZ       PHE  34  77.293  -7.072 -12.706
  283    H    VAL  35           H        VAL  35  76.285  -0.690  -8.331
  284    HA   VAL  35           HA       VAL  35  76.986   2.163  -8.885
  285    HB   VAL  35           HB       VAL  35  75.389   2.806  -7.087
  286   1HG1  VAL  35          1HG1      VAL  35  74.808   2.282  -9.664
  287   2HG1  VAL  35          2HG1      VAL  35  73.587   2.837  -8.519
  288   3HG1  VAL  35          3HG1      VAL  35  73.724   1.119  -8.899
  289   1HG2  VAL  35          1HG2      VAL  35  74.800  -0.168  -7.101
  290   2HG2  VAL  35          2HG2      VAL  35  73.712   1.029  -6.395
  291   3HG2  VAL  35          3HG2      VAL  35  75.335   0.813  -5.735
  292    H    GLU  36           H        GLU  36  78.215   3.144  -7.121
  293    HA   GLU  36           HA       GLU  36  79.542   1.115  -5.347
  294   1HB   GLU  36          2HB       GLU  36  80.904   2.109  -7.208
  295   2HB   GLU  36          1HB       GLU  36  80.608   3.708  -6.525
  296   1HG   GLU  36          2HG       GLU  36  81.657   2.949  -4.390
  297   2HG   GLU  36          1HG       GLU  36  82.041   1.410  -5.161
  298    H    ILE  37           H        ILE  37  79.121   1.466  -3.230
  299    HA   ILE  37           HA       ILE  37  78.221   4.197  -2.401
  300    HB   ILE  37           HB       ILE  37  76.389   2.706  -3.111
  301   1HG1  ILE  37          2HG1      ILE  37  76.240   2.788  -0.110
  302   2HG1  ILE  37          1HG1      ILE  37  76.283   4.288  -1.035
  303   1HG2  ILE  37          1HG2      ILE  37  75.910   0.651  -1.793
  304   2HG2  ILE  37          2HG2      ILE  37  77.435   0.871  -0.935
  305   3HG2  ILE  37          3HG2      ILE  37  77.439   0.545  -2.668
  306   1HD1  ILE  37          1HD1      ILE  37  74.060   4.061  -1.336
  307   2HD1  ILE  37          2HD1      ILE  37  74.077   2.433  -0.663
  308   3HD1  ILE  37          3HD1      ILE  37  74.403   2.680  -2.378
  309    H    LYS  38           H        LYS  38  78.269   4.550  -0.070
  310    HA   LYS  38           HA       LYS  38  79.917   2.610   1.499
  311   1HB   LYS  38          2HB       LYS  38  81.176   4.621   0.559
  312   2HB   LYS  38          1HB       LYS  38  80.173   5.628   1.613
  313   1HG   LYS  38          2HG       LYS  38  80.947   4.376   3.576
  314   2HG   LYS  38          1HG       LYS  38  81.919   3.331   2.540
  315   1HD   LYS  38          2HD       LYS  38  83.182   5.346   1.764
  316   2HD   LYS  38          1HD       LYS  38  82.266   6.321   2.914
  317   1HE   LYS  38          2HE       LYS  38  83.158   4.299   4.541
  318   2HE   LYS  38          1HE       LYS  38  84.514   4.469   3.410
  319   1HZ   LYS  38          1HZ       LYS  38  83.185   6.677   4.893
  320   2HZ   LYS  38          2HZ       LYS  38  84.427   6.875   3.750
  321   3HZ   LYS  38          3HZ       LYS  38  84.732   6.059   5.208
  322    H    ILE  39           H        ILE  39  79.335   2.462   3.693
  323    HA   ILE  39           HA       ILE  39  76.877   3.985   4.507
  324    HB   ILE  39           HB       ILE  39  76.469   1.995   5.972
  325   1HG1  ILE  39          2HG1      ILE  39  78.709   0.666   4.429
  326   2HG1  ILE  39          1HG1      ILE  39  78.960   1.382   6.021
  327   1HG2  ILE  39          1HG2      ILE  39  75.212   1.677   4.105
  328   2HG2  ILE  39          2HG2      ILE  39  76.360   0.371   3.810
  329   3HG2  ILE  39          3HG2      ILE  39  76.575   1.929   3.012
  330   1HD1  ILE  39          1HD1      ILE  39  76.997  -0.051   6.817
  331   2HD1  ILE  39          2HD1      ILE  39  78.483  -0.916   6.427
  332   3HD1  ILE  39          3HD1      ILE  39  77.139  -0.915   5.285
  333    H    VAL  40           H        VAL  40  76.796   4.776   6.655
  334    HA   VAL  40           HA       VAL  40  79.269   4.541   8.312
  335    HB   VAL  40           HB       VAL  40  77.778   7.102   7.623
  336   1HG1  VAL  40          1HG1      VAL  40  78.635   7.336   9.835
  337   2HG1  VAL  40          2HG1      VAL  40  79.830   8.112   8.795
  338   3HG1  VAL  40          3HG1      VAL  40  80.130   6.494   9.429
  339   1HG2  VAL  40          1HG2      VAL  40  80.293   5.819   6.604
  340   2HG2  VAL  40          2HG2      VAL  40  80.234   7.577   6.725
  341   3HG2  VAL  40          3HG2      VAL  40  79.064   6.722   5.720
  342    H    LYS  41           H        LYS  41  78.682   3.955  10.343
  343    HA   LYS  41           HA       LYS  41  76.115   4.957  11.481
  344   1HB   LYS  41          2HB       LYS  41  75.738   2.688  10.594
  345   2HB   LYS  41          1HB       LYS  41  77.115   2.090  11.516
  346   1HG   LYS  41          2HG       LYS  41  75.037   1.579  12.712
  347   2HG   LYS  41          1HG       LYS  41  75.974   2.763  13.622
  348   1HD   LYS  41          2HD       LYS  41  74.570   4.563  12.904
  349   2HD   LYS  41          1HD       LYS  41  73.787   3.559  11.689
  350   1HE   LYS  41          2HE       LYS  41  72.441   2.491  13.239
  351   2HE   LYS  41          1HE       LYS  41  73.641   2.649  14.537
  352   1HZ   LYS  41          1HZ       LYS  41  73.245   5.010  14.614
  353   2HZ   LYS  41          2HZ       LYS  41  71.766   4.198  14.813
  354   3HZ   LYS  41          3HZ       LYS  41  72.149   4.915  13.322
  355    H    TYR  42           H        TYR  42  76.233   5.302  13.722
  356    HA   TYR  42           HA       TYR  42  79.006   5.336  14.821
  357   1HB   TYR  42          2HB       TYR  42  77.482   7.377  14.588
  358   2HB   TYR  42          1HB       TYR  42  76.505   6.674  15.879
  359    HD1  TYR  42           HD1      TYR  42  79.911   7.963  15.002
  360    HD2  TYR  42           HD2      TYR  42  77.224   6.723  18.198
  361    HE1  TYR  42           HE1      TYR  42  81.517   8.879  16.703
  362    HE2  TYR  42           HE2      TYR  42  78.830   7.641  19.903
  363    HH   TYR  42           HH       TYR  42  82.060   8.686  19.033
  364    H    GLU  43           H        GLU  43  79.566   3.976  16.483
  365    HA   GLU  43           HA       GLU  43  77.386   2.816  18.178
  366   1HB   GLU  43          2HB       GLU  43  79.744   1.382  16.911
  367   2HB   GLU  43          1HB       GLU  43  78.599   0.646  18.032
  368   1HG   GLU  43          2HG       GLU  43  76.749   1.211  16.448
  369   2HG   GLU  43          1HG       GLU  43  77.950   1.814  15.310
  370    H    GLY  44           H        GLY  44  77.887   2.870  20.344
  371   1HA   GLY  44          2HA       GLY  44  79.073   3.342  22.311
  372   2HA   GLY  44          1HA       GLY  44  80.497   2.712  21.486
  373    H    GLU  45           H        GLU  45  82.085   4.210  21.622
  374    HA   GLU  45           HA       GLU  45  81.380   7.098  21.330
  375   1HB   GLU  45          2HB       GLU  45  83.490   7.497  22.493
  376   2HB   GLU  45          1HB       GLU  45  82.542   6.317  23.391
  377   1HG   GLU  45          2HG       GLU  45  83.874   4.485  22.400
  378   2HG   GLU  45          1HG       GLU  45  84.815   5.662  21.485
  379    H    GLU  46           H        GLU  46  82.214   4.736  19.227
  380    HA   GLU  46           HA       GLU  46  84.002   6.557  17.666
  381   1HB   GLU  46          2HB       GLU  46  85.224   4.519  16.955
  382   2HB   GLU  46          1HB       GLU  46  85.265   4.725  18.704
  383   1HG   GLU  46          2HG       GLU  46  83.326   3.138  18.879
  384   2HG   GLU  46          1HG       GLU  46  83.458   2.855  17.143
  385    HA   PRO  47           HA       PRO  47  80.950   5.614  14.476
  386   1HB   PRO  47          2HB       PRO  47  82.567   6.981  12.511
  387   2HB   PRO  47          1HB       PRO  47  81.069   7.539  13.272
  388   1HG   PRO  47          2HG       PRO  47  83.573   8.628  13.674
  389   2HG   PRO  47          1HG       PRO  47  82.169   8.852  14.723
  390   1HD   PRO  47          2HD       PRO  47  84.543   7.122  15.097
  391   2HD   PRO  47          1HD       PRO  47  83.505   7.911  16.305
  392    H    LYS  48           H        LYS  48  80.893   4.008  12.859
  393    HA   LYS  48           HA       LYS  48  83.514   2.912  11.914
  394   1HB   LYS  48          2HB       LYS  48  80.951   1.462  12.633
  395   2HB   LYS  48          1HB       LYS  48  82.329   0.697  11.838
  396   1HG   LYS  48          2HG       LYS  48  83.622   1.851  13.896
  397   2HG   LYS  48          1HG       LYS  48  82.041   1.631  14.649
  398   1HD   LYS  48          2HD       LYS  48  82.074  -0.753  14.046
  399   2HD   LYS  48          1HD       LYS  48  83.646  -0.539  13.275
  400   1HE   LYS  48          2HE       LYS  48  83.179   0.155  16.190
  401   2HE   LYS  48          1HE       LYS  48  83.724  -1.450  15.667
  402   1HZ   LYS  48          1HZ       LYS  48  85.661  -0.141  16.039
  403   2HZ   LYS  48          2HZ       LYS  48  85.040   1.158  15.137
  404   3HZ   LYS  48          3HZ       LYS  48  85.480  -0.286  14.360
  405    H    GLU  49           H        GLU  49  83.551   2.307   9.708
  406    HA   GLU  49           HA       GLU  49  81.157   3.073   8.074
  407   1HB   GLU  49          2HB       GLU  49  84.056   3.900   7.718
  408   2HB   GLU  49          1HB       GLU  49  82.753   4.290   6.595
  409   1HG   GLU  49          2HG       GLU  49  81.554   5.464   8.436
  410   2HG   GLU  49          1HG       GLU  49  82.914   5.132   9.506
  411    H    GLY  50           H        GLY  50  81.408   2.310   5.770
  412   1HA   GLY  50          2HA       GLY  50  83.363   0.204   5.219
  413   2HA   GLY  50          1HA       GLY  50  81.707  -0.383   5.390
  414    H    THR  51           H        THR  51  83.704   0.106   3.017
  415    HA   THR  51           HA       THR  51  81.671   1.428   1.238
  416    HB   THR  51           HB       THR  51  84.652   1.316   0.740
  417    HG1  THR  51           HG1      THR  51  84.950   2.790   2.182
  418   1HG2  THR  51          1HG2      THR  51  84.227   2.806  -0.942
  419   2HG2  THR  51          2HG2      THR  51  82.937   3.608  -0.046
  420   3HG2  THR  51          3HG2      THR  51  82.620   2.082  -0.874
  421    H    PHE  52           H        PHE  52  81.094   0.235  -0.584
  422    HA   PHE  52           HA       PHE  52  82.865  -1.872  -1.600
  423   1HB   PHE  52          2HB       PHE  52  81.427  -3.729  -1.108
  424   2HB   PHE  52          1HB       PHE  52  81.582  -2.821   0.389
  425    HD1  PHE  52           HD1      PHE  52  79.305  -4.243  -2.010
  426    HD2  PHE  52           HD2      PHE  52  79.687  -1.049   0.927
  427    HE1  PHE  52           HE1      PHE  52  76.805  -4.019  -1.931
  428    HE2  PHE  52           HE2      PHE  52  77.180  -0.826   1.006
  429    HZ   PHE  52           HZ       PHE  52  75.741  -2.313  -0.432
  430    H    THR  53           H        THR  53  81.729  -3.020  -3.523
  431    HA   THR  53           HA       THR  53  80.028  -1.052  -5.020
  432    HB   THR  53           HB       THR  53  81.753  -3.354  -5.999
  433    HG1  THR  53           HG1      THR  53  83.291  -1.893  -6.315
  434   1HG2  THR  53          1HG2      THR  53  80.076  -2.939  -7.627
  435   2HG2  THR  53          2HG2      THR  53  81.482  -2.034  -8.186
  436   3HG2  THR  53          3HG2      THR  53  80.157  -1.195  -7.379
  437    H    ALA  54           H        ALA  54  78.024  -1.779  -5.774
  438    HA   ALA  54           HA       ALA  54  77.269  -4.623  -5.251
  439   1HB   ALA  54          1HB       ALA  54  76.743  -2.523  -3.554
  440   2HB   ALA  54          2HB       ALA  54  75.778  -3.994  -3.639
  441   3HB   ALA  54          3HB       ALA  54  75.281  -2.562  -4.536
  442    H    ARG  55           H        ARG  55  75.654  -5.421  -6.615
  443    HA   ARG  55           HA       ARG  55  74.930  -3.747  -8.968
  444   1HB   ARG  55          2HB       ARG  55  75.865  -6.132  -9.059
  445   2HB   ARG  55          1HB       ARG  55  74.310  -6.657  -8.412
  446   1HG   ARG  55          2HG       ARG  55  73.184  -5.487 -10.324
  447   2HG   ARG  55          1HG       ARG  55  74.778  -5.157 -11.003
  448   1HD   ARG  55          2HD       ARG  55  75.214  -7.668 -10.923
  449   2HD   ARG  55          1HD       ARG  55  73.488  -7.863 -10.556
  450    HE   ARG  55           HE       ARG  55  74.015  -6.129 -12.856
  451   1HH1  ARG  55          1HH1      ARG  55  73.442  -9.427 -11.798
  452   2HH1  ARG  55          2HH1      ARG  55  72.878  -9.925 -13.353
  453   1HH2  ARG  55          1HH2      ARG  55  73.279  -6.832 -14.841
  454   2HH2  ARG  55          2HH2      ARG  55  72.785  -8.479 -15.054
  455    H    VAL  56           H        VAL  56  72.760  -3.252  -9.419
  456    HA   VAL  56           HA       VAL  56  70.908  -3.216  -7.154
  457    HB   VAL  56           HB       VAL  56  70.691  -2.394 -10.070
  458   1HG1  VAL  56          1HG1      VAL  56  68.938  -1.052  -8.126
  459   2HG1  VAL  56          2HG1      VAL  56  68.576  -2.767  -8.300
  460   3HG1  VAL  56          3HG1      VAL  56  68.559  -1.715  -9.716
  461   1HG2  VAL  56          1HG2      VAL  56  71.518  -0.341  -9.436
  462   2HG2  VAL  56          2HG2      VAL  56  72.326  -1.328  -8.219
  463   3HG2  VAL  56          3HG2      VAL  56  70.848  -0.461  -7.808
  464    H    GLY  57           H        GLY  57  69.508  -4.804  -6.700
  465   1HA   GLY  57          2HA       GLY  57  68.883  -6.843  -8.785
  466   2HA   GLY  57          1HA       GLY  57  68.743  -7.104  -7.048
  467    H    GLU  58           H        GLU  58  66.560  -7.857  -7.769
  468    HA   GLU  58           HA       GLU  58  64.551  -6.122  -8.823
  469   1HB   GLU  58          2HB       GLU  58  64.476  -8.620  -8.605
  470   2HB   GLU  58          1HB       GLU  58  64.269  -8.426  -6.864
  471   1HG   GLU  58          2HG       GLU  58  62.209  -7.097  -7.283
  472   2HG   GLU  58          1HG       GLU  58  62.398  -7.377  -9.011
  473    H    GLN  59           H        GLN  59  62.877  -4.965  -7.714
  474    HA   GLN  59           HA       GLN  59  62.068  -3.450  -6.106
  475   1HB   GLN  59          2HB       GLN  59  63.083  -5.803  -4.512
  476   2HB   GLN  59          1HB       GLN  59  62.282  -4.440  -3.729
  477   1HG   GLN  59          2HG       GLN  59  60.303  -4.757  -5.135
  478   2HG   GLN  59          1HG       GLN  59  61.101  -6.071  -5.995
  479   1HE2  GLN  59          1HE2      GLN  59  61.092  -8.150  -5.024
  480   2HE2  GLN  59          2HE2      GLN  59  60.387  -8.474  -3.517
  481    H    GLY  60           H        GLY  60  65.124  -3.359  -6.886
  482   1HA   GLY  60          2HA       GLY  60  66.720  -1.696  -6.432
  483   2HA   GLY  60          1HA       GLY  60  65.584  -1.030  -5.261
  484    H    SER  61           H        SER  61  66.504  -4.353  -4.844
  485    HA   SER  61           HA       SER  61  67.537  -3.758  -2.193
  486   1HB   SER  61          2HB       SER  61  67.580  -6.344  -3.780
  487   2HB   SER  61          1HB       SER  61  67.655  -6.185  -2.028
  488    HG   SER  61           HG       SER  61  65.510  -6.214  -3.670
  489    H    VAL  62           H        VAL  62  69.667  -3.932  -1.463
  490    HA   VAL  62           HA       VAL  62  71.797  -4.691  -3.405
  491    HB   VAL  62           HB       VAL  62  71.547  -2.236  -3.448
  492   1HG1  VAL  62          1HG1      VAL  62  70.553  -1.997  -1.184
  493   2HG1  VAL  62          2HG1      VAL  62  71.916  -0.905  -1.426
  494   3HG1  VAL  62          3HG1      VAL  62  72.124  -2.374  -0.474
  495   1HG2  VAL  62          1HG2      VAL  62  73.865  -3.583  -3.228
  496   2HG2  VAL  62          2HG2      VAL  62  73.998  -2.571  -1.788
  497   3HG2  VAL  62          3HG2      VAL  62  73.808  -1.827  -3.376
  498    H    ILE  63           H        ILE  63  73.599  -5.692  -2.370
  499    HA   ILE  63           HA       ILE  63  73.100  -6.443   0.486
  500    HB   ILE  63           HB       ILE  63  74.677  -7.820  -1.715
  501   1HG1  ILE  63          2HG1      ILE  63  72.274  -7.738  -2.260
  502   2HG1  ILE  63          1HG1      ILE  63  72.749  -9.379  -1.831
  503   1HG2  ILE  63          1HG2      ILE  63  74.327  -9.809  -0.123
  504   2HG2  ILE  63          2HG2      ILE  63  73.907  -8.605   1.097
  505   3HG2  ILE  63          3HG2      ILE  63  75.511  -8.594   0.363
  506   1HD1  ILE  63          1HD1      ILE  63  70.617  -8.765  -0.746
  507   2HD1  ILE  63          2HD1      ILE  63  71.406  -7.392   0.028
  508   3HD1  ILE  63          3HD1      ILE  63  71.879  -9.035   0.457
  509    H    ILE  64           H        ILE  64  74.499  -5.627   1.966
  510    HA   ILE  64           HA       ILE  64  77.118  -4.479   1.226
  511    HB   ILE  64           HB       ILE  64  75.732  -5.012   3.882
  512   1HG1  ILE  64          2HG1      ILE  64  76.059  -2.364   2.460
  513   2HG1  ILE  64          1HG1      ILE  64  74.659  -3.401   2.179
  514   1HG2  ILE  64          1HG2      ILE  64  77.354  -3.483   4.849
  515   2HG2  ILE  64          2HG2      ILE  64  78.069  -3.179   3.266
  516   3HG2  ILE  64          3HG2      ILE  64  78.229  -4.767   4.015
  517   1HD1  ILE  64          1HD1      ILE  64  75.395  -1.828   4.592
  518   2HD1  ILE  64          2HD1      ILE  64  74.677  -3.413   4.878
  519   3HD1  ILE  64          3HD1      ILE  64  73.802  -2.206   3.937
  520    HA   PRO  65           HA       PRO  65  79.293  -8.339   1.665
  521   1HB   PRO  65          2HB       PRO  65  81.756  -7.438   2.439
  522   2HB   PRO  65          1HB       PRO  65  81.152  -7.260   0.776
  523   1HG   PRO  65          2HG       PRO  65  81.050  -5.284   3.027
  524   2HG   PRO  65          1HG       PRO  65  81.642  -5.047   1.370
  525   1HD   PRO  65          2HD       PRO  65  79.206  -4.245   2.015
  526   2HD   PRO  65          1HD       PRO  65  79.476  -5.086   0.466
  527    H    LYS  66           H        LYS  66  79.369  -9.791   3.343
  528    HA   LYS  66           HA       LYS  66  78.590  -9.209   6.001
  529   1HB   LYS  66          2HB       LYS  66  78.579 -11.426   4.843
  530   2HB   LYS  66          1HB       LYS  66  80.335 -11.481   4.999
  531   1HG   LYS  66          2HG       LYS  66  80.102 -11.313   7.467
  532   2HG   LYS  66          1HG       LYS  66  78.348 -11.333   7.286
  533   1HD   LYS  66          2HD       LYS  66  78.553 -13.544   6.114
  534   2HD   LYS  66          1HD       LYS  66  80.275 -13.535   6.496
  535   1HE   LYS  66          2HE       LYS  66  79.520 -13.179   8.959
  536   2HE   LYS  66          1HE       LYS  66  77.935 -13.743   8.393
  537   1HZ   LYS  66          1HZ       LYS  66  80.490 -15.163   7.864
  538   2HZ   LYS  66          2HZ       LYS  66  78.920 -15.715   7.515
  539   3HZ   LYS  66          3HZ       LYS  66  79.434 -15.567   9.128
  540    H    ALA  67           H        ALA  67  81.814  -9.313   4.558
  541    HA   ALA  67           HA       ALA  67  83.415  -9.341   6.907
  542   1HB   ALA  67          1HB       ALA  67  84.182  -7.681   4.532
  543   2HB   ALA  67          2HB       ALA  67  83.893  -9.404   4.286
  544   3HB   ALA  67          3HB       ALA  67  85.137  -8.871   5.417
  545    H    LEU  68           H        LEU  68  81.864  -6.636   5.211
  546    HA   LEU  68           HA       LEU  68  83.017  -4.590   6.951
  547   1HB   LEU  68          2HB       LEU  68  80.782  -4.642   4.903
  548   2HB   LEU  68          1HB       LEU  68  81.292  -3.173   5.733
  549    HG   LEU  68           HG       LEU  68  83.075  -4.936   4.017
  550   1HD1  LEU  68          1HD1      LEU  68  81.207  -3.273   3.061
  551   2HD1  LEU  68          2HD1      LEU  68  82.789  -3.427   2.296
  552   3HD1  LEU  68          3HD1      LEU  68  82.465  -2.081   3.389
  553   1HD2  LEU  68          1HD2      LEU  68  83.575  -2.418   5.623
  554   2HD2  LEU  68          2HD2      LEU  68  84.611  -2.882   4.274
  555   3HD2  LEU  68          3HD2      LEU  68  84.467  -3.939   5.678
  556    H    ARG  69           H        ARG  69  80.006  -6.475   6.873
  557    HA   ARG  69           HA       ARG  69  78.448  -4.996   8.759
  558   1HB   ARG  69          2HB       ARG  69  78.705  -8.013   8.457
  559   2HB   ARG  69          1HB       ARG  69  77.331  -7.158   9.144
  560   1HG   ARG  69          2HG       ARG  69  77.017  -6.043   6.894
  561   2HG   ARG  69          1HG       ARG  69  78.244  -7.141   6.258
  562   1HD   ARG  69          2HD       ARG  69  76.734  -8.971   7.485
  563   2HD   ARG  69          1HD       ARG  69  75.473  -7.759   7.202
  564    HE   ARG  69           HE       ARG  69  76.692  -7.839   4.765
  565   1HH1  ARG  69          1HH1      ARG  69  75.528 -10.409   6.862
  566   2HH1  ARG  69          2HH1      ARG  69  75.251 -11.485   5.540
  567   1HH2  ARG  69          1HH2      ARG  69  76.299  -9.276   3.105
  568   2HH2  ARG  69          2HH2      ARG  69  75.678 -10.856   3.442
  569    H    ASP  70           H        ASP  70  80.802  -7.620   9.251
  570    HA   ASP  70           HA       ASP  70  80.502  -7.766  12.105
  571   1HB   ASP  70          2HB       ASP  70  82.743  -8.597  10.232
  572   2HB   ASP  70          1HB       ASP  70  82.595  -9.128  11.907
  573    H    VAL  71           H        VAL  71  82.999  -6.213  10.062
  574    HA   VAL  71           HA       VAL  71  84.648  -5.226  12.173
  575    HB   VAL  71           HB       VAL  71  84.046  -4.167   9.387
  576   1HG1  VAL  71          1HG1      VAL  71  86.258  -3.068   9.539
  577   2HG1  VAL  71          2HG1      VAL  71  86.395  -3.590  11.219
  578   3HG1  VAL  71          3HG1      VAL  71  85.140  -2.441  10.751
  579   1HG2  VAL  71          1HG2      VAL  71  86.474  -5.735  10.219
  580   2HG2  VAL  71          2HG2      VAL  71  85.750  -5.577   8.619
  581   3HG2  VAL  71          3HG2      VAL  71  84.970  -6.576   9.845
  582    H    ILE  72           H        ILE  72  81.805  -3.812  10.595
  583    HA   ILE  72           HA       ILE  72  82.006  -1.292  12.058
  584    HB   ILE  72           HB       ILE  72  79.830  -2.495  10.307
  585   1HG1  ILE  72          2HG1      ILE  72  82.016  -0.498   9.625
  586   2HG1  ILE  72          1HG1      ILE  72  82.094  -2.217   9.239
  587   1HG2  ILE  72          1HG2      ILE  72  80.344   0.417  11.000
  588   2HG2  ILE  72          2HG2      ILE  72  79.148  -0.578  11.829
  589   3HG2  ILE  72          3HG2      ILE  72  78.973  -0.243  10.105
  590   1HD1  ILE  72          1HD1      ILE  72  79.816  -1.872   8.078
  591   2HD1  ILE  72          2HD1      ILE  72  81.242  -1.216   7.271
  592   3HD1  ILE  72          3HD1      ILE  72  80.175  -0.146   8.179
  593    H    GLY  73           H        GLY  73  80.556  -4.391  12.732
  594   1HA   GLY  73          2HA       GLY  73  79.474  -5.082  14.704
  595   2HA   GLY  73          1HA       GLY  73  79.667  -3.442  15.322
  596    H    ILE  74           H        ILE  74  78.042  -4.284  12.296
  597    HA   ILE  74           HA       ILE  74  75.692  -2.741  13.188
  598    HB   ILE  74           HB       ILE  74  76.389  -4.086  10.555
  599   1HG1  ILE  74          2HG1      ILE  74  78.058  -2.390  11.207
  600   2HG1  ILE  74          1HG1      ILE  74  77.098  -1.819   9.847
  601   1HG2  ILE  74          1HG2      ILE  74  74.192  -2.231  11.429
  602   2HG2  ILE  74          2HG2      ILE  74  74.097  -3.665  10.406
  603   3HG2  ILE  74          3HG2      ILE  74  74.780  -2.170   9.767
  604   1HD1  ILE  74          1HD1      ILE  74  76.781   0.051  11.094
  605   2HD1  ILE  74          2HD1      ILE  74  77.296  -0.748  12.579
  606   3HD1  ILE  74          3HD1      ILE  74  75.635  -0.926  12.013
  607    H    LYS  75           H        LYS  75  73.632  -3.573  13.479
  608    HA   LYS  75           HA       LYS  75  73.299  -6.553  13.310
  609   1HB   LYS  75          2HB       LYS  75  72.524  -4.553  15.453
  610   2HB   LYS  75          1HB       LYS  75  71.959  -6.224  15.437
  611   1HG   LYS  75          2HG       LYS  75  74.017  -7.072  15.997
  612   2HG   LYS  75          1HG       LYS  75  74.889  -5.809  15.126
  613   1HD   LYS  75          2HD       LYS  75  74.857  -4.359  16.912
  614   2HD   LYS  75          1HD       LYS  75  73.312  -4.965  17.509
  615   1HE   LYS  75          2HE       LYS  75  74.793  -7.182  17.902
  616   2HE   LYS  75          1HE       LYS  75  76.067  -5.957  18.066
  617   1HZ   LYS  75          1HZ       LYS  75  73.455  -5.982  19.484
  618   2HZ   LYS  75          2HZ       LYS  75  74.591  -4.722  19.571
  619   3HZ   LYS  75          3HZ       LYS  75  74.974  -6.260  20.182
  620    HA   PRO  76           HA       PRO  76  69.493  -5.935  11.114
  621   1HB   PRO  76          2HB       PRO  76  68.094  -7.613  13.121
  622   2HB   PRO  76          1HB       PRO  76  68.231  -7.834  11.367
  623   1HG   PRO  76          2HG       PRO  76  69.581  -9.345  13.138
  624   2HG   PRO  76          1HG       PRO  76  70.199  -8.961  11.526
  625   1HD   PRO  76          2HD       PRO  76  71.058  -7.931  14.159
  626   2HD   PRO  76          1HD       PRO  76  71.971  -8.091  12.647
  627    H    GLY  77           H        GLY  77  67.997  -4.299  11.224
  628   1HA   GLY  77          2HA       GLY  77  66.206  -3.052  12.187
  629   2HA   GLY  77          1HA       GLY  77  66.630  -3.706  13.766
  630    H    GLU  78           H        GLU  78  69.512  -2.635  12.464
  631    HA   GLU  78           HA       GLU  78  69.337  -0.091  13.996
  632   1HB   GLU  78          2HB       GLU  78  71.444  -2.033  13.180
  633   2HB   GLU  78          1HB       GLU  78  71.938  -0.348  13.369
  634   1HG   GLU  78          2HG       GLU  78  70.852  -0.342  15.628
  635   2HG   GLU  78          1HG       GLU  78  70.547  -2.069  15.443
  636    H    VAL  79           H        VAL  79  69.402   1.858  12.988
  637    HA   VAL  79           HA       VAL  79  69.276   1.868  10.045
  638    HB   VAL  79           HB       VAL  79  67.601   2.986  11.474
  639   1HG1  VAL  79          1HG1      VAL  79  69.228   5.286  12.236
  640   2HG1  VAL  79          2HG1      VAL  79  69.833   3.802  12.967
  641   3HG1  VAL  79          3HG1      VAL  79  68.160   4.291  13.227
  642   1HG2  VAL  79          1HG2      VAL  79  67.391   4.903  10.141
  643   2HG2  VAL  79          2HG2      VAL  79  68.435   3.876   9.159
  644   3HG2  VAL  79          3HG2      VAL  79  69.130   5.190  10.107
  645    H    ILE  80           H        ILE  80  70.866   2.571   8.742
  646    HA   ILE  80           HA       ILE  80  73.149   4.134   9.892
  647    HB   ILE  80           HB       ILE  80  74.525   2.975   8.170
  648   1HG1  ILE  80          2HG1      ILE  80  71.999   1.404   7.572
  649   2HG1  ILE  80          1HG1      ILE  80  72.651   2.678   6.540
  650   1HG2  ILE  80          1HG2      ILE  80  72.985   0.795   9.551
  651   2HG2  ILE  80          2HG2      ILE  80  73.880   1.968  10.516
  652   3HG2  ILE  80          3HG2      ILE  80  74.726   0.966   9.339
  653   1HD1  ILE  80          1HD1      ILE  80  74.552   1.427   5.975
  654   2HD1  ILE  80          2HD1      ILE  80  73.290   0.196   6.023
  655   3HD1  ILE  80          3HD1      ILE  80  74.398   0.377   7.383
  656    H    GLU  81           H        GLU  81  74.073   5.686   8.344
  657    HA   GLU  81           HA       GLU  81  72.095   6.757   6.384
  658   1HB   GLU  81          2HB       GLU  81  73.059   8.230   8.163
  659   2HB   GLU  81          1HB       GLU  81  74.669   7.915   7.513
  660   1HG   GLU  81          2HG       GLU  81  73.925   8.840   5.318
  661   2HG   GLU  81          1HG       GLU  81  72.371   9.244   6.046
  662    H    VAL  82           H        VAL  82  72.508   6.490   4.244
  663    HA   VAL  82           HA       VAL  82  75.061   5.139   3.497
  664    HB   VAL  82           HB       VAL  82  72.246   5.056   2.350
  665   1HG1  VAL  82          1HG1      VAL  82  73.782   4.595   0.566
  666   2HG1  VAL  82          2HG1      VAL  82  73.183   3.034   1.129
  667   3HG1  VAL  82          3HG1      VAL  82  74.787   3.587   1.608
  668   1HG2  VAL  82          1HG2      VAL  82  73.823   3.314   4.231
  669   2HG2  VAL  82          2HG2      VAL  82  72.562   2.607   3.221
  670   3HG2  VAL  82          3HG2      VAL  82  72.158   3.876   4.378
  671    H    LEU  83           H        LEU  83  76.355   6.125   2.051
  672    HA   LEU  83           HA       LEU  83  75.305   8.452   0.468
  673   1HB   LEU  83          2HB       LEU  83  78.167   7.800   1.275
  674   2HB   LEU  83          1HB       LEU  83  77.578   9.321   0.620
  675    HG   LEU  83           HG       LEU  83  76.810   8.150   3.311
  676   1HD1  LEU  83          1HD1      LEU  83  78.195   9.867   4.267
  677   2HD1  LEU  83          2HD1      LEU  83  78.461  10.610   2.689
  678   3HD1  LEU  83          3HD1      LEU  83  79.168   9.033   3.053
  679   1HD2  LEU  83          1HD2      LEU  83  75.731  10.365   3.647
  680   2HD2  LEU  83          2HD2      LEU  83  75.002   9.465   2.315
  681   3HD2  LEU  83          3HD2      LEU  83  76.121  10.787   1.978
  682    H    LEU  84           H        LEU  84  75.392   8.169  -1.766
  683    HA   LEU  84           HA       LEU  84  76.668   5.772  -2.927
  684   1HB   LEU  84          2HB       LEU  84  74.943   8.045  -3.835
  685   2HB   LEU  84          1HB       LEU  84  75.873   7.153  -5.045
  686    HG   LEU  84           HG       LEU  84  74.372   5.561  -3.018
  687   1HD1  LEU  84          1HD1      LEU  84  72.359   6.419  -3.553
  688   2HD1  LEU  84          2HD1      LEU  84  72.613   5.898  -5.217
  689   3HD1  LEU  84          3HD1      LEU  84  73.085   7.521  -4.717
  690   1HD2  LEU  84          1HD2      LEU  84  75.463   4.151  -4.480
  691   2HD2  LEU  84          2HD2      LEU  84  75.424   5.319  -5.800
  692   3HD2  LEU  84          3HD2      LEU  84  73.981   4.385  -5.407
  693    H    LEU  85           H        LEU  85  78.604   5.787  -4.043
  694    HA   LEU  85           HA       LEU  85  80.233   8.275  -3.842
  695   1HB   LEU  85          2HB       LEU  85  80.683   5.329  -3.705
  696   2HB   LEU  85          1HB       LEU  85  82.007   6.319  -4.325
  697    HG   LEU  85           HG       LEU  85  80.572   7.040  -1.771
  698   1HD1  LEU  85          1HD1      LEU  85  82.973   5.217  -2.112
  699   2HD1  LEU  85          2HD1      LEU  85  81.396   4.757  -1.472
  700   3HD1  LEU  85          3HD1      LEU  85  82.421   5.875  -0.572
  701   1HD2  LEU  85          1HD2      LEU  85  82.034   8.714  -2.921
  702   2HD2  LEU  85          2HD2      LEU  85  83.382   7.585  -2.783
  703   3HD2  LEU  85          3HD2      LEU  85  82.644   8.259  -1.329
  704    H    GLY  86           H        GLY  86  79.244   5.720  -6.122
  705   1HA   GLY  86          2HA       GLY  86  79.684   7.471  -8.422
  706   2HA   GLY  86          1HA       GLY  86  80.937   6.245  -8.279
  707    H    HIS  87           H        HIS  87  79.793   5.834 -10.513
  708    HA   HIS  87           HA       HIS  87  77.815   3.629 -10.108
  709   1HB   HIS  87          2HB       HIS  87  76.440   4.622 -11.933
  710   2HB   HIS  87          1HB       HIS  87  76.575   5.709 -10.558
  711    HD1  HIS  87           HD1      HIS  87  77.535   5.347 -14.142
  712    HD2  HIS  87           HD2      HIS  87  78.256   8.007 -11.014
  713    HE1  HIS  87           HE1      HIS  87  78.560   7.415 -15.183
  714    H    TYR  88           H        TYR  88  77.807   2.079 -11.865
  715    HA   TYR  88           HA       TYR  88  79.891   2.458 -13.975
  716   1HB   TYR  88          2HB       TYR  88  79.430   0.075 -12.156
  717   2HB   TYR  88          1HB       TYR  88  80.451   0.018 -13.594
  718    HD1  TYR  88           HD1      TYR  88  80.071   1.424 -10.168
  719    HD2  TYR  88           HD2      TYR  88  82.606   1.213 -13.705
  720    HE1  TYR  88           HE1      TYR  88  81.978   2.418  -8.862
  721    HE2  TYR  88           HE2      TYR  88  84.512   2.205 -12.399
  722    HH   TYR  88           HH       TYR  88  84.629   3.785 -10.200
  723    H    LYS  89           H        LYS  89  79.211   1.774 -15.987
  724    HA   LYS  89           HA       LYS  89  76.571   0.355 -16.161
  725   1HB   LYS  89          2HB       LYS  89  77.732   2.775 -17.462
  726   2HB   LYS  89          1HB       LYS  89  76.704   1.746 -18.463
  727   1HG   LYS  89          2HG       LYS  89  74.901   1.897 -16.804
  728   2HG   LYS  89          1HG       LYS  89  75.927   2.883 -15.761
  729   1HD   LYS  89          2HD       LYS  89  75.843   4.727 -17.196
  730   2HD   LYS  89          1HD       LYS  89  75.421   3.741 -18.597
  731   1HE   LYS  89          2HE       LYS  89  73.266   3.217 -17.056
  732   2HE   LYS  89          1HE       LYS  89  73.654   4.847 -16.468
  733   1HZ   LYS  89          1HZ       LYS  89  73.377   4.046 -19.319
  734   2HZ   LYS  89          2HZ       LYS  89  73.797   5.597 -18.768
  735   3HZ   LYS  89          3HZ       LYS  89  72.255   4.964 -18.438
  736    HA   PRO  90           HA       PRO  90  79.524  -2.610 -18.067
  737   1HB   PRO  90          2HB       PRO  90  76.876  -3.997 -18.380
  738   2HB   PRO  90          1HB       PRO  90  78.436  -4.660 -17.839
  739   1HG   PRO  90          2HG       PRO  90  76.605  -4.173 -16.050
  740   2HG   PRO  90          1HG       PRO  90  78.271  -3.648 -15.735
  741   1HD   PRO  90          2HD       PRO  90  75.924  -2.015 -16.640
  742   2HD   PRO  90          1HD       PRO  90  77.152  -1.638 -15.405
  743    H    ARG  91           H        ARG  91  79.968  -2.989 -20.266
  744    HA   ARG  91           HA       ARG  91  77.980  -1.919 -22.247
  745   1HB   ARG  91          2HB       ARG  91  81.013  -1.816 -22.171
  746   2HB   ARG  91          1HB       ARG  91  80.031  -1.228 -23.513
  747   1HG   ARG  91          2HG       ARG  91  78.878   0.332 -21.962
  748   2HG   ARG  91          1HG       ARG  91  79.923  -0.223 -20.653
  749   1HD   ARG  91          2HD       ARG  91  80.894   1.818 -21.545
  750   2HD   ARG  91          1HD       ARG  91  81.909   0.472 -22.099
  751    HE   ARG  91           HE       ARG  91  81.112   0.821 -24.298
  752   1HH1  ARG  91          1HH1      ARG  91  79.094   2.552 -22.008
  753   2HH1  ARG  91          2HH1      ARG  91  78.216   3.364 -23.254
  754   1HH2  ARG  91          1HH2      ARG  91  79.944   1.899 -25.864
  755   2HH2  ARG  91          2HH2      ARG  91  78.688   3.002 -25.410
  756    H    ASN  92           H        ASN  92  77.800  -3.082 -24.221
  757    HA   ASN  92           HA       ASN  92  79.120  -5.780 -24.259
  758   1HB   ASN  92          2HB       ASN  92  76.382  -4.876 -25.214
  759   2HB   ASN  92          1HB       ASN  92  77.012  -6.517 -25.364
  760   1HD2  ASN  92          1HD2      ASN  92  78.230  -6.898 -22.863
  761   2HD2  ASN  92          2HD2      ASN  92  77.059  -6.804 -21.638
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1  83.022  15.688   0.673
    2   2H    MET   1          2H        MET   1  84.015  14.495   1.363
    3   3H    MET   1          3H        MET   1  82.337  14.251   1.257
    4    HA   MET   1           HA       MET   1  84.201  14.454  -1.056
    5   1HB   MET   1          2HB       MET   1  82.883  12.215   0.484
    6   2HB   MET   1          1HB       MET   1  83.429  11.985  -1.178
    7   1HG   MET   1          2HG       MET   1  85.696  12.772  -0.499
    8   2HG   MET   1          1HG       MET   1  85.136  12.850   1.172
    9   1HE   MET   1          1HE       MET   1  83.206   9.799   1.172
   10   2HE   MET   1          2HE       MET   1  83.767  11.171   2.124
   11   3HE   MET   1          3HE       MET   1  84.458   9.574   2.401
   12    H    ASP   2           H        ASP   2  82.995  13.468  -3.002
   13    HA   ASP   2           HA       ASP   2  80.465  14.910  -3.385
   14   1HB   ASP   2          2HB       ASP   2  82.118  13.039  -5.114
   15   2HB   ASP   2          1HB       ASP   2  80.732  13.963  -5.691
   16    H    VAL   3           H        VAL   3  78.422  13.979  -3.427
   17    HA   VAL   3           HA       VAL   3  78.239  11.011  -3.223
   18    HB   VAL   3           HB       VAL   3  77.972  12.456  -1.080
   19   1HG1  VAL   3          1HG1      VAL   3  76.428  14.139  -2.161
   20   2HG1  VAL   3          2HG1      VAL   3  75.822  13.454  -0.652
   21   3HG1  VAL   3          3HG1      VAL   3  75.190  12.878  -2.199
   22   1HG2  VAL   3          1HG2      VAL   3  77.345  10.070  -1.267
   23   2HG2  VAL   3          2HG2      VAL   3  75.756  10.544  -1.866
   24   3HG2  VAL   3          3HG2      VAL   3  76.235  10.952  -0.218
   25    H    LEU   4           H        LEU   4  76.773  10.136  -4.653
   26    HA   LEU   4           HA       LEU   4  75.442  11.920  -6.568
   27   1HB   LEU   4          2HB       LEU   4  75.357   8.897  -6.295
   28   2HB   LEU   4          1HB       LEU   4  74.977   9.830  -7.737
   29    HG   LEU   4           HG       LEU   4  77.697   9.542  -6.413
   30   1HD1  LEU   4          1HD1      LEU   4  76.434   8.541  -8.952
   31   2HD1  LEU   4          2HD1      LEU   4  77.355   7.646  -7.742
   32   3HD1  LEU   4          3HD1      LEU   4  78.183   8.745  -8.846
   33   1HD2  LEU   4          1HD2      LEU   4  77.789  11.761  -7.174
   34   2HD2  LEU   4          2HD2      LEU   4  76.706  11.442  -8.532
   35   3HD2  LEU   4          3HD2      LEU   4  78.373  10.868  -8.583
   36    H    ALA   5           H        ALA   5  74.561  10.223  -3.655
   37    HA   ALA   5           HA       ALA   5  71.982  11.495  -3.553
   38   1HB   ALA   5          1HB       ALA   5  71.645   8.538  -3.678
   39   2HB   ALA   5          2HB       ALA   5  71.973   9.347  -5.210
   40   3HB   ALA   5          3HB       ALA   5  70.567   9.812  -4.251
   41    H    LYS   6           H        LYS   6  70.993  11.127  -1.461
   42    HA   LYS   6           HA       LYS   6  72.684   9.573   0.479
   43   1HB   LYS   6          2HB       LYS   6  73.130  12.048   0.370
   44   2HB   LYS   6          1HB       LYS   6  71.451  12.327   0.830
   45   1HG   LYS   6          2HG       LYS   6  71.807  11.085   2.924
   46   2HG   LYS   6          1HG       LYS   6  73.483  10.786   2.466
   47   1HD   LYS   6          2HD       LYS   6  73.626  13.381   2.227
   48   2HD   LYS   6          1HD       LYS   6  72.177  13.383   3.233
   49   1HE   LYS   6          2HE       LYS   6  73.458  11.885   4.861
   50   2HE   LYS   6          1HE       LYS   6  74.914  12.285   3.927
   51   1HZ   LYS   6          1HZ       LYS   6  74.291  14.657   4.178
   52   2HZ   LYS   6          2HZ       LYS   6  74.673  13.906   5.653
   53   3HZ   LYS   6          3HZ       LYS   6  73.051  14.195   5.237
   54    H    PHE   7           H        PHE   7  71.409   8.147   1.628
   55    HA   PHE   7           HA       PHE   7  68.659   8.939   2.408
   56   1HB   PHE   7          2HB       PHE   7  67.690   6.955   1.329
   57   2HB   PHE   7          1HB       PHE   7  68.526   7.951   0.142
   58    HD1  PHE   7           HD1      PHE   7  68.166   4.640   1.470
   59    HD2  PHE   7           HD2      PHE   7  71.072   7.334  -0.338
   60    HE1  PHE   7           HE1      PHE   7  69.585   2.669   0.811
   61    HE2  PHE   7           HE2      PHE   7  72.492   5.363  -0.991
   62    HZ   PHE   7           HZ       PHE   7  71.748   3.028  -0.411
   63    H    HIS   8           H        HIS   8  67.721   7.381   3.990
   64    HA   HIS   8           HA       HIS   8  69.886   6.079   5.613
   65   1HB   HIS   8          2HB       HIS   8  67.204   7.318   6.327
   66   2HB   HIS   8          1HB       HIS   8  68.302   6.576   7.491
   67    HD1  HIS   8           HD1      HIS   8  67.877   9.609   5.336
   68    HD2  HIS   8           HD2      HIS   8  70.680   8.079   8.016
   69    HE1  HIS   8           HE1      HIS   8  69.488  11.496   5.843
   70    H    THR   9           H        THR   9  69.621   3.946   6.212
   71    HA   THR   9           HA       THR   9  66.995   2.612   5.957
   72    HB   THR   9           HB       THR   9  68.118   2.564   3.699
   73    HG1  THR   9           HG1      THR   9  66.765   0.913   4.010
   74   1HG2  THR   9          1HG2      THR   9  70.458   2.464   4.462
   75   2HG2  THR   9          2HG2      THR   9  70.087   1.100   3.406
   76   3HG2  THR   9          3HG2      THR   9  70.167   0.867   5.153
   77    H    THR  10           H        THR  10  67.096   0.385   6.961
   78    HA   THR  10           HA       THR  10  69.332   0.203   8.945
   79    HB   THR  10           HB       THR  10  66.932   0.620   9.737
   80    HG1  THR  10           HG1      THR  10  67.647  -0.249  11.472
   81   1HG2  THR  10          1HG2      THR  10  66.287  -1.478   8.049
   82   2HG2  THR  10          2HG2      THR  10  65.251  -0.837   9.326
   83   3HG2  THR  10          3HG2      THR  10  66.288  -2.232   9.646
   84    H    VAL  11           H        VAL  11  70.069  -1.995   9.456
   85    HA   VAL  11           HA       VAL  11  70.419  -3.575   7.029
   86    HB   VAL  11           HB       VAL  11  71.256  -4.049   9.913
   87   1HG1  VAL  11          1HG1      VAL  11  71.509  -6.113   8.758
   88   2HG1  VAL  11          2HG1      VAL  11  73.107  -5.370   8.705
   89   3HG1  VAL  11          3HG1      VAL  11  72.061  -5.313   7.287
   90   1HG2  VAL  11          1HG2      VAL  11  73.491  -3.253   8.515
   91   2HG2  VAL  11          2HG2      VAL  11  72.503  -2.186   9.510
   92   3HG2  VAL  11          3HG2      VAL  11  72.234  -2.267   7.768
   93    H    HIS  12           H        HIS  12  69.370  -5.419   6.469
   94    HA   HIS  12           HA       HIS  12  67.513  -6.683   8.454
   95   1HB   HIS  12          2HB       HIS  12  67.385  -6.189   5.496
   96   2HB   HIS  12          1HB       HIS  12  66.543  -7.591   6.166
   97    HD1  HIS  12           HD1      HIS  12  66.869  -3.886   7.079
   98    HD2  HIS  12           HD2      HIS  12  64.001  -6.908   6.963
   99    HE1  HIS  12           HE1      HIS  12  64.696  -2.838   7.847
  100    H    ARG  13           H        ARG  13  67.226  -9.090   7.904
  101    HA   ARG  13           HA       ARG  13  69.494 -10.565   8.458
  102   1HB   ARG  13          2HB       ARG  13  67.036 -11.227   6.827
  103   2HB   ARG  13          1HB       ARG  13  68.170 -12.463   7.384
  104   1HG   ARG  13          2HG       ARG  13  67.820 -11.662   9.726
  105   2HG   ARG  13          1HG       ARG  13  66.599 -10.539   9.125
  106   1HD   ARG  13          2HD       ARG  13  65.353 -12.515   8.162
  107   2HD   ARG  13          1HD       ARG  13  66.507 -13.572   8.999
  108    HE   ARG  13           HE       ARG  13  65.321 -11.519  10.722
  109   1HH1  ARG  13          1HH1      ARG  13  64.996 -14.785   9.478
  110   2HH1  ARG  13          2HH1      ARG  13  64.009 -15.289  10.804
  111   1HH2  ARG  13          1HH2      ARG  13  64.045 -12.229  12.408
  112   2HH2  ARG  13          2HH2      ARG  13  63.476 -13.864  12.442
  113    H    ILE  14           H        ILE  14  70.976 -11.841   7.237
  114    HA   ILE  14           HA       ILE  14  72.498 -12.301   5.508
  115    HB   ILE  14           HB       ILE  14  70.295 -11.257   3.696
  116   1HG1  ILE  14          2HG1      ILE  14  70.832 -14.134   4.480
  117   2HG1  ILE  14          1HG1      ILE  14  69.637 -13.135   5.310
  118   1HG2  ILE  14          1HG2      ILE  14  71.516 -13.165   2.283
  119   2HG2  ILE  14          2HG2      ILE  14  72.876 -12.698   3.305
  120   3HG2  ILE  14          3HG2      ILE  14  72.092 -11.498   2.278
  121   1HD1  ILE  14          1HD1      ILE  14  69.631 -14.119   2.470
  122   2HD1  ILE  14          2HD1      ILE  14  68.765 -12.639   2.884
  123   3HD1  ILE  14          3HD1      ILE  14  68.333 -14.162   3.664
  124    H    GLY  15           H        GLY  15  71.746  -9.229   6.466
  125   1HA   GLY  15          2HA       GLY  15  73.021  -7.262   6.252
  126   2HA   GLY  15          1HA       GLY  15  74.043  -8.101   5.090
  127    H    ARG  16           H        ARG  16  70.663  -8.266   4.389
  128    HA   ARG  16           HA       ARG  16  71.101  -6.739   1.926
  129   1HB   ARG  16          2HB       ARG  16  69.897  -8.906   2.065
  130   2HB   ARG  16          1HB       ARG  16  68.675  -8.150   3.087
  131   1HG   ARG  16          2HG       ARG  16  68.176  -6.547   1.243
  132   2HG   ARG  16          1HG       ARG  16  69.324  -7.409   0.220
  133   1HD   ARG  16          2HD       ARG  16  66.872  -8.664   1.514
  134   2HD   ARG  16          1HD       ARG  16  67.007  -8.206  -0.195
  135    HE   ARG  16           HE       ARG  16  69.243  -9.766   0.198
  136   1HH1  ARG  16          1HH1      ARG  16  65.832 -10.278   0.849
  137   2HH1  ARG  16          2HH1      ARG  16  65.956 -11.990   0.642
  138   1HH2  ARG  16          1HH2      ARG  16  69.341 -11.979  -0.058
  139   2HH2  ARG  16          2HH2      ARG  16  67.915 -12.943   0.135
  140    H    ILE  17           H        ILE  17  70.129  -4.771   1.403
  141    HA   ILE  17           HA       ILE  17  68.220  -3.574   3.359
  142    HB   ILE  17           HB       ILE  17  69.390  -1.402   3.106
  143   1HG1  ILE  17          2HG1      ILE  17  71.555  -2.932   1.636
  144   2HG1  ILE  17          1HG1      ILE  17  70.314  -1.999   0.802
  145   1HG2  ILE  17          1HG2      ILE  17  70.044  -2.854   4.963
  146   2HG2  ILE  17          2HG2      ILE  17  71.458  -2.000   4.345
  147   3HG2  ILE  17          3HG2      ILE  17  71.199  -3.694   3.927
  148   1HD1  ILE  17          1HD1      ILE  17  71.261  -0.005   1.356
  149   2HD1  ILE  17          2HD1      ILE  17  72.709  -0.968   1.646
  150   3HD1  ILE  17          3HD1      ILE  17  71.653  -0.541   2.991
  151    H    ILE  18           H        ILE  18  66.729  -2.052   2.323
  152    HA   ILE  18           HA       ILE  18  66.658  -2.288  -0.672
  153    HB   ILE  18           HB       ILE  18  64.368  -1.887   1.284
  154   1HG1  ILE  18          2HG1      ILE  18  65.329  -4.137   1.548
  155   2HG1  ILE  18          1HG1      ILE  18  63.767  -4.240   0.742
  156   1HG2  ILE  18          1HG2      ILE  18  63.600  -1.017  -0.734
  157   2HG2  ILE  18          2HG2      ILE  18  63.140  -2.714  -0.899
  158   3HG2  ILE  18          3HG2      ILE  18  64.591  -2.112  -1.703
  159   1HD1  ILE  18          1HD1      ILE  18  64.939  -5.561  -0.717
  160   2HD1  ILE  18          2HD1      ILE  18  66.485  -4.816  -0.309
  161   3HD1  ILE  18          3HD1      ILE  18  65.382  -4.006  -1.421
  162    H    ILE  19           H        ILE  19  66.844  -0.367  -1.742
  163    HA   ILE  19           HA       ILE  19  66.896   2.180  -0.257
  164    HB   ILE  19           HB       ILE  19  67.067   1.512  -3.232
  165   1HG1  ILE  19          2HG1      ILE  19  69.178   1.942  -1.072
  166   2HG1  ILE  19          1HG1      ILE  19  68.863   0.449  -1.945
  167   1HG2  ILE  19          1HG2      ILE  19  68.008   4.020  -1.798
  168   2HG2  ILE  19          2HG2      ILE  19  66.412   3.898  -2.542
  169   3HG2  ILE  19          3HG2      ILE  19  67.862   3.758  -3.536
  170   1HD1  ILE  19          1HD1      ILE  19  70.357   1.077  -3.501
  171   2HD1  ILE  19          2HD1      ILE  19  70.597   2.615  -2.669
  172   3HD1  ILE  19          3HD1      ILE  19  69.338   2.463  -3.897
  173    HA   PRO  20           HA       PRO  20  62.561   3.097  -0.931
  174   1HB   PRO  20          2HB       PRO  20  62.708   5.831  -1.024
  175   2HB   PRO  20          1HB       PRO  20  62.790   4.922   0.495
  176   1HG   PRO  20          2HG       PRO  20  65.045   5.943  -1.199
  177   2HG   PRO  20          1HG       PRO  20  64.795   6.137   0.548
  178   1HD   PRO  20          2HD       PRO  20  66.447   4.270  -0.322
  179   2HD   PRO  20          1HD       PRO  20  65.303   3.883   0.991
  180    H    ALA  21           H        ALA  21  61.339   3.464  -2.792
  181    HA   ALA  21           HA       ALA  21  62.546   3.343  -5.348
  182   1HB   ALA  21          1HB       ALA  21  60.215   2.714  -4.778
  183   2HB   ALA  21          2HB       ALA  21  60.257   3.826  -6.147
  184   3HB   ALA  21          3HB       ALA  21  59.819   4.416  -4.544
  185    H    GLY  22           H        GLY  22  61.773   6.122  -3.333
  186   1HA   GLY  22          2HA       GLY  22  61.783   8.138  -5.374
  187   2HA   GLY  22          1HA       GLY  22  62.106   8.427  -3.664
  188    H    THR  23           H        THR  23  64.392   6.875  -3.296
  189    HA   THR  23           HA       THR  23  66.446   8.611  -4.360
  190    HB   THR  23           HB       THR  23  66.633   5.885  -3.033
  191    HG1  THR  23           HG1      THR  23  66.707   7.056  -1.143
  192   1HG2  THR  23          1HG2      THR  23  68.808   7.291  -2.221
  193   2HG2  THR  23          2HG2      THR  23  68.606   7.944  -3.848
  194   3HG2  THR  23          3HG2      THR  23  68.818   6.208  -3.613
  195    H    ARG  24           H        ARG  24  65.305   5.350  -5.225
  196    HA   ARG  24           HA       ARG  24  67.332   4.606  -7.092
  197   1HB   ARG  24          2HB       ARG  24  64.366   4.099  -7.455
  198   2HB   ARG  24          1HB       ARG  24  65.698   3.081  -7.983
  199   1HG   ARG  24          2HG       ARG  24  66.234   3.027  -5.379
  200   2HG   ARG  24          1HG       ARG  24  64.519   3.397  -5.262
  201   1HD   ARG  24          2HD       ARG  24  64.340   1.433  -7.065
  202   2HD   ARG  24          1HD       ARG  24  65.848   0.932  -6.267
  203    HE   ARG  24           HE       ARG  24  64.290   1.516  -4.123
  204   1HH1  ARG  24          1HH1      ARG  24  63.599  -0.395  -6.983
  205   2HH1  ARG  24          2HH1      ARG  24  62.480  -1.407  -6.143
  206   1HH2  ARG  24          1HH2      ARG  24  62.859   0.175  -3.095
  207   2HH2  ARG  24          2HH2      ARG  24  62.061  -1.092  -3.967
  208    H    LYS  25           H        LYS  25  64.381   6.546  -7.527
  209    HA   LYS  25           HA       LYS  25  64.596   6.882 -10.371
  210   1HB   LYS  25          2HB       LYS  25  62.549   7.246  -9.049
  211   2HB   LYS  25          1HB       LYS  25  63.313   8.593  -8.209
  212   1HG   LYS  25          2HG       LYS  25  61.851   9.435  -9.995
  213   2HG   LYS  25          1HG       LYS  25  63.537   9.794 -10.374
  214   1HD   LYS  25          2HD       LYS  25  63.656   7.870 -11.855
  215   2HD   LYS  25          1HD       LYS  25  62.012   7.397 -11.426
  216   1HE   LYS  25          2HE       LYS  25  62.294  10.189 -12.394
  217   2HE   LYS  25          1HE       LYS  25  62.587   8.928 -13.608
  218   1HZ   LYS  25          1HZ       LYS  25  60.203   9.522 -13.358
  219   2HZ   LYS  25          2HZ       LYS  25  60.262   8.950 -11.759
  220   3HZ   LYS  25          3HZ       LYS  25  60.528   7.885 -13.056
  221    H    PHE  26           H        PHE  26  65.506   9.054  -7.708
  222    HA   PHE  26           HA       PHE  26  66.566  11.202  -9.222
  223   1HB   PHE  26          2HB       PHE  26  66.091  11.153  -6.774
  224   2HB   PHE  26          1HB       PHE  26  67.496  10.116  -6.543
  225    HD1  PHE  26           HD1      PHE  26  69.738  11.005  -6.484
  226    HD2  PHE  26           HD2      PHE  26  66.394  13.510  -7.710
  227    HE1  PHE  26           HE1      PHE  26  71.227  13.031  -6.402
  228    HE2  PHE  26           HE2      PHE  26  67.881  15.537  -7.629
  229    HZ   PHE  26           HZ       PHE  26  70.298  15.298  -6.975
  230    H    TYR  27           H        TYR  27  68.129   8.212  -8.135
  231    HA   TYR  27           HA       TYR  27  70.765   9.016  -9.177
  232   1HB   TYR  27          2HB       TYR  27  70.333   7.726  -7.083
  233   2HB   TYR  27          1HB       TYR  27  69.720   6.400  -8.055
  234    HD1  TYR  27           HD1      TYR  27  72.640   7.919  -6.592
  235    HD2  TYR  27           HD2      TYR  27  71.339   5.390  -9.886
  236    HE1  TYR  27           HE1      TYR  27  74.978   7.026  -6.840
  237    HE2  TYR  27           HE2      TYR  27  73.672   4.496 -10.128
  238    HH   TYR  27           HH       TYR  27  76.001   4.773  -7.797
  239    H    GLY  28           H        GLY  28  67.969   7.416 -10.493
  240   1HA   GLY  28          2HA       GLY  28  67.638   6.616 -12.678
  241   2HA   GLY  28          1HA       GLY  28  69.316   7.032 -13.034
  242    H    ILE  29           H        ILE  29  68.060   4.842 -10.512
  243    HA   ILE  29           HA       ILE  29  70.020   2.800 -11.336
  244    HB   ILE  29           HB       ILE  29  67.964   2.898  -9.096
  245   1HG1  ILE  29          2HG1      ILE  29  70.943   3.475  -9.070
  246   2HG1  ILE  29          1HG1      ILE  29  69.679   4.700  -9.044
  247   1HG2  ILE  29          1HG2      ILE  29  70.012   0.908  -9.932
  248   2HG2  ILE  29          2HG2      ILE  29  68.501   0.667  -9.057
  249   3HG2  ILE  29          3HG2      ILE  29  69.928   1.258  -8.205
  250   1HD1  ILE  29          1HD1      ILE  29  69.787   4.537  -6.789
  251   2HD1  ILE  29          2HD1      ILE  29  70.689   3.019  -6.863
  252   3HD1  ILE  29          3HD1      ILE  29  68.926   3.009  -6.982
  253    H    GLU  30           H        GLU  30  69.544   1.079 -12.571
  254    HA   GLU  30           HA       GLU  30  66.732   0.058 -12.639
  255   1HB   GLU  30          2HB       GLU  30  68.703   0.283 -14.944
  256   2HB   GLU  30          1HB       GLU  30  67.112  -0.472 -15.042
  257   1HG   GLU  30          2HG       GLU  30  66.072   1.690 -14.378
  258   2HG   GLU  30          1HG       GLU  30  67.669   2.434 -14.374
  259    H    GLN  31           H        GLN  31  66.689  -2.319 -12.986
  260    HA   GLN  31           HA       GLN  31  68.570  -3.770 -11.437
  261   1HB   GLN  31          2HB       GLN  31  66.243  -4.439 -12.133
  262   2HB   GLN  31          1HB       GLN  31  66.887  -4.805 -13.733
  263   1HG   GLN  31          2HG       GLN  31  68.503  -6.390 -12.669
  264   2HG   GLN  31          1HG       GLN  31  67.710  -6.098 -11.120
  265   1HE2  GLN  31          1HE2      GLN  31  66.138  -7.627 -10.640
  266   2HE2  GLN  31          2HE2      GLN  31  65.222  -8.482 -11.783
  267    H    GLY  32           H        GLY  32  70.455  -4.838 -11.930
  268   1HA   GLY  32          2HA       GLY  32  72.073  -5.884 -13.362
  269   2HA   GLY  32          1HA       GLY  32  71.313  -5.109 -14.748
  270    H    ASP  33           H        ASP  33  71.414  -2.495 -12.927
  271    HA   ASP  33           HA       ASP  33  73.934  -1.513 -14.051
  272   1HB   ASP  33          2HB       ASP  33  71.855  -0.379 -12.158
  273   2HB   ASP  33          1HB       ASP  33  73.214   0.553 -12.782
  274    H    PHE  34           H        PHE  34  75.707  -0.635 -12.716
  275    HA   PHE  34           HA       PHE  34  75.934  -1.964 -10.034
  276   1HB   PHE  34          2HB       PHE  34  77.963  -1.108 -12.120
  277   2HB   PHE  34          1HB       PHE  34  78.416  -1.615 -10.492
  278    HD1  PHE  34           HD1      PHE  34  76.958  -2.710 -13.742
  279    HD2  PHE  34           HD2      PHE  34  78.205  -3.952  -9.756
  280    HE1  PHE  34           HE1      PHE  34  76.816  -5.119 -14.450
  281    HE2  PHE  34           HE2      PHE  34  78.061  -6.362 -10.464
  282    HZ   PHE  34           HZ       PHE  34  77.368  -6.945 -12.810
  283    H    VAL  35           H        VAL  35  76.298  -0.615  -8.286
  284    HA   VAL  35           HA       VAL  35  76.973   2.244  -8.846
  285    HB   VAL  35           HB       VAL  35  75.367   2.873  -7.051
  286   1HG1  VAL  35          1HG1      VAL  35  73.305   2.397  -8.325
  287   2HG1  VAL  35          2HG1      VAL  35  74.150   1.145  -9.235
  288   3HG1  VAL  35          3HG1      VAL  35  74.623   2.834  -9.412
  289   1HG2  VAL  35          1HG2      VAL  35  74.804  -0.108  -7.061
  290   2HG2  VAL  35          2HG2      VAL  35  73.712   1.083  -6.349
  291   3HG2  VAL  35          3HG2      VAL  35  75.341   0.876  -5.697
  292    H    GLU  36           H        GLU  36  78.230   3.226  -7.118
  293    HA   GLU  36           HA       GLU  36  79.555   1.219  -5.322
  294   1HB   GLU  36          2HB       GLU  36  80.913   2.213  -7.181
  295   2HB   GLU  36          1HB       GLU  36  80.603   3.814  -6.511
  296   1HG   GLU  36          2HG       GLU  36  81.653   3.078  -4.368
  297   2HG   GLU  36          1HG       GLU  36  82.054   1.538  -5.128
  298    H    ILE  37           H        ILE  37  79.117   1.570  -3.210
  299    HA   ILE  37           HA       ILE  37  78.221   4.302  -2.381
  300    HB   ILE  37           HB       ILE  37  76.380   2.822  -3.089
  301   1HG1  ILE  37          2HG1      ILE  37  76.251   2.895  -0.084
  302   2HG1  ILE  37          1HG1      ILE  37  76.277   4.394  -1.011
  303   1HG2  ILE  37          1HG2      ILE  37  75.900   0.761  -1.778
  304   2HG2  ILE  37          2HG2      ILE  37  77.431   0.971  -0.928
  305   3HG2  ILE  37          3HG2      ILE  37  77.422   0.655  -2.663
  306   1HD1  ILE  37          1HD1      ILE  37  74.084   2.529  -0.613
  307   2HD1  ILE  37          2HD1      ILE  37  74.394   2.773  -2.333
  308   3HD1  ILE  37          3HD1      ILE  37  74.052   4.154  -1.293
  309    H    LYS  38           H        LYS  38  78.252   4.634  -0.034
  310    HA   LYS  38           HA       LYS  38  79.905   2.683   1.517
  311   1HB   LYS  38          2HB       LYS  38  81.179   4.686   0.606
  312   2HB   LYS  38          1HB       LYS  38  80.162   5.700   1.637
  313   1HG   LYS  38          2HG       LYS  38  80.902   4.453   3.619
  314   2HG   LYS  38          1HG       LYS  38  81.896   3.410   2.602
  315   1HD   LYS  38          2HD       LYS  38  83.164   5.429   1.846
  316   2HD   LYS  38          1HD       LYS  38  82.224   6.402   2.977
  317   1HE   LYS  38          2HE       LYS  38  83.095   4.383   4.622
  318   2HE   LYS  38          1HE       LYS  38  84.472   4.565   3.516
  319   1HZ   LYS  38          1HZ       LYS  38  83.087   6.867   4.772
  320   2HZ   LYS  38          2HZ       LYS  38  84.561   6.878   3.927
  321   3HZ   LYS  38          3HZ       LYS  38  84.459   6.138   5.453
  322    H    ILE  39           H        ILE  39  79.325   2.512   3.709
  323    HA   ILE  39           HA       ILE  39  76.880   4.047   4.549
  324    HB   ILE  39           HB       ILE  39  76.463   2.047   6.002
  325   1HG1  ILE  39          2HG1      ILE  39  78.649   0.683   4.418
  326   2HG1  ILE  39          1HG1      ILE  39  78.963   1.415   5.992
  327   1HG2  ILE  39          1HG2      ILE  39  75.182   1.760   4.146
  328   2HG2  ILE  39          2HG2      ILE  39  76.316   0.448   3.819
  329   3HG2  ILE  39          3HG2      ILE  39  76.533   2.016   3.041
  330   1HD1  ILE  39          1HD1      ILE  39  76.767  -0.004   6.621
  331   2HD1  ILE  39          2HD1      ILE  39  78.391  -0.683   6.719
  332   3HD1  ILE  39          3HD1      ILE  39  77.381  -1.013   5.310
  333    H    VAL  40           H        VAL  40  76.820   4.820   6.707
  334    HA   VAL  40           HA       VAL  40  79.293   4.527   8.353
  335    HB   VAL  40           HB       VAL  40  77.869   7.129   7.678
  336   1HG1  VAL  40          1HG1      VAL  40  80.088   7.985   8.815
  337   2HG1  VAL  40          2HG1      VAL  40  80.089   6.391   9.570
  338   3HG1  VAL  40          3HG1      VAL  40  78.729   7.485   9.822
  339   1HG2  VAL  40          1HG2      VAL  40  80.605   6.076   6.869
  340   2HG2  VAL  40          2HG2      VAL  40  79.993   7.693   6.516
  341   3HG2  VAL  40          3HG2      VAL  40  79.219   6.281   5.797
  342    H    LYS  41           H        LYS  41  78.681   3.916  10.365
  343    HA   LYS  41           HA       LYS  41  76.121   4.964  11.504
  344   1HB   LYS  41          2HB       LYS  41  75.904   2.598  10.708
  345   2HB   LYS  41          1HB       LYS  41  77.218   2.150  11.797
  346   1HG   LYS  41          2HG       LYS  41  75.877   3.069  13.705
  347   2HG   LYS  41          1HG       LYS  41  74.542   3.327  12.584
  348   1HD   LYS  41          2HD       LYS  41  74.562   0.899  12.039
  349   2HD   LYS  41          1HD       LYS  41  75.839   0.665  13.232
  350   1HE   LYS  41          2HE       LYS  41  73.751   0.130  14.330
  351   2HE   LYS  41          1HE       LYS  41  74.253   1.716  14.947
  352   1HZ   LYS  41          1HZ       LYS  41  71.889   1.569  14.121
  353   2HZ   LYS  41          2HZ       LYS  41  72.526   1.405  12.555
  354   3HZ   LYS  41          3HZ       LYS  41  72.823   2.816  13.454
  355    H    TYR  42           H        TYR  42  76.300   5.508  13.699
  356    HA   TYR  42           HA       TYR  42  79.080   5.474  14.804
  357   1HB   TYR  42          2HB       TYR  42  77.757   7.606  14.385
  358   2HB   TYR  42          1HB       TYR  42  76.670   7.091  15.676
  359    HD1  TYR  42           HD1      TYR  42  80.246   7.924  14.885
  360    HD2  TYR  42           HD2      TYR  42  77.259   7.346  18.002
  361    HE1  TYR  42           HE1      TYR  42  81.855   8.829  16.591
  362    HE2  TYR  42           HE2      TYR  42  78.867   8.254  19.711
  363    HH   TYR  42           HH       TYR  42  81.016   9.945  19.521
  364    H    GLU  43           H        GLU  43  79.517   4.194  16.563
  365    HA   GLU  43           HA       GLU  43  77.243   3.381  18.333
  366   1HB   GLU  43          2HB       GLU  43  78.238   1.103  18.380
  367   2HB   GLU  43          1HB       GLU  43  77.762   1.568  16.749
  368   1HG   GLU  43          2HG       GLU  43  80.115   2.257  16.291
  369   2HG   GLU  43          1HG       GLU  43  80.568   1.682  17.896
  370    H    GLY  44           H        GLY  44  77.716   3.769  20.454
  371   1HA   GLY  44          2HA       GLY  44  78.926   4.353  22.376
  372   2HA   GLY  44          1HA       GLY  44  80.255   3.403  21.712
  373    H    GLU  45           H        GLU  45  82.047   4.661  21.686
  374    HA   GLU  45           HA       GLU  45  81.786   7.544  20.947
  375   1HB   GLU  45          2HB       GLU  45  83.921   7.797  22.114
  376   2HB   GLU  45          1HB       GLU  45  82.786   6.928  23.142
  377   1HG   GLU  45          2HG       GLU  45  83.829   4.786  22.514
  378   2HG   GLU  45          1HG       GLU  45  84.941   5.633  21.438
  379    H    GLU  46           H        GLU  46  82.161   4.900  19.172
  380    HA   GLU  46           HA       GLU  46  84.357   6.065  17.506
  381   1HB   GLU  46          2HB       GLU  46  85.091   3.749  17.085
  382   2HB   GLU  46          1HB       GLU  46  85.097   4.111  18.808
  383   1HG   GLU  46          2HG       GLU  46  82.516   3.143  18.350
  384   2HG   GLU  46          1HG       GLU  46  83.528   2.129  17.327
  385    HA   PRO  47           HA       PRO  47  81.087   5.566  14.407
  386   1HB   PRO  47          2HB       PRO  47  82.860   6.758  12.448
  387   2HB   PRO  47          1HB       PRO  47  81.409   7.457  13.184
  388   1HG   PRO  47          2HG       PRO  47  83.975   8.330  13.630
  389   2HG   PRO  47          1HG       PRO  47  82.599   8.625  14.701
  390   1HD   PRO  47          2HD       PRO  47  84.821   6.673  14.976
  391   2HD   PRO  47          1HD       PRO  47  83.909   7.543  16.230
  392    H    LYS  48           H        LYS  48  80.824   3.838  13.013
  393    HA   LYS  48           HA       LYS  48  83.268   2.395  12.041
  394   1HB   LYS  48          2HB       LYS  48  80.427   1.435  12.534
  395   2HB   LYS  48          1HB       LYS  48  81.755   0.431  11.957
  396   1HG   LYS  48          2HG       LYS  48  81.789   1.936  14.585
  397   2HG   LYS  48          1HG       LYS  48  81.367   0.230  14.424
  398   1HD   LYS  48          2HD       LYS  48  83.598  -0.135  13.311
  399   2HD   LYS  48          1HD       LYS  48  84.015   1.527  13.731
  400   1HE   LYS  48          2HE       LYS  48  84.825   0.568  15.655
  401   2HE   LYS  48          1HE       LYS  48  83.121   0.567  16.150
  402   1HZ   LYS  48          1HZ       LYS  48  84.233  -1.661  16.228
  403   2HZ   LYS  48          2HZ       LYS  48  84.349  -1.598  14.535
  404   3HZ   LYS  48          3HZ       LYS  48  82.825  -1.604  15.284
  405    H    GLU  49           H        GLU  49  83.465   2.168   9.813
  406    HA   GLU  49           HA       GLU  49  81.164   3.043   8.103
  407   1HB   GLU  49          2HB       GLU  49  84.086   3.854   7.942
  408   2HB   GLU  49          1HB       GLU  49  82.846   4.323   6.780
  409   1HG   GLU  49          2HG       GLU  49  81.567   5.406   8.622
  410   2HG   GLU  49          1HG       GLU  49  82.866   4.995   9.738
  411    H    GLY  50           H        GLY  50  81.425   2.342   5.819
  412   1HA   GLY  50          2HA       GLY  50  83.411   0.283   5.197
  413   2HA   GLY  50          1HA       GLY  50  81.763  -0.327   5.349
  414    H    THR  51           H        THR  51  83.754   0.253   2.997
  415    HA   THR  51           HA       THR  51  81.690   1.563   1.246
  416    HB   THR  51           HB       THR  51  84.673   1.513   0.743
  417    HG1  THR  51           HG1      THR  51  84.824   2.764   2.413
  418   1HG2  THR  51          1HG2      THR  51  82.909   3.763  -0.055
  419   2HG2  THR  51          2HG2      THR  51  82.629   2.228  -0.880
  420   3HG2  THR  51          3HG2      THR  51  84.219   2.988  -0.946
  421    H    PHE  52           H        PHE  52  81.116   0.359  -0.573
  422    HA   PHE  52           HA       PHE  52  82.913  -1.731  -1.593
  423   1HB   PHE  52          2HB       PHE  52  81.486  -3.595  -1.084
  424   2HB   PHE  52          1HB       PHE  52  81.646  -2.677   0.406
  425    HD1  PHE  52           HD1      PHE  52  79.359  -4.148  -1.940
  426    HD2  PHE  52           HD2      PHE  52  79.748  -0.882   0.915
  427    HE1  PHE  52           HE1      PHE  52  76.859  -3.933  -1.849
  428    HE2  PHE  52           HE2      PHE  52  77.241  -0.667   1.006
  429    HZ   PHE  52           HZ       PHE  52  75.799  -2.194  -0.384
  430    H    THR  53           H        THR  53  81.780  -2.903  -3.503
  431    HA   THR  53           HA       THR  53  80.063  -0.959  -5.010
  432    HB   THR  53           HB       THR  53  81.800  -3.260  -5.969
  433    HG1  THR  53           HG1      THR  53  83.054  -1.590  -5.161
  434   1HG2  THR  53          1HG2      THR  53  80.130  -2.906  -7.606
  435   2HG2  THR  53          2HG2      THR  53  81.500  -1.951  -8.172
  436   3HG2  THR  53          3HG2      THR  53  80.147  -1.159  -7.363
  437    H    ALA  54           H        ALA  54  78.051  -1.688  -5.716
  438    HA   ALA  54           HA       ALA  54  77.321  -4.543  -5.219
  439   1HB   ALA  54          1HB       ALA  54  75.855  -3.948  -3.574
  440   2HB   ALA  54          2HB       ALA  54  75.310  -2.526  -4.462
  441   3HB   ALA  54          3HB       ALA  54  76.784  -2.451  -3.499
  442    H    ARG  55           H        ARG  55  75.741  -5.341  -6.622
  443    HA   ARG  55           HA       ARG  55  74.999  -3.614  -8.930
  444   1HB   ARG  55          2HB       ARG  55  75.983  -6.006  -9.025
  445   2HB   ARG  55          1HB       ARG  55  74.385  -6.543  -8.505
  446   1HG   ARG  55          2HG       ARG  55  73.395  -5.297 -10.439
  447   2HG   ARG  55          1HG       ARG  55  75.030  -4.934 -10.991
  448   1HD   ARG  55          2HD       ARG  55  75.454  -7.464 -10.962
  449   2HD   ARG  55          1HD       ARG  55  73.698  -7.646 -10.788
  450    HE   ARG  55           HE       ARG  55  74.009  -5.836 -12.888
  451   1HH1  ARG  55          1HH1      ARG  55  75.090  -9.116 -12.253
  452   2HH1  ARG  55          2HH1      ARG  55  75.113  -9.530 -13.931
  453   1HH2  ARG  55          1HH2      ARG  55  74.058  -6.430 -15.036
  454   2HH2  ARG  55          2HH2      ARG  55  74.536  -8.032 -15.487
  455    H    VAL  56           H        VAL  56  72.831  -3.141  -9.387
  456    HA   VAL  56           HA       VAL  56  70.959  -3.190  -7.142
  457    HB   VAL  56           HB       VAL  56  70.758  -2.308 -10.043
  458   1HG1  VAL  56          1HG1      VAL  56  68.632  -2.744  -8.291
  459   2HG1  VAL  56          2HG1      VAL  56  68.608  -1.687  -9.704
  460   3HG1  VAL  56          3HG1      VAL  56  68.962  -1.021  -8.109
  461   1HG2  VAL  56          1HG2      VAL  56  70.872  -0.436  -7.723
  462   2HG2  VAL  56          2HG2      VAL  56  71.530  -0.248  -9.349
  463   3HG2  VAL  56          3HG2      VAL  56  72.364  -1.260  -8.171
  464    H    GLY  57           H        GLY  57  69.558  -4.791  -6.736
  465   1HA   GLY  57          2HA       GLY  57  69.010  -6.819  -8.851
  466   2HA   GLY  57          1HA       GLY  57  68.814  -7.087  -7.119
  467    H    GLU  58           H        GLU  58  66.659  -7.859  -7.942
  468    HA   GLU  58           HA       GLU  58  64.670  -6.113  -9.025
  469   1HB   GLU  58          2HB       GLU  58  64.609  -8.618  -8.863
  470   2HB   GLU  58          1HB       GLU  58  64.344  -8.463  -7.126
  471   1HG   GLU  58          2HG       GLU  58  62.290  -7.138  -7.584
  472   2HG   GLU  58          1HG       GLU  58  62.537  -7.381  -9.310
  473    H    GLN  59           H        GLN  59  62.953  -4.995  -7.940
  474    HA   GLN  59           HA       GLN  59  62.084  -3.523  -6.325
  475   1HB   GLN  59          2HB       GLN  59  63.076  -5.898  -4.748
  476   2HB   GLN  59          1HB       GLN  59  62.236  -4.560  -3.964
  477   1HG   GLN  59          2HG       GLN  59  60.305  -4.869  -5.433
  478   2HG   GLN  59          1HG       GLN  59  61.142  -6.153  -6.299
  479   1HE2  GLN  59          1HE2      GLN  59  61.126  -8.253  -5.380
  480   2HE2  GLN  59          2HE2      GLN  59  60.382  -8.622  -3.900
  481    H    GLY  60           H        GLY  60  65.160  -3.394  -7.013
  482   1HA   GLY  60          2HA       GLY  60  66.729  -1.728  -6.488
  483   2HA   GLY  60          1HA       GLY  60  65.550  -1.085  -5.348
  484    H    SER  61           H        SER  61  66.486  -4.404  -4.929
  485    HA   SER  61           HA       SER  61  67.480  -3.818  -2.256
  486   1HB   SER  61          2HB       SER  61  67.550  -6.395  -3.859
  487   2HB   SER  61          1HB       SER  61  67.605  -6.245  -2.105
  488    HG   SER  61           HG       SER  61  65.504  -6.696  -2.716
  489    H    VAL  62           H        VAL  62  69.609  -3.988  -1.515
  490    HA   VAL  62           HA       VAL  62  71.751  -4.725  -3.451
  491    HB   VAL  62           HB       VAL  62  71.497  -2.271  -3.479
  492   1HG1  VAL  62          1HG1      VAL  62  71.805  -0.943  -1.465
  493   2HG1  VAL  62          2HG1      VAL  62  72.091  -2.397  -0.508
  494   3HG1  VAL  62          3HG1      VAL  62  70.495  -2.090  -1.193
  495   1HG2  VAL  62          1HG2      VAL  62  73.942  -2.804  -1.806
  496   2HG2  VAL  62          2HG2      VAL  62  73.771  -1.764  -3.220
  497   3HG2  VAL  62          3HG2      VAL  62  73.798  -3.517  -3.413
  498    H    ILE  63           H        ILE  63  73.537  -5.741  -2.416
  499    HA   ILE  63           HA       ILE  63  73.015  -6.523   0.427
  500    HB   ILE  63           HB       ILE  63  74.645  -7.866  -1.757
  501   1HG1  ILE  63          2HG1      ILE  63  72.264  -7.781  -2.384
  502   2HG1  ILE  63          1HG1      ILE  63  72.724  -9.427  -1.955
  503   1HG2  ILE  63          1HG2      ILE  63  75.445  -8.826   0.184
  504   2HG2  ILE  63          2HG2      ILE  63  74.044  -9.857  -0.103
  505   3HG2  ILE  63          3HG2      ILE  63  73.946  -8.543   1.069
  506   1HD1  ILE  63          1HD1      ILE  63  70.549  -8.793  -0.950
  507   2HD1  ILE  63          2HD1      ILE  63  71.336  -7.463  -0.102
  508   3HD1  ILE  63          3HD1      ILE  63  71.758  -9.131   0.288
  509    H    ILE  64           H        ILE  64  74.402  -5.726   1.935
  510    HA   ILE  64           HA       ILE  64  77.018  -4.550   1.226
  511    HB   ILE  64           HB       ILE  64  75.640  -5.144   3.874
  512   1HG1  ILE  64          2HG1      ILE  64  75.907  -2.499   2.418
  513   2HG1  ILE  64          1HG1      ILE  64  74.489  -3.537   2.268
  514   1HG2  ILE  64          1HG2      ILE  64  78.120  -4.873   4.028
  515   2HG2  ILE  64          2HG2      ILE  64  77.242  -3.580   4.844
  516   3HG2  ILE  64          3HG2      ILE  64  77.964  -3.292   3.261
  517   1HD1  ILE  64          1HD1      ILE  64  74.056  -1.888   4.000
  518   2HD1  ILE  64          2HD1      ILE  64  75.562  -2.301   4.819
  519   3HD1  ILE  64          3HD1      ILE  64  74.240  -3.468   4.761
  520    HA   PRO  65           HA       PRO  65  79.197  -8.415   1.576
  521   1HB   PRO  65          2HB       PRO  65  81.669  -7.519   2.330
  522   2HB   PRO  65          1HB       PRO  65  81.042  -7.321   0.678
  523   1HG   PRO  65          2HG       PRO  65  80.966  -5.373   2.955
  524   2HG   PRO  65          1HG       PRO  65  81.536  -5.114   1.292
  525   1HD   PRO  65          2HD       PRO  65  79.107  -4.326   1.981
  526   2HD   PRO  65          1HD       PRO  65  79.357  -5.146   0.418
  527    H    LYS  66           H        LYS  66  79.264  -9.886   3.233
  528    HA   LYS  66           HA       LYS  66  78.523  -9.332   5.907
  529   1HB   LYS  66          2HB       LYS  66  78.472 -11.533   4.723
  530   2HB   LYS  66          1HB       LYS  66  80.229 -11.611   4.852
  531   1HG   LYS  66          2HG       LYS  66  80.034 -11.476   7.325
  532   2HG   LYS  66          1HG       LYS  66  78.276 -11.471   7.169
  533   1HD   LYS  66          2HD       LYS  66  78.433 -13.667   5.969
  534   2HD   LYS  66          1HD       LYS  66  80.163 -13.685   6.314
  535   1HE   LYS  66          2HE       LYS  66  79.461 -14.838   8.186
  536   2HE   LYS  66          1HE       LYS  66  79.189 -13.199   8.810
  537   1HZ   LYS  66          1HZ       LYS  66  76.946 -13.247   8.058
  538   2HZ   LYS  66          2HZ       LYS  66  77.202 -14.677   8.940
  539   3HZ   LYS  66          3HZ       LYS  66  77.177 -14.716   7.242
  540    H    ALA  67           H        ALA  67  81.730  -9.455   4.428
  541    HA   ALA  67           HA       ALA  67  83.358  -9.533   6.758
  542   1HB   ALA  67          1HB       ALA  67  83.654  -8.358   3.991
  543   2HB   ALA  67          2HB       ALA  67  84.365  -9.840   4.631
  544   3HB   ALA  67          3HB       ALA  67  84.968  -8.270   5.164
  545    H    LEU  68           H        LEU  68  81.821  -6.788   5.115
  546    HA   LEU  68           HA       LEU  68  83.009  -4.781   6.880
  547   1HB   LEU  68          2HB       LEU  68  80.758  -4.771   4.849
  548   2HB   LEU  68          1HB       LEU  68  81.296  -3.323   5.697
  549    HG   LEU  68           HG       LEU  68  83.040  -5.085   3.941
  550   1HD1  LEU  68          1HD1      LEU  68  81.183  -3.384   3.024
  551   2HD1  LEU  68          2HD1      LEU  68  82.755  -3.551   2.242
  552   3HD1  LEU  68          3HD1      LEU  68  82.462  -2.215   3.354
  553   1HD2  LEU  68          1HD2      LEU  68  83.576  -2.703   5.700
  554   2HD2  LEU  68          2HD2      LEU  68  84.516  -2.912   4.223
  555   3HD2  LEU  68          3HD2      LEU  68  84.548  -4.157   5.472
  556    H    ARG  69           H        ARG  69  79.972  -6.632   6.792
  557    HA   ARG  69           HA       ARG  69  78.444  -5.160   8.705
  558   1HB   ARG  69          2HB       ARG  69  78.667  -8.177   8.373
  559   2HB   ARG  69          1HB       ARG  69  77.307  -7.313   9.075
  560   1HG   ARG  69          2HG       ARG  69  77.002  -6.170   6.833
  561   2HG   ARG  69          1HG       ARG  69  78.200  -7.294   6.185
  562   1HD   ARG  69          2HD       ARG  69  76.659  -9.095   7.417
  563   2HD   ARG  69          1HD       ARG  69  75.422  -7.854   7.149
  564    HE   ARG  69           HE       ARG  69  76.616  -7.954   4.701
  565   1HH1  ARG  69          1HH1      ARG  69  75.416 -10.504   6.801
  566   2HH1  ARG  69          2HH1      ARG  69  75.110 -11.571   5.478
  567   1HH2  ARG  69          1HH2      ARG  69  76.187  -9.380   3.042
  568   2HH2  ARG  69          2HH2      ARG  69  75.537 -10.947   3.380
  569    H    ASP  70           H        ASP  70  80.783  -7.803   9.149
  570    HA   ASP  70           HA       ASP  70  80.497  -7.989  12.004
  571   1HB   ASP  70          2HB       ASP  70  81.375  -9.727  10.399
  572   2HB   ASP  70          1HB       ASP  70  82.852  -8.775  10.256
  573    H    VAL  71           H        VAL  71  83.021  -6.458   9.974
  574    HA   VAL  71           HA       VAL  71  84.673  -5.508  12.100
  575    HB   VAL  71           HB       VAL  71  84.108  -4.439   9.309
  576   1HG1  VAL  71          1HG1      VAL  71  86.464  -3.889  11.141
  577   2HG1  VAL  71          2HG1      VAL  71  85.210  -2.728  10.705
  578   3HG1  VAL  71          3HG1      VAL  71  86.311  -3.342   9.471
  579   1HG2  VAL  71          1HG2      VAL  71  84.905  -6.766   9.381
  580   2HG2  VAL  71          2HG2      VAL  71  86.262  -6.277  10.396
  581   3HG2  VAL  71          3HG2      VAL  71  86.156  -5.706   8.731
  582    H    ILE  72           H        ILE  72  81.853  -4.052  10.526
  583    HA   ILE  72           HA       ILE  72  82.098  -1.530  11.978
  584    HB   ILE  72           HB       ILE  72  79.896  -2.706  10.239
  585   1HG1  ILE  72          2HG1      ILE  72  82.125  -0.769   9.529
  586   2HG1  ILE  72          1HG1      ILE  72  82.158  -2.492   9.159
  587   1HG2  ILE  72          1HG2      ILE  72  78.875  -0.628  10.220
  588   2HG2  ILE  72          2HG2      ILE  72  80.381   0.231  10.535
  589   3HG2  ILE  72          3HG2      ILE  72  79.544  -0.590  11.849
  590   1HD1  ILE  72          1HD1      ILE  72  80.413  -0.341   8.010
  591   2HD1  ILE  72          2HD1      ILE  72  79.807  -2.000   8.070
  592   3HD1  ILE  72          3HD1      ILE  72  81.286  -1.630   7.181
  593    H    GLY  73           H        GLY  73  80.583  -4.604  12.646
  594   1HA   GLY  73          2HA       GLY  73  79.542  -5.283  14.645
  595   2HA   GLY  73          1HA       GLY  73  79.759  -3.643  15.256
  596    H    ILE  74           H        ILE  74  78.073  -4.483  12.264
  597    HA   ILE  74           HA       ILE  74  75.756  -2.907  13.181
  598    HB   ILE  74           HB       ILE  74  76.372  -4.288  10.547
  599   1HG1  ILE  74          2HG1      ILE  74  78.111  -2.646  11.123
  600   2HG1  ILE  74          1HG1      ILE  74  77.119  -2.041   9.800
  601   1HG2  ILE  74          1HG2      ILE  74  74.221  -2.438  11.489
  602   2HG2  ILE  74          2HG2      ILE  74  74.125  -3.790  10.360
  603   3HG2  ILE  74          3HG2      ILE  74  74.815  -2.254   9.838
  604   1HD1  ILE  74          1HD1      ILE  74  77.285  -1.099  12.634
  605   2HD1  ILE  74          2HD1      ILE  74  75.727  -0.974  11.819
  606   3HD1  ILE  74          3HD1      ILE  74  77.141  -0.162  11.148
  607    H    LYS  75           H        LYS  75  73.665  -3.709  13.450
  608    HA   LYS  75           HA       LYS  75  73.296  -6.681  13.287
  609   1HB   LYS  75          2HB       LYS  75  72.651  -4.696  15.481
  610   2HB   LYS  75          1HB       LYS  75  71.967  -6.322  15.443
  611   1HG   LYS  75          2HG       LYS  75  73.968  -7.325  15.947
  612   2HG   LYS  75          1HG       LYS  75  74.912  -6.114  15.080
  613   1HD   LYS  75          2HD       LYS  75  74.894  -4.620  16.875
  614   2HD   LYS  75          1HD       LYS  75  73.445  -5.334  17.583
  615   1HE   LYS  75          2HE       LYS  75  74.803  -7.417  18.065
  616   2HE   LYS  75          1HE       LYS  75  76.244  -6.508  17.567
  617   1HZ   LYS  75          1HZ       LYS  75  74.320  -5.733  19.695
  618   2HZ   LYS  75          2HZ       LYS  75  75.611  -4.767  19.159
  619   3HZ   LYS  75          3HZ       LYS  75  75.918  -6.250  19.930
  620    HA   PRO  76           HA       PRO  76  69.479  -5.960  11.219
  621   1HB   PRO  76          2HB       PRO  76  67.671  -7.482  12.710
  622   2HB   PRO  76          1HB       PRO  76  68.701  -8.102  11.406
  623   1HG   PRO  76          2HG       PRO  76  69.061  -8.268  14.343
  624   2HG   PRO  76          1HG       PRO  76  69.509  -9.423  13.079
  625   1HD   PRO  76          2HD       PRO  76  71.318  -7.849  14.327
  626   2HD   PRO  76          1HD       PRO  76  71.501  -8.368  12.637
  627    H    GLY  77           H        GLY  77  68.024  -4.288  11.315
  628   1HA   GLY  77          2HA       GLY  77  66.274  -2.980  12.270
  629   2HA   GLY  77          1HA       GLY  77  66.669  -3.645  13.851
  630    H    GLU  78           H        GLU  78  69.583  -2.665  12.518
  631    HA   GLU  78           HA       GLU  78  69.509  -0.133  14.080
  632   1HB   GLU  78          2HB       GLU  78  71.533  -2.140  13.220
  633   2HB   GLU  78          1HB       GLU  78  72.092  -0.477  13.396
  634   1HG   GLU  78          2HG       GLU  78  71.060  -0.425  15.678
  635   2HG   GLU  78          1HG       GLU  78  70.674  -2.136  15.500
  636    H    VAL  79           H        VAL  79  69.579   1.818  13.087
  637    HA   VAL  79           HA       VAL  79  69.433   1.839  10.146
  638    HB   VAL  79           HB       VAL  79  67.748   2.930  11.612
  639   1HG1  VAL  79          1HG1      VAL  79  68.364   5.092  12.702
  640   2HG1  VAL  79          2HG1      VAL  79  70.055   4.762  12.339
  641   3HG1  VAL  79          3HG1      VAL  79  69.167   3.709  13.439
  642   1HG2  VAL  79          1HG2      VAL  79  67.707   3.866   9.486
  643   2HG2  VAL  79          2HG2      VAL  79  69.356   4.478   9.613
  644   3HG2  VAL  79          3HG2      VAL  79  68.047   5.292  10.467
  645    H    ILE  80           H        ILE  80  70.884   2.753   8.800
  646    HA   ILE  80           HA       ILE  80  73.213   4.243   9.941
  647    HB   ILE  80           HB       ILE  80  74.580   3.076   8.218
  648   1HG1  ILE  80          2HG1      ILE  80  72.046   1.503   7.660
  649   2HG1  ILE  80          1HG1      ILE  80  72.706   2.753   6.602
  650   1HG2  ILE  80          1HG2      ILE  80  74.790   1.080   9.414
  651   2HG2  ILE  80          2HG2      ILE  80  73.050   0.927   9.657
  652   3HG2  ILE  80          3HG2      ILE  80  73.969   2.116  10.581
  653   1HD1  ILE  80          1HD1      ILE  80  73.658  -0.018   7.079
  654   2HD1  ILE  80          2HD1      ILE  80  74.915   1.213   6.952
  655   3HD1  ILE  80          3HD1      ILE  80  73.774   0.979   5.628
  656    H    GLU  81           H        GLU  81  74.143   5.775   8.383
  657    HA   GLU  81           HA       GLU  81  72.157   6.866   6.442
  658   1HB   GLU  81          2HB       GLU  81  73.167   8.319   8.212
  659   2HB   GLU  81          1HB       GLU  81  74.763   7.985   7.539
  660   1HG   GLU  81          2HG       GLU  81  73.998   8.929   5.358
  661   2HG   GLU  81          1HG       GLU  81  72.463   9.356   6.116
  662    H    VAL  82           H        VAL  82  72.525   6.560   4.305
  663    HA   VAL  82           HA       VAL  82  75.062   5.204   3.513
  664    HB   VAL  82           HB       VAL  82  72.227   5.128   2.416
  665   1HG1  VAL  82          1HG1      VAL  82  73.749   4.664   0.613
  666   2HG1  VAL  82          2HG1      VAL  82  73.126   3.110   1.172
  667   3HG1  VAL  82          3HG1      VAL  82  74.745   3.632   1.641
  668   1HG2  VAL  82          1HG2      VAL  82  72.164   3.951   4.445
  669   2HG2  VAL  82          2HG2      VAL  82  73.827   3.388   4.278
  670   3HG2  VAL  82          3HG2      VAL  82  72.553   2.677   3.287
  671    H    LEU  83           H        LEU  83  76.327   6.179   2.031
  672    HA   LEU  83           HA       LEU  83  75.244   8.508   0.467
  673   1HB   LEU  83          2HB       LEU  83  78.129   7.907   1.229
  674   2HB   LEU  83          1HB       LEU  83  77.486   9.427   0.622
  675    HG   LEU  83           HG       LEU  83  76.812   8.174   3.304
  676   1HD1  LEU  83          1HD1      LEU  83  78.160   9.936   4.263
  677   2HD1  LEU  83          2HD1      LEU  83  78.412  10.670   2.679
  678   3HD1  LEU  83          3HD1      LEU  83  79.137   9.104   3.051
  679   1HD2  LEU  83          1HD2      LEU  83  74.923   9.426   2.621
  680   2HD2  LEU  83          2HD2      LEU  83  75.915  10.688   1.889
  681   3HD2  LEU  83          3HD2      LEU  83  75.835  10.535   3.645
  682    H    LEU  84           H        LEU  84  75.297   8.191  -1.767
  683    HA   LEU  84           HA       LEU  84  76.655   5.836  -2.924
  684   1HB   LEU  84          2HB       LEU  84  74.860   8.052  -3.850
  685   2HB   LEU  84          1HB       LEU  84  75.809   7.167  -5.049
  686    HG   LEU  84           HG       LEU  84  74.341   5.572  -2.997
  687   1HD1  LEU  84          1HD1      LEU  84  73.009   7.484  -4.690
  688   2HD1  LEU  84          2HD1      LEU  84  72.298   6.325  -3.573
  689   3HD1  LEU  84          3HD1      LEU  84  72.606   5.860  -5.244
  690   1HD2  LEU  84          1HD2      LEU  84  75.481   4.167  -4.427
  691   2HD2  LEU  84          2HD2      LEU  84  75.402   5.302  -5.774
  692   3HD2  LEU  84          3HD2      LEU  84  73.989   4.333  -5.354
  693    H    LEU  85           H        LEU  85  78.584   5.924  -4.069
  694    HA   LEU  85           HA       LEU  85  80.104   8.486  -3.866
  695   1HB   LEU  85          2HB       LEU  85  80.684   5.570  -3.609
  696   2HB   LEU  85          1HB       LEU  85  81.982   6.600  -4.222
  697    HG   LEU  85           HG       LEU  85  80.432   7.360  -1.749
  698   1HD1  LEU  85          1HD1      LEU  85  82.916   5.623  -1.903
  699   2HD1  LEU  85          2HD1      LEU  85  81.320   5.098  -1.362
  700   3HD1  LEU  85          3HD1      LEU  85  82.224   6.284  -0.420
  701   1HD2  LEU  85          1HD2      LEU  85  81.758   9.151  -2.536
  702   2HD2  LEU  85          2HD2      LEU  85  83.075   8.081  -3.017
  703   3HD2  LEU  85          3HD2      LEU  85  82.774   8.396  -1.309
  704    H    GLY  86           H        GLY  86  79.218   5.865  -6.094
  705   1HA   GLY  86          2HA       GLY  86  79.732   7.556  -8.424
  706   2HA   GLY  86          1HA       GLY  86  80.969   6.322  -8.219
  707    H    HIS  87           H        HIS  87  79.863   5.887 -10.474
  708    HA   HIS  87           HA       HIS  87  77.856   3.706 -10.074
  709   1HB   HIS  87          2HB       HIS  87  76.527   4.688 -11.940
  710   2HB   HIS  87          1HB       HIS  87  76.649   5.793 -10.577
  711    HD1  HIS  87           HD1      HIS  87  77.912   5.273 -14.085
  712    HD2  HIS  87           HD2      HIS  87  78.126   8.158 -11.085
  713    HE1  HIS  87           HE1      HIS  87  78.919   7.340 -15.150
  714    H    TYR  88           H        TYR  88  77.863   2.131 -11.815
  715    HA   TYR  88           HA       TYR  88  79.960   2.465 -13.914
  716   1HB   TYR  88          2HB       TYR  88  79.584   0.152 -11.989
  717   2HB   TYR  88          1HB       TYR  88  80.609   0.067 -13.422
  718    HD1  TYR  88           HD1      TYR  88  80.252   1.410 -10.002
  719    HD2  TYR  88           HD2      TYR  88  82.641   1.531 -13.643
  720    HE1  TYR  88           HE1      TYR  88  82.121   2.524  -8.741
  721    HE2  TYR  88           HE2      TYR  88  84.509   2.644 -12.380
  722    HH   TYR  88           HH       TYR  88  84.356   4.223  -9.853
  723    H    LYS  89           H        LYS  89  79.365   1.535 -15.888
  724    HA   LYS  89           HA       LYS  89  76.735   0.087 -15.970
  725   1HB   LYS  89          2HB       LYS  89  77.472   2.594 -17.034
  726   2HB   LYS  89          1HB       LYS  89  77.483   1.499 -18.416
  727   1HG   LYS  89          2HG       LYS  89  75.186   0.682 -17.440
  728   2HG   LYS  89          1HG       LYS  89  75.200   2.238 -16.608
  729   1HD   LYS  89          2HD       LYS  89  75.870   3.092 -19.061
  730   2HD   LYS  89          1HD       LYS  89  74.964   1.649 -19.521
  731   1HE   LYS  89          2HE       LYS  89  73.029   2.427 -18.195
  732   2HE   LYS  89          1HE       LYS  89  73.936   3.879 -17.726
  733   1HZ   LYS  89          1HZ       LYS  89  74.280   4.303 -20.134
  734   2HZ   LYS  89          2HZ       LYS  89  72.655   4.416 -19.650
  735   3HZ   LYS  89          3HZ       LYS  89  73.204   3.038 -20.478
  736    HA   PRO  90           HA       PRO  90  78.682  -3.283 -18.080
  737   1HB   PRO  90          2HB       PRO  90  76.623  -2.898 -20.234
  738   2HB   PRO  90          1HB       PRO  90  77.069  -4.379 -19.355
  739   1HG   PRO  90          2HG       PRO  90  74.851  -3.170 -18.710
  740   2HG   PRO  90          1HG       PRO  90  75.941  -3.709 -17.417
  741   1HD   PRO  90          2HD       PRO  90  75.571  -0.947 -18.532
  742   2HD   PRO  90          1HD       PRO  90  75.691  -1.469 -16.832
  743    H    ARG  91           H        ARG  91  80.307  -3.522 -19.642
  744    HA   ARG  91           HA       ARG  91  80.535  -1.393 -21.744
  745   1HB   ARG  91          2HB       ARG  91  82.023  -1.066 -19.757
  746   2HB   ARG  91          1HB       ARG  91  82.744  -2.644 -20.078
  747   1HG   ARG  91          2HG       ARG  91  83.422  -1.858 -22.331
  748   2HG   ARG  91          1HG       ARG  91  82.748  -0.270 -21.965
  749   1HD   ARG  91          2HD       ARG  91  84.311  -0.099 -20.012
  750   2HD   ARG  91          1HD       ARG  91  85.049  -1.630 -20.522
  751    HE   ARG  91           HE       ARG  91  84.847   0.358 -22.666
  752   1HH1  ARG  91          1HH1      ARG  91  86.842  -0.882 -20.058
  753   2HH1  ARG  91          2HH1      ARG  91  88.298  -0.274 -20.761
  754   1HH2  ARG  91          1HH2      ARG  91  86.759   1.119 -23.523
  755   2HH2  ARG  91          2HH2      ARG  91  88.256   0.844 -22.695
  756    H    ASN  92           H        ASN  92  81.155  -2.147 -23.771
  757    HA   ASN  92           HA       ASN  92  81.771  -5.076 -24.022
  758   1HB   ASN  92          2HB       ASN  92  79.462  -4.383 -24.694
  759   2HB   ASN  92          1HB       ASN  92  80.171  -3.284 -25.879
  760   1HD2  ASN  92          1HD2      ASN  92  80.141  -6.771 -24.974
  761   2HD2  ASN  92          2HD2      ASN  92  80.385  -7.336 -26.557
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1  82.947  12.586   0.874
    2   2H    MET   1          2H        MET   1  83.133  14.273   0.953
    3   3H    MET   1          3H        MET   1  84.490  13.259   1.083
    4    HA   MET   1           HA       MET   1  84.482  14.174  -1.119
    5   1HB   MET   1          2HB       MET   1  83.640  11.295  -0.742
    6   2HB   MET   1          1HB       MET   1  84.148  11.915  -2.314
    7   1HG   MET   1          2HG       MET   1  86.275  12.697  -1.264
    8   2HG   MET   1          1HG       MET   1  85.778  11.921   0.240
    9   1HE   MET   1          1HE       MET   1  86.968  11.690  -3.297
   10   2HE   MET   1          2HE       MET   1  85.434  10.876  -3.591
   11   3HE   MET   1          3HE       MET   1  86.942   9.977  -3.739
   12    H    ASP   2           H        ASP   2  83.192  13.348  -3.327
   13    HA   ASP   2           HA       ASP   2  80.667  14.805  -3.292
   14   1HB   ASP   2          2HB       ASP   2  82.046  13.048  -5.352
   15   2HB   ASP   2          1HB       ASP   2  80.647  14.066  -5.689
   16    H    VAL   3           H        VAL   3  78.561  13.919  -3.475
   17    HA   VAL   3           HA       VAL   3  78.339  10.958  -3.235
   18    HB   VAL   3           HB       VAL   3  78.090  12.435  -1.114
   19   1HG1  VAL   3          1HG1      VAL   3  76.555  14.113  -2.230
   20   2HG1  VAL   3          2HG1      VAL   3  75.961  13.471  -0.698
   21   3HG1  VAL   3          3HG1      VAL   3  75.306  12.862  -2.223
   22   1HG2  VAL   3          1HG2      VAL   3  75.869  10.524  -1.886
   23   2HG2  VAL   3          2HG2      VAL   3  76.322  10.964  -0.239
   24   3HG2  VAL   3          3HG2      VAL   3  77.447  10.058  -1.251
   25    H    LEU   4           H        LEU   4  76.803  10.062  -4.579
   26    HA   LEU   4           HA       LEU   4  75.528  11.808  -6.571
   27   1HB   LEU   4          2HB       LEU   4  75.353   8.802  -6.185
   28   2HB   LEU   4          1HB       LEU   4  75.020   9.692  -7.665
   29    HG   LEU   4           HG       LEU   4  77.714   9.361  -6.300
   30   1HD1  LEU   4          1HD1      LEU   4  76.446   8.311  -8.817
   31   2HD1  LEU   4          2HD1      LEU   4  77.322   7.430  -7.564
   32   3HD1  LEU   4          3HD1      LEU   4  78.200   8.459  -8.697
   33   1HD2  LEU   4          1HD2      LEU   4  78.464  10.590  -8.499
   34   2HD2  LEU   4          2HD2      LEU   4  77.881  11.552  -7.135
   35   3HD2  LEU   4          3HD2      LEU   4  76.813  11.214  -8.502
   36    H    ALA   5           H        ALA   5  74.606  10.189  -3.619
   37    HA   ALA   5           HA       ALA   5  72.066  11.542  -3.514
   38   1HB   ALA   5          1HB       ALA   5  70.595   9.890  -4.186
   39   2HB   ALA   5          2HB       ALA   5  71.658   8.588  -3.651
   40   3HB   ALA   5          3HB       ALA   5  71.973   9.412  -5.178
   41    H    LYS   6           H        LYS   6  71.035  11.155  -1.426
   42    HA   LYS   6           HA       LYS   6  72.699   9.566   0.508
   43   1HB   LYS   6          2HB       LYS   6  73.171  12.040   0.435
   44   2HB   LYS   6          1HB       LYS   6  71.494  12.326   0.899
   45   1HG   LYS   6          2HG       LYS   6  71.828  11.069   2.975
   46   2HG   LYS   6          1HG       LYS   6  73.489  10.713   2.509
   47   1HD   LYS   6          2HD       LYS   6  73.675  13.332   2.284
   48   2HD   LYS   6          1HD       LYS   6  72.285  13.320   3.370
   49   1HE   LYS   6          2HE       LYS   6  73.906  11.504   4.614
   50   2HE   LYS   6          1HE       LYS   6  75.105  12.617   3.926
   51   1HZ   LYS   6          1HZ       LYS   6  72.706  13.430   5.482
   52   2HZ   LYS   6          2HZ       LYS   6  73.879  14.476   4.837
   53   3HZ   LYS   6          3HZ       LYS   6  74.291  13.399   6.085
   54    H    PHE   7           H        PHE   7  71.410   8.145   1.640
   55    HA   PHE   7           HA       PHE   7  68.654   8.947   2.398
   56   1HB   PHE   7          2HB       PHE   7  67.699   6.958   1.305
   57   2HB   PHE   7          1HB       PHE   7  68.532   7.971   0.131
   58    HD1  PHE   7           HD1      PHE   7  68.224   4.649   1.483
   59    HD2  PHE   7           HD2      PHE   7  71.055   7.377  -0.393
   60    HE1  PHE   7           HE1      PHE   7  69.666   2.698   0.817
   61    HE2  PHE   7           HE2      PHE   7  72.499   5.425  -1.050
   62    HZ   PHE   7           HZ       PHE   7  71.803   3.082  -0.440
   63    H    HIS   8           H        HIS   8  67.692   7.379   3.959
   64    HA   HIS   8           HA       HIS   8  69.837   6.072   5.608
   65   1HB   HIS   8          2HB       HIS   8  67.136   7.288   6.290
   66   2HB   HIS   8          1HB       HIS   8  68.229   6.557   7.465
   67    HD1  HIS   8           HD1      HIS   8  67.841   9.563   5.245
   68    HD2  HIS   8           HD2      HIS   8  70.529   8.115   8.085
   69    HE1  HIS   8           HE1      HIS   8  69.408  11.477   5.790
   70    H    THR   9           H        THR   9  69.571   3.933   6.188
   71    HA   THR   9           HA       THR   9  66.952   2.595   5.893
   72    HB   THR   9           HB       THR   9  68.103   2.561   3.648
   73    HG1  THR   9           HG1      THR   9  66.971   0.820   3.566
   74   1HG2  THR   9          1HG2      THR   9  70.140   0.875   5.129
   75   2HG2  THR   9          2HG2      THR   9  70.433   2.463   4.418
   76   3HG2  THR   9          3HG2      THR   9  70.073   1.083   3.379
   77    H    THR  10           H        THR  10  67.046   0.361   6.887
   78    HA   THR  10           HA       THR  10  69.262   0.180   8.893
   79    HB   THR  10           HB       THR  10  66.848   0.582   9.661
   80    HG1  THR  10           HG1      THR  10  67.537  -0.290  11.406
   81   1HG2  THR  10          1HG2      THR  10  66.235  -2.278   9.561
   82   2HG2  THR  10          2HG2      THR  10  66.234  -1.518   7.966
   83   3HG2  THR  10          3HG2      THR  10  65.185  -0.895   9.240
   84    H    VAL  11           H        VAL  11  70.004  -2.012   9.407
   85    HA   VAL  11           HA       VAL  11  70.394  -3.583   6.981
   86    HB   VAL  11           HB       VAL  11  71.199  -4.057   9.874
   87   1HG1  VAL  11          1HG1      VAL  11  71.282  -6.036   8.251
   88   2HG1  VAL  11          2HG1      VAL  11  72.802  -5.622   9.042
   89   3HG1  VAL  11          3HG1      VAL  11  72.516  -5.135   7.371
   90   1HG2  VAL  11          1HG2      VAL  11  73.446  -3.244   8.506
   91   2HG2  VAL  11          2HG2      VAL  11  72.436  -2.182   9.486
   92   3HG2  VAL  11          3HG2      VAL  11  72.193  -2.268   7.740
   93    H    HIS  12           H        HIS  12  69.391  -5.455   6.413
   94    HA   HIS  12           HA       HIS  12  67.502  -6.728   8.364
   95   1HB   HIS  12          2HB       HIS  12  67.408  -6.217   5.409
   96   2HB   HIS  12          1HB       HIS  12  66.566  -7.627   6.058
   97    HD1  HIS  12           HD1      HIS  12  66.861  -3.927   7.003
   98    HD2  HIS  12           HD2      HIS  12  64.007  -6.960   6.818
   99    HE1  HIS  12           HE1      HIS  12  64.670  -2.894   7.741
  100    H    ARG  13           H        ARG  13  67.227  -9.131   7.799
  101    HA   ARG  13           HA       ARG  13  69.492 -10.609   8.363
  102   1HB   ARG  13          2HB       ARG  13  67.047 -11.265   6.707
  103   2HB   ARG  13          1HB       ARG  13  68.177 -12.503   7.270
  104   1HG   ARG  13          2HG       ARG  13  67.803 -11.706   9.614
  105   2HG   ARG  13          1HG       ARG  13  66.581 -10.590   9.002
  106   1HD   ARG  13          2HD       ARG  13  65.363 -12.574   8.020
  107   2HD   ARG  13          1HD       ARG  13  66.511 -13.623   8.874
  108    HE   ARG  13           HE       ARG  13  65.687 -11.941  10.871
  109   1HH1  ARG  13          1HH1      ARG  13  63.895 -13.834   8.520
  110   2HH1  ARG  13          2HH1      ARG  13  62.534 -14.018   9.570
  111   1HH2  ARG  13          1HH2      ARG  13  63.902 -12.213  12.180
  112   2HH2  ARG  13          2HH2      ARG  13  62.536 -13.114  11.614
  113    H    ILE  14           H        ILE  14  70.980 -11.878   7.145
  114    HA   ILE  14           HA       ILE  14  72.515 -12.329   5.423
  115    HB   ILE  14           HB       ILE  14  70.322 -11.277   3.603
  116   1HG1  ILE  14          2HG1      ILE  14  70.852 -14.158   4.374
  117   2HG1  ILE  14          1HG1      ILE  14  69.656 -13.162   5.206
  118   1HG2  ILE  14          1HG2      ILE  14  71.550 -13.179   2.188
  119   2HG2  ILE  14          2HG2      ILE  14  72.904 -12.723   3.222
  120   3HG2  ILE  14          3HG2      ILE  14  72.129 -11.514   2.197
  121   1HD1  ILE  14          1HD1      ILE  14  69.612 -14.257   2.435
  122   2HD1  ILE  14          2HD1      ILE  14  68.914 -12.654   2.676
  123   3HD1  ILE  14          3HD1      ILE  14  68.285 -14.034   3.577
  124    H    GLY  15           H        GLY  15  71.756  -9.265   6.390
  125   1HA   GLY  15          2HA       GLY  15  73.044  -7.303   6.198
  126   2HA   GLY  15          1HA       GLY  15  74.059  -8.135   5.024
  127    H    ARG  16           H        ARG  16  70.674  -8.273   4.323
  128    HA   ARG  16           HA       ARG  16  71.111  -6.715   1.882
  129   1HB   ARG  16          2HB       ARG  16  69.842  -8.839   1.969
  130   2HB   ARG  16          1HB       ARG  16  68.675  -8.098   3.063
  131   1HG   ARG  16          2HG       ARG  16  68.004  -6.504   1.356
  132   2HG   ARG  16          1HG       ARG  16  69.265  -7.079   0.268
  133   1HD   ARG  16          2HD       ARG  16  67.184  -8.127  -0.415
  134   2HD   ARG  16          1HD       ARG  16  68.158  -9.376   0.383
  135    HE   ARG  16           HE       ARG  16  66.437  -7.874   2.217
  136   1HH1  ARG  16          1HH1      ARG  16  66.661 -10.669   0.104
  137   2HH1  ARG  16          2HH1      ARG  16  65.404 -11.513   0.936
  138   1HH2  ARG  16          1HH2      ARG  16  64.822  -9.013   3.249
  139   2HH2  ARG  16          2HH2      ARG  16  64.375 -10.591   2.693
  140    H    ILE  17           H        ILE  17  70.202  -4.719   1.404
  141    HA   ILE  17           HA       ILE  17  68.327  -3.503   3.380
  142    HB   ILE  17           HB       ILE  17  69.512  -1.342   3.123
  143   1HG1  ILE  17          2HG1      ILE  17  71.646  -2.878   1.613
  144   2HG1  ILE  17          1HG1      ILE  17  70.399  -1.930   0.803
  145   1HG2  ILE  17          1HG2      ILE  17  71.657  -3.334   3.793
  146   2HG2  ILE  17          2HG2      ILE  17  70.206  -3.251   4.791
  147   3HG2  ILE  17          3HG2      ILE  17  71.236  -1.831   4.614
  148   1HD1  ILE  17          1HD1      ILE  17  72.821  -0.929   1.637
  149   2HD1  ILE  17          2HD1      ILE  17  71.767  -0.486   2.979
  150   3HD1  ILE  17          3HD1      ILE  17  71.382   0.048   1.342
  151    H    ILE  18           H        ILE  18  66.820  -1.994   2.358
  152    HA   ILE  18           HA       ILE  18  66.729  -2.230  -0.637
  153    HB   ILE  18           HB       ILE  18  64.456  -1.850   1.342
  154   1HG1  ILE  18          2HG1      ILE  18  65.437  -4.093   1.586
  155   2HG1  ILE  18          1HG1      ILE  18  63.867  -4.204   0.794
  156   1HG2  ILE  18          1HG2      ILE  18  63.672  -0.971  -0.672
  157   2HG2  ILE  18          2HG2      ILE  18  63.198  -2.665  -0.820
  158   3HG2  ILE  18          3HG2      ILE  18  64.641  -2.077  -1.649
  159   1HD1  ILE  18          1HD1      ILE  18  65.033  -5.508  -0.686
  160   2HD1  ILE  18          2HD1      ILE  18  66.578  -4.755  -0.287
  161   3HD1  ILE  18          3HD1      ILE  18  65.459  -3.945  -1.384
  162    H    ILE  19           H        ILE  19  66.894  -0.314  -1.711
  163    HA   ILE  19           HA       ILE  19  66.952   2.237  -0.236
  164    HB   ILE  19           HB       ILE  19  67.098   1.562  -3.211
  165   1HG1  ILE  19          2HG1      ILE  19  69.229   1.973  -1.069
  166   2HG1  ILE  19          1HG1      ILE  19  68.903   0.488  -1.950
  167   1HG2  ILE  19          1HG2      ILE  19  67.997   4.073  -1.745
  168   2HG2  ILE  19          2HG2      ILE  19  66.454   3.939  -2.588
  169   3HG2  ILE  19          3HG2      ILE  19  67.964   3.810  -3.489
  170   1HD1  ILE  19          1HD1      ILE  19  70.441   1.134  -3.461
  171   2HD1  ILE  19          2HD1      ILE  19  70.596   2.711  -2.687
  172   3HD1  ILE  19          3HD1      ILE  19  69.362   2.452  -3.922
  173    HA   PRO  20           HA       PRO  20  62.610   3.142  -0.884
  174   1HB   PRO  20          2HB       PRO  20  62.751   5.877  -0.985
  175   2HB   PRO  20          1HB       PRO  20  62.843   4.971   0.537
  176   1HG   PRO  20          2HG       PRO  20  65.086   5.994  -1.173
  177   2HG   PRO  20          1HG       PRO  20  64.847   6.191   0.574
  178   1HD   PRO  20          2HD       PRO  20  66.498   4.327  -0.302
  179   2HD   PRO  20          1HD       PRO  20  65.363   3.938   1.020
  180    H    ALA  21           H        ALA  21  61.376   3.509  -2.739
  181    HA   ALA  21           HA       ALA  21  62.566   3.375  -5.300
  182   1HB   ALA  21          1HB       ALA  21  60.247   3.974  -6.067
  183   2HB   ALA  21          2HB       ALA  21  59.847   4.383  -4.398
  184   3HB   ALA  21          3HB       ALA  21  60.264   2.723  -4.824
  185    H    GLY  22           H        GLY  22  61.812   6.165  -3.295
  186   1HA   GLY  22          2HA       GLY  22  61.826   8.173  -5.346
  187   2HA   GLY  22          1HA       GLY  22  62.156   8.468  -3.639
  188    H    THR  23           H        THR  23  64.433   6.904  -3.269
  189    HA   THR  23           HA       THR  23  66.492   8.623  -4.347
  190    HB   THR  23           HB       THR  23  66.664   5.908  -2.997
  191    HG1  THR  23           HG1      THR  23  66.687   8.543  -1.951
  192   1HG2  THR  23          1HG2      THR  23  68.856   7.296  -2.206
  193   2HG2  THR  23          2HG2      THR  23  68.654   7.942  -3.836
  194   3HG2  THR  23          3HG2      THR  23  68.850   6.205  -3.591
  195    H    ARG  24           H        ARG  24  65.327   5.367  -5.197
  196    HA   ARG  24           HA       ARG  24  67.348   4.597  -7.061
  197   1HB   ARG  24          2HB       ARG  24  64.375   4.114  -7.410
  198   2HB   ARG  24          1HB       ARG  24  65.696   3.085  -7.945
  199   1HG   ARG  24          2HG       ARG  24  66.252   3.035  -5.345
  200   2HG   ARG  24          1HG       ARG  24  64.540   3.415  -5.216
  201   1HD   ARG  24          2HD       ARG  24  64.335   1.446  -7.011
  202   2HD   ARG  24          1HD       ARG  24  65.847   0.939  -6.223
  203    HE   ARG  24           HE       ARG  24  64.303   1.546  -4.071
  204   1HH1  ARG  24          1HH1      ARG  24  63.601  -0.390  -6.912
  205   2HH1  ARG  24          2HH1      ARG  24  62.491  -1.400  -6.057
  206   1HH2  ARG  24          1HH2      ARG  24  62.883   0.209  -3.025
  207   2HH2  ARG  24          2HH2      ARG  24  62.084  -1.069  -3.881
  208    H    LYS  25           H        LYS  25  64.415   6.565  -7.501
  209    HA   LYS  25           HA       LYS  25  64.630   6.889 -10.346
  210   1HB   LYS  25          2HB       LYS  25  62.588   7.281  -9.022
  211   2HB   LYS  25          1HB       LYS  25  63.370   8.618  -8.184
  212   1HG   LYS  25          2HG       LYS  25  61.918   9.478  -9.967
  213   2HG   LYS  25          1HG       LYS  25  63.606   9.815 -10.351
  214   1HD   LYS  25          2HD       LYS  25  63.695   7.882 -11.826
  215   2HD   LYS  25          1HD       LYS  25  62.041   7.443 -11.400
  216   1HE   LYS  25          2HE       LYS  25  61.542   8.652 -13.302
  217   2HE   LYS  25          1HE       LYS  25  61.676  10.033 -12.194
  218   1HZ   LYS  25          1HZ       LYS  25  63.123  10.239 -14.177
  219   2HZ   LYS  25          2HZ       LYS  25  63.960   8.847 -13.679
  220   3HZ   LYS  25          3HZ       LYS  25  63.989  10.249 -12.719
  221    H    PHE  26           H        PHE  26  65.570   9.057  -7.692
  222    HA   PHE  26           HA       PHE  26  66.644  11.191  -9.211
  223   1HB   PHE  26          2HB       PHE  26  66.176  11.152  -6.762
  224   2HB   PHE  26          1HB       PHE  26  67.574  10.101  -6.533
  225    HD1  PHE  26           HD1      PHE  26  69.827  10.969  -6.492
  226    HD2  PHE  26           HD2      PHE  26  66.496  13.506  -7.691
  227    HE1  PHE  26           HE1      PHE  26  71.334  12.982  -6.420
  228    HE2  PHE  26           HE2      PHE  26  68.002  15.519  -7.618
  229    HZ   PHE  26           HZ       PHE  26  70.421  15.256  -6.983
  230    H    TYR  27           H        TYR  27  68.190   8.192  -8.119
  231    HA   TYR  27           HA       TYR  27  70.827   8.980  -9.175
  232   1HB   TYR  27          2HB       TYR  27  70.402   7.703  -7.073
  233   2HB   TYR  27          1HB       TYR  27  69.770   6.376  -8.032
  234    HD1  TYR  27           HD1      TYR  27  71.360   5.330  -9.860
  235    HD2  TYR  27           HD2      TYR  27  72.719   7.884  -6.607
  236    HE1  TYR  27           HE1      TYR  27  73.679   4.398 -10.101
  237    HE2  TYR  27           HE2      TYR  27  75.044   6.962  -6.865
  238    HH   TYR  27           HH       TYR  27  76.053   4.734  -7.779
  239    H    GLY  28           H        GLY  28  68.019   7.386 -10.473
  240   1HA   GLY  28          2HA       GLY  28  67.678   6.571 -12.651
  241   2HA   GLY  28          1HA       GLY  28  69.356   6.976 -13.014
  242    H    ILE  29           H        ILE  29  68.095   4.809 -10.474
  243    HA   ILE  29           HA       ILE  29  70.044   2.753 -11.285
  244    HB   ILE  29           HB       ILE  29  67.977   2.868  -9.054
  245   1HG1  ILE  29          2HG1      ILE  29  70.959   3.429  -9.019
  246   2HG1  ILE  29          1HG1      ILE  29  69.703   4.661  -8.998
  247   1HG2  ILE  29          1HG2      ILE  29  69.923   1.218  -8.149
  248   2HG2  ILE  29          2HG2      ILE  29  70.023   0.866  -9.874
  249   3HG2  ILE  29          3HG2      ILE  29  68.502   0.633  -9.014
  250   1HD1  ILE  29          1HD1      ILE  29  69.789   4.501  -6.744
  251   2HD1  ILE  29          2HD1      ILE  29  70.706   2.991  -6.811
  252   3HD1  ILE  29          3HD1      ILE  29  68.945   2.964  -6.935
  253    H    GLU  30           H        GLU  30  69.563   1.067 -12.562
  254    HA   GLU  30           HA       GLU  30  66.749   0.048 -12.646
  255   1HB   GLU  30          2HB       GLU  30  67.405   1.324 -14.715
  256   2HB   GLU  30          1HB       GLU  30  68.722   0.175 -14.954
  257   1HG   GLU  30          2HG       GLU  30  67.052  -1.676 -15.013
  258   2HG   GLU  30          1HG       GLU  30  65.762  -0.483 -14.881
  259    H    GLN  31           H        GLN  31  66.673  -2.305 -12.879
  260    HA   GLN  31           HA       GLN  31  68.551  -3.756 -11.358
  261   1HB   GLN  31          2HB       GLN  31  66.214  -4.404 -12.042
  262   2HB   GLN  31          1HB       GLN  31  66.857  -4.821 -13.629
  263   1HG   GLN  31          2HG       GLN  31  68.379  -6.455 -12.605
  264   2HG   GLN  31          1HG       GLN  31  67.776  -6.027 -11.005
  265   1HE2  GLN  31          1HE2      GLN  31  67.514  -8.686 -11.764
  266   2HE2  GLN  31          2HE2      GLN  31  65.891  -9.046 -12.108
  267    H    GLY  32           H        GLY  32  70.427  -4.835 -11.823
  268   1HA   GLY  32          2HA       GLY  32  72.041  -5.936 -13.219
  269   2HA   GLY  32          1HA       GLY  32  71.286  -5.201 -14.630
  270    H    ASP  33           H        ASP  33  71.404  -2.533 -12.885
  271    HA   ASP  33           HA       ASP  33  73.927  -1.593 -14.040
  272   1HB   ASP  33          2HB       ASP  33  71.874  -0.405 -12.148
  273   2HB   ASP  33          1HB       ASP  33  73.232   0.502 -12.810
  274    H    PHE  34           H        PHE  34  75.712  -0.692 -12.719
  275    HA   PHE  34           HA       PHE  34  75.946  -2.007 -10.031
  276   1HB   PHE  34          2HB       PHE  34  77.952  -1.193 -12.149
  277   2HB   PHE  34          1HB       PHE  34  78.432  -1.650 -10.514
  278    HD1  PHE  34           HD1      PHE  34  76.902  -2.845 -13.698
  279    HD2  PHE  34           HD2      PHE  34  78.265  -3.964  -9.714
  280    HE1  PHE  34           HE1      PHE  34  76.757  -5.275 -14.332
  281    HE2  PHE  34           HE2      PHE  34  78.118  -6.395 -10.348
  282    HZ   PHE  34           HZ       PHE  34  77.365  -7.050 -12.656
  283    H    VAL  35           H        VAL  35  76.325  -0.657  -8.290
  284    HA   VAL  35           HA       VAL  35  77.008   2.199  -8.853
  285    HB   VAL  35           HB       VAL  35  75.399   2.831  -7.062
  286   1HG1  VAL  35          1HG1      VAL  35  73.408   2.546  -8.373
  287   2HG1  VAL  35          2HG1      VAL  35  74.035   1.080  -9.126
  288   3HG1  VAL  35          3HG1      VAL  35  74.747   2.646  -9.516
  289   1HG2  VAL  35          1HG2      VAL  35  74.823  -0.146  -7.076
  290   2HG2  VAL  35          2HG2      VAL  35  73.739   1.050  -6.360
  291   3HG2  VAL  35          3HG2      VAL  35  75.367   0.830  -5.711
  292    H    GLU  36           H        GLU  36  78.237   3.188  -7.099
  293    HA   GLU  36           HA       GLU  36  79.552   1.179  -5.296
  294   1HB   GLU  36          2HB       GLU  36  80.925   2.200  -7.141
  295   2HB   GLU  36          1HB       GLU  36  80.613   3.789  -6.440
  296   1HG   GLU  36          2HG       GLU  36  81.641   3.008  -4.303
  297   2HG   GLU  36          1HG       GLU  36  82.034   1.478  -5.083
  298    H    ILE  37           H        ILE  37  79.081   1.520  -3.190
  299    HA   ILE  37           HA       ILE  37  78.177   4.248  -2.360
  300    HB   ILE  37           HB       ILE  37  76.334   2.783  -3.094
  301   1HG1  ILE  37          2HG1      ILE  37  76.165   2.826  -0.093
  302   2HG1  ILE  37          1HG1      ILE  37  76.243   4.341  -0.991
  303   1HG2  ILE  37          1HG2      ILE  37  75.832   0.715  -1.805
  304   2HG2  ILE  37          2HG2      ILE  37  77.353   0.913  -0.933
  305   3HG2  ILE  37          3HG2      ILE  37  77.366   0.607  -2.670
  306   1HD1  ILE  37          1HD1      ILE  37  74.346   2.789  -2.376
  307   2HD1  ILE  37          2HD1      ILE  37  74.017   4.158  -1.315
  308   3HD1  ILE  37          3HD1      ILE  37  74.001   2.520  -0.666
  309    H    LYS  38           H        LYS  38  78.150   4.545  -0.006
  310    HA   LYS  38           HA       LYS  38  79.813   2.603   1.546
  311   1HB   LYS  38          2HB       LYS  38  81.083   4.608   0.666
  312   2HB   LYS  38          1HB       LYS  38  80.026   5.627   1.649
  313   1HG   LYS  38          2HG       LYS  38  80.744   4.491   3.679
  314   2HG   LYS  38          1HG       LYS  38  81.708   3.355   2.736
  315   1HD   LYS  38          2HD       LYS  38  83.155   5.099   3.671
  316   2HD   LYS  38          1HD       LYS  38  83.097   5.247   1.914
  317   1HE   LYS  38          2HE       LYS  38  82.026   7.269   2.001
  318   2HE   LYS  38          1HE       LYS  38  81.028   6.789   3.389
  319   1HZ   LYS  38          1HZ       LYS  38  82.632   8.383   4.138
  320   2HZ   LYS  38          2HZ       LYS  38  83.909   7.516   3.431
  321   3HZ   LYS  38          3HZ       LYS  38  83.071   6.867   4.759
  322    H    ILE  39           H        ILE  39  79.198   2.415   3.740
  323    HA   ILE  39           HA       ILE  39  76.754   3.960   4.563
  324    HB   ILE  39           HB       ILE  39  76.322   1.967   6.022
  325   1HG1  ILE  39          2HG1      ILE  39  78.504   0.592   4.440
  326   2HG1  ILE  39          1HG1      ILE  39  78.807   1.307   6.024
  327   1HG2  ILE  39          1HG2      ILE  39  76.160   0.366   3.841
  328   2HG2  ILE  39          2HG2      ILE  39  76.379   1.934   3.064
  329   3HG2  ILE  39          3HG2      ILE  39  75.032   1.681   4.177
  330   1HD1  ILE  39          1HD1      ILE  39  76.588  -0.106   6.607
  331   2HD1  ILE  39          2HD1      ILE  39  78.210  -0.788   6.736
  332   3HD1  ILE  39          3HD1      ILE  39  77.228  -1.109   5.305
  333    H    VAL  40           H        VAL  40  76.710   4.754   6.709
  334    HA   VAL  40           HA       VAL  40  79.185   4.466   8.349
  335    HB   VAL  40           HB       VAL  40  77.825   7.067   7.553
  336   1HG1  VAL  40          1HG1      VAL  40  80.064   6.391   9.457
  337   2HG1  VAL  40          2HG1      VAL  40  78.679   7.454   9.713
  338   3HG1  VAL  40          3HG1      VAL  40  80.006   7.968   8.670
  339   1HG2  VAL  40          1HG2      VAL  40  80.534   5.896   6.813
  340   2HG2  VAL  40          2HG2      VAL  40  79.983   7.517   6.389
  341   3HG2  VAL  40          3HG2      VAL  40  79.164   6.106   5.723
  342    H    LYS  41           H        LYS  41  78.564   3.924  10.372
  343    HA   LYS  41           HA       LYS  41  76.034   5.053  11.500
  344   1HB   LYS  41          2HB       LYS  41  75.821   2.656  10.739
  345   2HB   LYS  41          1HB       LYS  41  77.092   2.234  11.887
  346   1HG   LYS  41          2HG       LYS  41  75.673   3.296  13.697
  347   2HG   LYS  41          1HG       LYS  41  74.372   3.408  12.513
  348   1HD   LYS  41          2HD       LYS  41  74.544   0.938  12.158
  349   2HD   LYS  41          1HD       LYS  41  75.740   0.870  13.451
  350   1HE   LYS  41          2HE       LYS  41  72.880   1.866  13.756
  351   2HE   LYS  41          1HE       LYS  41  73.507   0.313  14.341
  352   1HZ   LYS  41          1HZ       LYS  41  73.680   1.812  16.144
  353   2HZ   LYS  41          2HZ       LYS  41  74.351   3.033  15.172
  354   3HZ   LYS  41          3HZ       LYS  41  75.251   1.639  15.532
  355    H    TYR  42           H        TYR  42  76.190   5.495  13.771
  356    HA   TYR  42           HA       TYR  42  78.997   5.630  14.784
  357   1HB   TYR  42          2HB       TYR  42  77.163   7.540  14.585
  358   2HB   TYR  42          1HB       TYR  42  76.626   6.878  16.130
  359    HD1  TYR  42           HD1      TYR  42  80.003   7.466  14.513
  360    HD2  TYR  42           HD2      TYR  42  77.437   8.109  17.973
  361    HE1  TYR  42           HE1      TYR  42  81.879   8.668  15.677
  362    HE2  TYR  42           HE2      TYR  42  79.312   9.313  19.140
  363    HH   TYR  42           HH       TYR  42  82.582   9.310  17.885
  364    H    GLU  43           H        GLU  43  79.653   4.274  16.411
  365    HA   GLU  43           HA       GLU  43  77.567   3.015  18.159
  366   1HB   GLU  43          2HB       GLU  43  79.977   1.732  16.825
  367   2HB   GLU  43          1HB       GLU  43  78.913   0.919  17.974
  368   1HG   GLU  43          2HG       GLU  43  76.990   1.347  16.457
  369   2HG   GLU  43          1HG       GLU  43  78.093   2.077  15.293
  370    H    GLY  44           H        GLY  44  78.070   3.233  20.306
  371   1HA   GLY  44          2HA       GLY  44  79.275   3.749  22.252
  372   2HA   GLY  44          1HA       GLY  44  80.677   3.049  21.441
  373    H    GLU  45           H        GLU  45  82.310   4.498  21.524
  374    HA   GLU  45           HA       GLU  45  81.701   7.396  21.123
  375   1HB   GLU  45          2HB       GLU  45  83.834   7.770  22.256
  376   2HB   GLU  45          1HB       GLU  45  82.848   6.668  23.211
  377   1HG   GLU  45          2HG       GLU  45  84.103   4.744  22.302
  378   2HG   GLU  45          1HG       GLU  45  85.078   5.837  21.324
  379    H    GLU  46           H        GLU  46  82.416   4.933  19.111
  380    HA   GLU  46           HA       GLU  46  84.284   6.599  17.469
  381   1HB   GLU  46          2HB       GLU  46  85.369   4.455  16.823
  382   2HB   GLU  46          1HB       GLU  46  85.458   4.741  18.559
  383   1HG   GLU  46          2HG       GLU  46  83.492   3.270  18.895
  384   2HG   GLU  46          1HG       GLU  46  83.437   2.963  17.159
  385    HA   PRO  47           HA       PRO  47  81.141   5.794  14.365
  386   1HB   PRO  47          2HB       PRO  47  82.469   6.778  12.184
  387   2HB   PRO  47          1HB       PRO  47  81.666   7.813  13.380
  388   1HG   PRO  47          2HG       PRO  47  84.543   7.208  13.034
  389   2HG   PRO  47          1HG       PRO  47  83.757   8.691  13.587
  390   1HD   PRO  47          2HD       PRO  47  84.989   6.846  15.230
  391   2HD   PRO  47          1HD       PRO  47  83.770   8.025  15.757
  392    H    LYS  48           H        LYS  48  80.775   4.034  13.028
  393    HA   LYS  48           HA       LYS  48  83.133   2.441  12.080
  394   1HB   LYS  48          2HB       LYS  48  80.283   1.603  12.716
  395   2HB   LYS  48          1HB       LYS  48  81.550   0.529  12.128
  396   1HG   LYS  48          2HG       LYS  48  81.789   2.147  14.676
  397   2HG   LYS  48          1HG       LYS  48  81.230   0.473  14.632
  398   1HD   LYS  48          2HD       LYS  48  83.363  -0.130  13.442
  399   2HD   LYS  48          1HD       LYS  48  83.926   1.516  13.732
  400   1HE   LYS  48          2HE       LYS  48  84.171   1.180  16.017
  401   2HE   LYS  48          1HE       LYS  48  82.903  -0.062  16.071
  402   1HZ   LYS  48          1HZ       LYS  48  85.573  -0.340  14.791
  403   2HZ   LYS  48          2HZ       LYS  48  84.344  -1.512  14.751
  404   3HZ   LYS  48          3HZ       LYS  48  85.075  -1.094  16.226
  405    H    GLU  49           H        GLU  49  83.254   2.153   9.855
  406    HA   GLU  49           HA       GLU  49  80.886   2.910   8.192
  407   1HB   GLU  49          2HB       GLU  49  82.422   4.280   6.800
  408   2HB   GLU  49          1HB       GLU  49  82.363   4.857   8.465
  409   1HG   GLU  49          2HG       GLU  49  84.437   3.536   8.944
  410   2HG   GLU  49          1HG       GLU  49  84.522   3.120   7.233
  411    H    GLY  50           H        GLY  50  81.231   2.254   5.863
  412   1HA   GLY  50          2HA       GLY  50  83.287   0.267   5.273
  413   2HA   GLY  50          1HA       GLY  50  81.663  -0.411   5.399
  414    H    THR  51           H        THR  51  83.662   0.272   3.074
  415    HA   THR  51           HA       THR  51  81.575   1.531   1.313
  416    HB   THR  51           HB       THR  51  84.558   1.618   0.832
  417    HG1  THR  51           HG1      THR  51  84.679   3.440   2.040
  418   1HG2  THR  51          1HG2      THR  51  84.021   3.026  -0.855
  419   2HG2  THR  51          2HG2      THR  51  82.884   3.924   0.149
  420   3HG2  THR  51          3HG2      THR  51  82.367   2.443  -0.660
  421    H    PHE  52           H        PHE  52  81.068   0.350  -0.527
  422    HA   PHE  52           HA       PHE  52  82.938  -1.675  -1.564
  423   1HB   PHE  52          2HB       PHE  52  81.541  -3.576  -1.097
  424   2HB   PHE  52          1HB       PHE  52  81.679  -2.677   0.408
  425    HD1  PHE  52           HD1      PHE  52  79.425  -4.196  -1.922
  426    HD2  PHE  52           HD2      PHE  52  79.747  -0.881   0.886
  427    HE1  PHE  52           HE1      PHE  52  76.920  -4.026  -1.837
  428    HE2  PHE  52           HE2      PHE  52  77.237  -0.713   0.972
  429    HZ   PHE  52           HZ       PHE  52  75.826  -2.286  -0.397
  430    H    THR  53           H        THR  53  81.836  -2.862  -3.493
  431    HA   THR  53           HA       THR  53  80.092  -0.941  -4.999
  432    HB   THR  53           HB       THR  53  81.878  -3.204  -5.960
  433    HG1  THR  53           HG1      THR  53  83.396  -1.789  -5.813
  434   1HG2  THR  53          1HG2      THR  53  81.561  -1.921  -8.164
  435   2HG2  THR  53          2HG2      THR  53  80.212  -1.113  -7.365
  436   3HG2  THR  53          3HG2      THR  53  80.185  -2.863  -7.590
  437    H    ALA  54           H        ALA  54  78.099  -1.705  -5.724
  438    HA   ALA  54           HA       ALA  54  77.410  -4.571  -5.238
  439   1HB   ALA  54          1HB       ALA  54  76.864  -2.503  -3.497
  440   2HB   ALA  54          2HB       ALA  54  75.942  -4.003  -3.582
  441   3HB   ALA  54          3HB       ALA  54  75.385  -2.575  -4.453
  442    H    ARG  55           H        ARG  55  75.785  -5.371  -6.607
  443    HA   ARG  55           HA       ARG  55  75.020  -3.645  -8.909
  444   1HB   ARG  55          2HB       ARG  55  75.994  -6.018  -9.066
  445   2HB   ARG  55          1HB       ARG  55  74.438  -6.578  -8.449
  446   1HG   ARG  55          2HG       ARG  55  73.276  -5.510 -10.319
  447   2HG   ARG  55          1HG       ARG  55  74.802  -4.867 -10.924
  448   1HD   ARG  55          2HD       ARG  55  74.333  -6.841 -12.218
  449   2HD   ARG  55          1HD       ARG  55  75.602  -7.307 -11.080
  450    HE   ARG  55           HE       ARG  55  72.743  -8.072 -10.919
  451   1HH1  ARG  55          1HH1      ARG  55  75.890  -8.067  -9.348
  452   2HH1  ARG  55          2HH1      ARG  55  75.444  -9.332  -8.267
  453   1HH2  ARG  55          1HH2      ARG  55  72.241  -9.696  -9.489
  454   2HH2  ARG  55          2HH2      ARG  55  73.414 -10.242  -8.338
  455    H    VAL  56           H        VAL  56  72.848  -3.178  -9.347
  456    HA   VAL  56           HA       VAL  56  70.997  -3.208  -7.082
  457    HB   VAL  56           HB       VAL  56  70.779  -2.334  -9.984
  458   1HG1  VAL  56          1HG1      VAL  56  68.994  -1.037  -8.048
  459   2HG1  VAL  56          2HG1      VAL  56  68.662  -2.759  -8.216
  460   3HG1  VAL  56          3HG1      VAL  56  68.633  -1.713  -9.637
  461   1HG2  VAL  56          1HG2      VAL  56  70.909  -0.456  -7.670
  462   2HG2  VAL  56          2HG2      VAL  56  71.558  -0.274  -9.300
  463   3HG2  VAL  56          3HG2      VAL  56  72.397  -1.284  -8.124
  464    H    GLY  57           H        GLY  57  69.572  -4.795  -6.669
  465   1HA   GLY  57          2HA       GLY  57  68.995  -6.818  -8.783
  466   2HA   GLY  57          1HA       GLY  57  68.796  -7.087  -7.050
  467    H    GLU  58           H        GLU  58  66.616  -7.817  -7.977
  468    HA   GLU  58           HA       GLU  58  64.681  -5.962  -8.979
  469   1HB   GLU  58          2HB       GLU  58  64.641  -8.520  -8.879
  470   2HB   GLU  58          1HB       GLU  58  64.160  -8.353  -7.189
  471   1HG   GLU  58          2HG       GLU  58  62.234  -6.933  -7.934
  472   2HG   GLU  58          1HG       GLU  58  62.679  -7.264  -9.603
  473    H    GLN  59           H        GLN  59  62.929  -4.935  -7.818
  474    HA   GLN  59           HA       GLN  59  62.072  -3.543  -6.128
  475   1HB   GLN  59          2HB       GLN  59  63.286  -5.774  -4.468
  476   2HB   GLN  59          1HB       GLN  59  62.171  -4.561  -3.842
  477   1HG   GLN  59          2HG       GLN  59  61.555  -6.451  -6.131
  478   2HG   GLN  59          1HG       GLN  59  61.013  -6.677  -4.470
  479   1HE2  GLN  59          1HE2      GLN  59  59.724  -5.782  -7.285
  480   2HE2  GLN  59          2HE2      GLN  59  58.671  -4.547  -6.793
  481    H    GLY  60           H        GLY  60  65.142  -3.370  -6.932
  482   1HA   GLY  60          2HA       GLY  60  66.728  -1.711  -6.446
  483   2HA   GLY  60          1HA       GLY  60  65.566  -1.048  -5.299
  484    H    SER  61           H        SER  61  66.488  -4.369  -4.853
  485    HA   SER  61           HA       SER  61  67.523  -3.749  -2.200
  486   1HB   SER  61          2HB       SER  61  67.522  -6.138  -1.962
  487   2HB   SER  61          1HB       SER  61  66.133  -5.752  -2.971
  488    HG   SER  61           HG       SER  61  67.283  -6.370  -4.763
  489    H    VAL  62           H        VAL  62  69.659  -3.987  -1.476
  490    HA   VAL  62           HA       VAL  62  71.759  -4.761  -3.439
  491    HB   VAL  62           HB       VAL  62  71.548  -2.302  -3.471
  492   1HG1  VAL  62          1HG1      VAL  62  70.570  -1.984  -1.244
  493   2HG1  VAL  62          2HG1      VAL  62  72.028  -1.006  -1.413
  494   3HG1  VAL  62          3HG1      VAL  62  72.077  -2.510  -0.493
  495   1HG2  VAL  62          1HG2      VAL  62  73.855  -1.774  -3.072
  496   2HG2  VAL  62          2HG2      VAL  62  73.810  -3.465  -3.575
  497   3HG2  VAL  62          3HG2      VAL  62  74.004  -3.057  -1.870
  498    H    ILE  63           H        ILE  63  73.548  -5.800  -2.425
  499    HA   ILE  63           HA       ILE  63  73.040  -6.583   0.419
  500    HB   ILE  63           HB       ILE  63  74.700  -7.901  -1.760
  501   1HG1  ILE  63          2HG1      ILE  63  72.325  -7.843  -2.408
  502   2HG1  ILE  63          1HG1      ILE  63  72.799  -9.483  -1.976
  503   1HG2  ILE  63          1HG2      ILE  63  73.900  -8.660   1.035
  504   2HG2  ILE  63          2HG2      ILE  63  75.479  -8.778   0.260
  505   3HG2  ILE  63          3HG2      ILE  63  74.201  -9.915  -0.167
  506   1HD1  ILE  63          1HD1      ILE  63  71.915  -8.231   0.421
  507   2HD1  ILE  63          2HD1      ILE  63  71.128  -9.533  -0.469
  508   3HD1  ILE  63          3HD1      ILE  63  70.727  -7.856  -0.826
  509    H    ILE  64           H        ILE  64  74.411  -5.748   1.926
  510    HA   ILE  64           HA       ILE  64  77.037  -4.586   1.229
  511    HB   ILE  64           HB       ILE  64  75.630  -5.148   3.867
  512   1HG1  ILE  64          2HG1      ILE  64  75.947  -2.489   2.460
  513   2HG1  ILE  64          1HG1      ILE  64  74.551  -3.530   2.179
  514   1HG2  ILE  64          1HG2      ILE  64  77.232  -3.561   4.828
  515   2HG2  ILE  64          2HG2      ILE  64  77.990  -3.342   3.251
  516   3HG2  ILE  64          3HG2      ILE  64  78.098  -4.899   4.072
  517   1HD1  ILE  64          1HD1      ILE  64  74.343  -1.724   4.020
  518   2HD1  ILE  64          2HD1      ILE  64  75.392  -2.771   4.974
  519   3HD1  ILE  64          3HD1      ILE  64  73.826  -3.361   4.422
  520    HA   PRO  65           HA       PRO  65  79.171  -8.470   1.612
  521   1HB   PRO  65          2HB       PRO  65  81.657  -7.594   2.342
  522   2HB   PRO  65          1HB       PRO  65  81.022  -7.406   0.690
  523   1HG   PRO  65          2HG       PRO  65  80.982  -5.434   2.948
  524   2HG   PRO  65          1HG       PRO  65  81.544  -5.199   1.280
  525   1HD   PRO  65          2HD       PRO  65  79.128  -4.376   1.973
  526   2HD   PRO  65          1HD       PRO  65  79.362  -5.215   0.417
  527    H    LYS  66           H        LYS  66  79.285  -9.929   3.285
  528    HA   LYS  66           HA       LYS  66  78.539  -9.354   5.954
  529   1HB   LYS  66          2HB       LYS  66  78.520 -11.569   4.790
  530   2HB   LYS  66          1HB       LYS  66  80.278 -11.622   4.929
  531   1HG   LYS  66          2HG       LYS  66  80.070 -11.460   7.398
  532   2HG   LYS  66          1HG       LYS  66  78.313 -11.479   7.236
  533   1HD   LYS  66          2HD       LYS  66  78.508 -13.686   6.055
  534   2HD   LYS  66          1HD       LYS  66  80.233 -13.679   6.423
  535   1HE   LYS  66          2HE       LYS  66  79.391 -14.890   8.244
  536   2HE   LYS  66          1HE       LYS  66  79.358 -13.242   8.902
  537   1HZ   LYS  66          1HZ       LYS  66  77.125 -14.702   7.599
  538   2HZ   LYS  66          2HZ       LYS  66  77.084 -13.039   7.943
  539   3HZ   LYS  66          3HZ       LYS  66  77.200 -14.169   9.207
  540    H    ALA  67           H        ALA  67  81.743  -9.449   4.469
  541    HA   ALA  67           HA       ALA  67  83.378  -9.466   6.797
  542   1HB   ALA  67          1HB       ALA  67  83.641  -8.358   4.002
  543   2HB   ALA  67          2HB       ALA  67  84.407  -9.789   4.692
  544   3HB   ALA  67          3HB       ALA  67  84.952  -8.181   5.167
  545    H    LEU  68           H        LEU  68  81.789  -6.774   5.116
  546    HA   LEU  68           HA       LEU  68  82.949  -4.719   6.841
  547   1HB   LEU  68          2HB       LEU  68  80.695  -4.786   4.817
  548   2HB   LEU  68          1HB       LEU  68  81.196  -3.314   5.645
  549    HG   LEU  68           HG       LEU  68  82.979  -5.054   3.906
  550   1HD1  LEU  68          1HD1      LEU  68  82.677  -3.525   2.198
  551   2HD1  LEU  68          2HD1      LEU  68  82.320  -2.201   3.307
  552   3HD1  LEU  68          3HD1      LEU  68  81.092  -3.419   2.963
  553   1HD2  LEU  68          1HD2      LEU  68  83.473  -2.538   5.516
  554   2HD2  LEU  68          2HD2      LEU  68  84.502  -2.991   4.157
  555   3HD2  LEU  68          3HD2      LEU  68  84.377  -4.052   5.561
  556    H    ARG  69           H        ARG  69  79.948  -6.625   6.799
  557    HA   ARG  69           HA       ARG  69  78.399  -5.153   8.692
  558   1HB   ARG  69          2HB       ARG  69  78.679  -8.167   8.385
  559   2HB   ARG  69          1HB       ARG  69  77.311  -7.329   9.101
  560   1HG   ARG  69          2HG       ARG  69  76.952  -6.199   6.863
  561   2HG   ARG  69          1HG       ARG  69  78.171  -7.291   6.202
  562   1HD   ARG  69          2HD       ARG  69  76.689  -9.132   7.445
  563   2HD   ARG  69          1HD       ARG  69  75.419  -7.922   7.192
  564    HE   ARG  69           HE       ARG  69  76.598  -7.987   4.733
  565   1HH1  ARG  69          1HH1      ARG  69  75.466 -10.566   6.836
  566   2HH1  ARG  69          2HH1      ARG  69  75.159 -11.631   5.513
  567   1HH2  ARG  69          1HH2      ARG  69  76.169  -9.410   3.073
  568   2HH2  ARG  69          2HH2      ARG  69  75.548 -10.990   3.411
  569    H    ASP  70           H        ASP  70  80.779  -7.753   9.178
  570    HA   ASP  70           HA       ASP  70  80.512  -7.875  12.040
  571   1HB   ASP  70          2HB       ASP  70  82.730  -8.717  10.144
  572   2HB   ASP  70          1HB       ASP  70  82.609  -9.230  11.826
  573    H    VAL  71           H        VAL  71  82.993  -6.353   9.951
  574    HA   VAL  71           HA       VAL  71  84.658  -5.335  12.033
  575    HB   VAL  71           HB       VAL  71  84.037  -4.321   9.234
  576   1HG1  VAL  71          1HG1      VAL  71  85.142  -2.574  10.569
  577   2HG1  VAL  71          2HG1      VAL  71  86.245  -3.215   9.349
  578   3HG1  VAL  71          3HG1      VAL  71  86.404  -3.715  11.033
  579   1HG2  VAL  71          1HG2      VAL  71  86.496  -5.842  10.032
  580   2HG2  VAL  71          2HG2      VAL  71  85.683  -5.774   8.468
  581   3HG2  VAL  71          3HG2      VAL  71  84.991  -6.725   9.782
  582    H    ILE  72           H        ILE  72  81.800  -3.948  10.466
  583    HA   ILE  72           HA       ILE  72  82.023  -1.395  11.865
  584    HB   ILE  72           HB       ILE  72  79.820  -2.646  10.181
  585   1HG1  ILE  72          2HG1      ILE  72  81.996  -0.671   9.412
  586   2HG1  ILE  72          1HG1      ILE  72  82.064  -2.399   9.068
  587   1HG2  ILE  72          1HG2      ILE  72  79.295  -0.605  11.724
  588   2HG2  ILE  72          2HG2      ILE  72  78.844  -0.504  10.024
  589   3HG2  ILE  72          3HG2      ILE  72  80.302   0.304  10.598
  590   1HD1  ILE  72          1HD1      ILE  72  81.165  -1.532   7.087
  591   2HD1  ILE  72          2HD1      ILE  72  80.208  -0.320   7.939
  592   3HD1  ILE  72          3HD1      ILE  72  79.720  -2.017   7.975
  593    H    GLY  73           H        GLY  73  80.553  -4.477  12.607
  594   1HA   GLY  73          2HA       GLY  73  79.510  -5.135  14.611
  595   2HA   GLY  73          1HA       GLY  73  79.727  -3.489  15.206
  596    H    ILE  74           H        ILE  74  78.049  -4.353  12.216
  597    HA   ILE  74           HA       ILE  74  75.712  -2.799  13.142
  598    HB   ILE  74           HB       ILE  74  76.375  -4.105  10.482
  599   1HG1  ILE  74          2HG1      ILE  74  78.080  -2.446  11.132
  600   2HG1  ILE  74          1HG1      ILE  74  77.104  -1.833   9.800
  601   1HG2  ILE  74          1HG2      ILE  74  74.086  -3.646  10.380
  602   2HG2  ILE  74          2HG2      ILE  74  74.786  -2.158   9.743
  603   3HG2  ILE  74          3HG2      ILE  74  74.224  -2.224  11.414
  604   1HD1  ILE  74          1HD1      ILE  74  76.826   0.015  11.085
  605   2HD1  ILE  74          2HD1      ILE  74  77.380  -0.811  12.541
  606   3HD1  ILE  74          3HD1      ILE  74  75.702  -0.966  12.023
  607    H    LYS  75           H        LYS  75  73.646  -3.640  13.426
  608    HA   LYS  75           HA       LYS  75  73.322  -6.615  13.182
  609   1HB   LYS  75          2HB       LYS  75  72.647  -4.684  15.415
  610   2HB   LYS  75          1HB       LYS  75  71.986  -6.318  15.345
  611   1HG   LYS  75          2HG       LYS  75  74.002  -7.303  15.827
  612   2HG   LYS  75          1HG       LYS  75  74.928  -6.059  14.985
  613   1HD   LYS  75          2HD       LYS  75  75.357  -5.836  17.359
  614   2HD   LYS  75          1HD       LYS  75  74.364  -4.470  16.850
  615   1HE   LYS  75          2HE       LYS  75  72.327  -5.759  17.607
  616   2HE   LYS  75          1HE       LYS  75  73.427  -6.970  18.295
  617   1HZ   LYS  75          1HZ       LYS  75  74.457  -5.324  19.640
  618   2HZ   LYS  75          2HZ       LYS  75  72.781  -5.165  19.871
  619   3HZ   LYS  75          3HZ       LYS  75  73.613  -4.066  18.878
  620    HA   PRO  76           HA       PRO  76  69.501  -5.933  11.118
  621   1HB   PRO  76          2HB       PRO  76  67.717  -7.515  12.573
  622   2HB   PRO  76          1HB       PRO  76  68.767  -8.091  11.266
  623   1HG   PRO  76          2HG       PRO  76  69.113  -8.299  14.202
  624   2HG   PRO  76          1HG       PRO  76  69.592  -9.423  12.921
  625   1HD   PRO  76          2HD       PRO  76  71.361  -7.836  14.205
  626   2HD   PRO  76          1HD       PRO  76  71.564  -8.323  12.506
  627    H    GLY  77           H        GLY  77  67.983  -4.315  11.231
  628   1HA   GLY  77          2HA       GLY  77  66.207  -3.058  12.206
  629   2HA   GLY  77          1HA       GLY  77  66.631  -3.722  13.781
  630    H    GLU  78           H        GLU  78  69.516  -2.675  12.460
  631    HA   GLU  78           HA       GLU  78  69.388  -0.154  14.032
  632   1HB   GLU  78          2HB       GLU  78  71.440  -2.130  13.176
  633   2HB   GLU  78          1HB       GLU  78  71.979  -0.459  13.338
  634   1HG   GLU  78          2HG       GLU  78  70.944  -0.410  15.626
  635   2HG   GLU  78          1HG       GLU  78  70.604  -2.131  15.460
  636    H    VAL  79           H        VAL  79  69.457   1.814  13.053
  637    HA   VAL  79           HA       VAL  79  69.318   1.873  10.112
  638    HB   VAL  79           HB       VAL  79  67.658   2.977  11.568
  639   1HG1  VAL  79          1HG1      VAL  79  69.304   5.255  12.356
  640   2HG1  VAL  79          2HG1      VAL  79  69.898   3.756  13.065
  641   3HG1  VAL  79          3HG1      VAL  79  68.230   4.257  13.336
  642   1HG2  VAL  79          1HG2      VAL  79  68.142   3.888   9.306
  643   2HG2  VAL  79          2HG2      VAL  79  69.343   4.968  10.016
  644   3HG2  VAL  79          3HG2      VAL  79  67.638   5.150  10.431
  645    H    ILE  80           H        ILE  80  70.866   2.653   8.801
  646    HA   ILE  80           HA       ILE  80  73.159   4.193   9.960
  647    HB   ILE  80           HB       ILE  80  74.559   3.012   8.271
  648   1HG1  ILE  80          2HG1      ILE  80  72.034   1.431   7.687
  649   2HG1  ILE  80          1HG1      ILE  80  72.722   2.662   6.626
  650   1HG2  ILE  80          1HG2      ILE  80  73.016   0.868   9.708
  651   2HG2  ILE  80          2HG2      ILE  80  73.914   2.071  10.636
  652   3HG2  ILE  80          3HG2      ILE  80  74.759   1.028   9.491
  653   1HD1  ILE  80          1HD1      ILE  80  74.907   1.064   7.103
  654   2HD1  ILE  80          2HD1      ILE  80  73.855   0.923   5.693
  655   3HD1  ILE  80          3HD1      ILE  80  73.597  -0.116   7.094
  656    H    GLU  81           H        GLU  81  74.096   5.723   8.391
  657    HA   GLU  81           HA       GLU  81  72.100   6.785   6.444
  658   1HB   GLU  81          2HB       GLU  81  73.097   8.223   8.252
  659   2HB   GLU  81          1HB       GLU  81  74.686   7.953   7.535
  660   1HG   GLU  81          2HG       GLU  81  73.862   8.930   5.401
  661   2HG   GLU  81          1HG       GLU  81  72.315   9.268   6.179
  662    H    VAL  82           H        VAL  82  72.488   6.523   4.301
  663    HA   VAL  82           HA       VAL  82  75.036   5.185   3.518
  664    HB   VAL  82           HB       VAL  82  72.214   5.115   2.390
  665   1HG1  VAL  82          1HG1      VAL  82  73.739   4.659   0.596
  666   2HG1  VAL  82          2HG1      VAL  82  73.140   3.095   1.154
  667   3HG1  VAL  82          3HG1      VAL  82  74.748   3.645   1.627
  668   1HG2  VAL  82          1HG2      VAL  82  73.793   3.357   4.254
  669   2HG2  VAL  82          2HG2      VAL  82  72.523   2.661   3.247
  670   3HG2  VAL  82          3HG2      VAL  82  72.131   3.926   4.413
  671    H    LEU  83           H        LEU  83  76.311   6.161   2.050
  672    HA   LEU  83           HA       LEU  83  75.250   8.495   0.483
  673   1HB   LEU  83          2HB       LEU  83  78.133   7.870   1.238
  674   2HB   LEU  83          1HB       LEU  83  77.499   9.396   0.635
  675    HG   LEU  83           HG       LEU  83  76.831   8.147   3.319
  676   1HD1  LEU  83          1HD1      LEU  83  78.186   9.910   4.270
  677   2HD1  LEU  83          2HD1      LEU  83  78.435  10.638   2.683
  678   3HD1  LEU  83          3HD1      LEU  83  79.155   9.070   3.059
  679   1HD2  LEU  83          1HD2      LEU  83  75.824  10.532   1.813
  680   2HD2  LEU  83          2HD2      LEU  83  75.968  10.644   3.568
  681   3HD2  LEU  83          3HD2      LEU  83  74.945   9.403   2.843
  682    H    LEU  84           H        LEU  84  75.324   8.197  -1.754
  683    HA   LEU  84           HA       LEU  84  76.645   5.818  -2.911
  684   1HB   LEU  84          2HB       LEU  84  74.895   8.071  -3.854
  685   2HB   LEU  84          1HB       LEU  84  75.808   7.132  -5.041
  686    HG   LEU  84           HG       LEU  84  74.300   5.634  -2.942
  687   1HD1  LEU  84          1HD1      LEU  84  72.279   6.423  -3.534
  688   2HD1  LEU  84          2HD1      LEU  84  72.572   5.922  -5.198
  689   3HD1  LEU  84          3HD1      LEU  84  73.022   7.543  -4.673
  690   1HD2  LEU  84          1HD2      LEU  84  74.670   3.900  -4.359
  691   2HD2  LEU  84          2HD2      LEU  84  75.805   4.967  -5.184
  692   3HD2  LEU  84          3HD2      LEU  84  74.146   4.824  -5.764
  693    H    LEU  85           H        LEU  85  78.577   5.888  -4.062
  694    HA   LEU  85           HA       LEU  85  80.114   8.442  -3.862
  695   1HB   LEU  85          2HB       LEU  85  80.670   5.533  -3.507
  696   2HB   LEU  85          1HB       LEU  85  81.989   6.538  -4.114
  697    HG   LEU  85           HG       LEU  85  80.379   7.373  -1.706
  698   1HD1  LEU  85          1HD1      LEU  85  81.423   5.026  -1.481
  699   2HD1  LEU  85          2HD1      LEU  85  81.849   6.214  -0.250
  700   3HD1  LEU  85          3HD1      LEU  85  82.981   5.848  -1.551
  701   1HD2  LEU  85          1HD2      LEU  85  81.847   9.029  -2.836
  702   2HD2  LEU  85          2HD2      LEU  85  83.218   7.940  -2.623
  703   3HD2  LEU  85          3HD2      LEU  85  82.427   8.648  -1.215
  704    H    GLY  86           H        GLY  86  79.209   5.811  -6.060
  705   1HA   GLY  86          2HA       GLY  86  79.881   7.432  -8.402
  706   2HA   GLY  86          1HA       GLY  86  81.039   6.136  -8.136
  707    H    HIS  87           H        HIS  87  79.945   5.773 -10.431
  708    HA   HIS  87           HA       HIS  87  77.879   3.647 -10.063
  709   1HB   HIS  87          2HB       HIS  87  76.566   4.683 -11.910
  710   2HB   HIS  87          1HB       HIS  87  76.718   5.770 -10.534
  711    HD1  HIS  87           HD1      HIS  87  77.989   5.252 -14.045
  712    HD2  HIS  87           HD2      HIS  87  78.216   8.119 -11.027
  713    HE1  HIS  87           HE1      HIS  87  79.033   7.310 -15.089
  714    H    TYR  88           H        TYR  88  77.857   2.094 -11.828
  715    HA   TYR  88           HA       TYR  88  79.974   2.423 -13.910
  716   1HB   TYR  88          2HB       TYR  88  79.493   0.070 -12.061
  717   2HB   TYR  88          1HB       TYR  88  80.517  -0.016 -13.496
  718    HD1  TYR  88           HD1      TYR  88  80.176   1.325 -10.059
  719    HD2  TYR  88           HD2      TYR  88  82.641   1.282 -13.651
  720    HE1  TYR  88           HE1      TYR  88  82.087   2.322  -8.761
  721    HE2  TYR  88           HE2      TYR  88  84.550   2.279 -12.353
  722    HH   TYR  88           HH       TYR  88  85.316   2.529 -10.079
  723    H    LYS  89           H        LYS  89  79.308   1.717 -15.918
  724    HA   LYS  89           HA       LYS  89  76.624   0.386 -16.099
  725   1HB   LYS  89          2HB       LYS  89  77.971   2.646 -17.486
  726   2HB   LYS  89          1HB       LYS  89  76.969   1.601 -18.493
  727   1HG   LYS  89          2HG       LYS  89  75.023   2.219 -17.444
  728   2HG   LYS  89          1HG       LYS  89  75.814   2.443 -15.883
  729   1HD   LYS  89          2HD       LYS  89  77.013   4.432 -17.221
  730   2HD   LYS  89          1HD       LYS  89  75.514   4.360 -18.147
  731   1HE   LYS  89          2HE       LYS  89  75.552   4.498 -15.116
  732   2HE   LYS  89          1HE       LYS  89  75.439   5.937 -16.149
  733   1HZ   LYS  89          1HZ       LYS  89  73.629   3.580 -16.270
  734   2HZ   LYS  89          2HZ       LYS  89  73.531   4.960 -17.257
  735   3HZ   LYS  89          3HZ       LYS  89  73.236   5.082 -15.589
  736    HA   PRO  90           HA       PRO  90  79.328  -2.940 -17.717
  737   1HB   PRO  90          2HB       PRO  90  76.578  -4.001 -18.303
  738   2HB   PRO  90          1HB       PRO  90  77.978  -4.837 -17.593
  739   1HG   PRO  90          2HG       PRO  90  76.042  -4.092 -16.014
  740   2HG   PRO  90          1HG       PRO  90  77.718  -3.767 -15.528
  741   1HD   PRO  90          2HD       PRO  90  75.699  -1.880 -16.693
  742   2HD   PRO  90          1HD       PRO  90  76.827  -1.630 -15.336
  743    H    ARG  91           H        ARG  91  79.920  -3.479 -19.859
  744    HA   ARG  91           HA       ARG  91  78.365  -2.121 -22.041
  745   1HB   ARG  91          2HB       ARG  91  80.570  -1.124 -21.404
  746   2HB   ARG  91          1HB       ARG  91  81.344  -2.658 -21.804
  747   1HG   ARG  91          2HG       ARG  91  81.573  -1.270 -23.742
  748   2HG   ARG  91          1HG       ARG  91  80.307  -2.439 -24.119
  749   1HD   ARG  91          2HD       ARG  91  78.581  -0.761 -23.498
  750   2HD   ARG  91          1HD       ARG  91  79.869   0.419 -23.181
  751    HE   ARG  91           HE       ARG  91  80.048  -0.848 -25.818
  752   1HH1  ARG  91          1HH1      ARG  91  78.722   1.839 -23.988
  753   2HH1  ARG  91          2HH1      ARG  91  78.552   2.831 -25.393
  754   1HH2  ARG  91          1HH2      ARG  91  79.804   0.480 -27.594
  755   2HH2  ARG  91          2HH2      ARG  91  79.156   2.074 -27.407
  756    H    ASN  92           H        ASN  92  78.022  -3.313 -23.938
  757    HA   ASN  92           HA       ASN  92  78.222  -6.225 -23.758
  758   1HB   ASN  92          2HB       ASN  92  77.365  -4.305 -25.949
  759   2HB   ASN  92          1HB       ASN  92  77.131  -6.051 -26.007
  760   1HD2  ASN  92          1HD2      ASN  92  74.936  -4.144 -26.008
  761   2HD2  ASN  92          2HD2      ASN  92  74.054  -4.380 -24.577
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1  83.649  15.596   0.269
    2   2H    MET   1          2H        MET   1  84.394  15.397  -1.246
    3   3H    MET   1          3H        MET   1  85.117  14.755   0.152
    4    HA   MET   1           HA       MET   1  84.091  12.946  -1.008
    5   1HB   MET   1          2HB       MET   1  84.002  13.180   1.497
    6   2HB   MET   1          1HB       MET   1  82.392  13.880   1.326
    7   1HG   MET   1          2HG       MET   1  81.685  11.797   0.112
    8   2HG   MET   1          1HG       MET   1  83.258  11.098   0.495
    9   1HE   MET   1          1HE       MET   1  83.407  10.772   4.226
   10   2HE   MET   1          2HE       MET   1  83.785  12.340   3.515
   11   3HE   MET   1          3HE       MET   1  84.235  10.864   2.665
   12    H    ASP   2           H        ASP   2  83.087  13.355  -3.022
   13    HA   ASP   2           HA       ASP   2  80.553  14.808  -3.241
   14   1HB   ASP   2          2HB       ASP   2  82.145  13.040  -5.128
   15   2HB   ASP   2          1HB       ASP   2  80.748  14.003  -5.610
   16    H    VAL   3           H        VAL   3  78.496  13.891  -3.353
   17    HA   VAL   3           HA       VAL   3  78.305  10.921  -3.242
   18    HB   VAL   3           HB       VAL   3  78.036  12.282  -1.062
   19   1HG1  VAL   3          1HG1      VAL   3  76.541  14.036  -2.123
   20   2HG1  VAL   3          2HG1      VAL   3  75.931  13.346  -0.617
   21   3HG1  VAL   3          3HG1      VAL   3  75.269  12.811  -2.165
   22   1HG2  VAL   3          1HG2      VAL   3  77.349   9.925  -1.327
   23   2HG2  VAL   3          2HG2      VAL   3  75.783  10.456  -1.943
   24   3HG2  VAL   3          3HG2      VAL   3  76.237  10.801  -0.274
   25    H    LEU   4           H        LEU   4  76.801  10.069  -4.653
   26    HA   LEU   4           HA       LEU   4  75.478  11.896  -6.541
   27   1HB   LEU   4          2HB       LEU   4  75.368   8.870  -6.332
   28   2HB   LEU   4          1HB       LEU   4  75.009   9.840  -7.755
   29    HG   LEU   4           HG       LEU   4  77.717   9.470  -6.428
   30   1HD1  LEU   4          1HD1      LEU   4  78.212   8.726  -8.866
   31   2HD1  LEU   4          2HD1      LEU   4  76.461   8.590  -9.018
   32   3HD1  LEU   4          3HD1      LEU   4  77.319   7.622  -7.820
   33   1HD2  LEU   4          1HD2      LEU   4  78.421  10.848  -8.561
   34   2HD2  LEU   4          2HD2      LEU   4  77.867  11.706  -7.119
   35   3HD2  LEU   4          3HD2      LEU   4  76.768  11.460  -8.481
   36    H    ALA   5           H        ALA   5  74.617  10.172  -3.643
   37    HA   ALA   5           HA       ALA   5  72.032  11.434  -3.522
   38   1HB   ALA   5          1HB       ALA   5  70.625   9.738  -4.209
   39   2HB   ALA   5          2HB       ALA   5  71.722   8.473  -3.657
   40   3HB   ALA   5          3HB       ALA   5  72.025   9.296  -5.187
   41    H    LYS   6           H        LYS   6  71.065  11.066  -1.421
   42    HA   LYS   6           HA       LYS   6  72.741   9.473   0.495
   43   1HB   LYS   6          2HB       LYS   6  73.270  11.920   0.439
   44   2HB   LYS   6          1HB       LYS   6  71.591  12.262   0.856
   45   1HG   LYS   6          2HG       LYS   6  71.833  11.032   2.958
   46   2HG   LYS   6          1HG       LYS   6  73.492  10.609   2.540
   47   1HD   LYS   6          2HD       LYS   6  73.754  13.229   2.270
   48   2HD   LYS   6          1HD       LYS   6  72.363  13.259   3.355
   49   1HE   LYS   6          2HE       LYS   6  73.938  11.409   4.611
   50   2HE   LYS   6          1HE       LYS   6  75.163  12.495   3.923
   51   1HZ   LYS   6          1HZ       LYS   6  74.471  13.413   5.999
   52   2HZ   LYS   6          2HZ       LYS   6  72.829  13.257   5.595
   53   3HZ   LYS   6          3HZ       LYS   6  73.806  14.378   4.772
   54    H    PHE   7           H        PHE   7  71.451   8.070   1.643
   55    HA   PHE   7           HA       PHE   7  68.705   8.902   2.416
   56   1HB   PHE   7          2HB       PHE   7  67.729   6.915   1.344
   57   2HB   PHE   7          1HB       PHE   7  68.573   7.904   0.156
   58    HD1  PHE   7           HD1      PHE   7  68.215   4.602   1.531
   59    HD2  PHE   7           HD2      PHE   7  71.102   7.274  -0.344
   60    HE1  PHE   7           HE1      PHE   7  69.633   2.625   0.889
   61    HE2  PHE   7           HE2      PHE   7  72.519   5.295  -0.977
   62    HZ   PHE   7           HZ       PHE   7  71.784   2.968  -0.355
   63    H    HIS   8           H        HIS   8  67.737   7.363   3.996
   64    HA   HIS   8           HA       HIS   8  69.873   6.042   5.647
   65   1HB   HIS   8          2HB       HIS   8  67.192   7.297   6.341
   66   2HB   HIS   8          1HB       HIS   8  68.292   6.570   7.511
   67    HD1  HIS   8           HD1      HIS   8  67.903   9.556   5.265
   68    HD2  HIS   8           HD2      HIS   8  70.612   8.116   8.088
   69    HE1  HIS   8           HE1      HIS   8  69.488  11.464   5.774
   70    H    THR   9           H        THR   9  69.584   3.906   6.223
   71    HA   THR   9           HA       THR   9  66.938   2.611   5.974
   72    HB   THR   9           HB       THR   9  68.049   2.556   3.710
   73    HG1  THR   9           HG1      THR   9  67.480   0.483   3.390
   74   1HG2  THR   9          1HG2      THR   9  70.390   2.418   4.438
   75   2HG2  THR   9          2HG2      THR   9  69.988   1.042   3.409
   76   3HG2  THR   9          3HG2      THR   9  70.082   0.837   5.160
   77    H    THR  10           H        THR  10  67.011   0.377   6.969
   78    HA   THR  10           HA       THR  10  69.255   0.162   8.938
   79    HB   THR  10           HB       THR  10  66.853   0.572   9.739
   80    HG1  THR  10           HG1      THR  10  68.073  -1.822  10.611
   81   1HG2  THR  10          1HG2      THR  10  65.178  -0.896   9.335
   82   2HG2  THR  10          2HG2      THR  10  66.227  -2.285   9.635
   83   3HG2  THR  10          3HG2      THR  10  66.207  -1.519   8.043
   84    H    VAL  11           H        VAL  11  70.012  -2.028   9.412
   85    HA   VAL  11           HA       VAL  11  70.337  -3.588   6.969
   86    HB   VAL  11           HB       VAL  11  71.219  -4.086   9.835
   87   1HG1  VAL  11          1HG1      VAL  11  72.979  -5.479   8.759
   88   2HG1  VAL  11          2HG1      VAL  11  72.211  -5.210   7.194
   89   3HG1  VAL  11          3HG1      VAL  11  71.360  -6.107   8.451
   90   1HG2  VAL  11          1HG2      VAL  11  72.131  -2.232   7.734
   91   2HG2  VAL  11          2HG2      VAL  11  73.422  -3.241   8.383
   92   3HG2  VAL  11          3HG2      VAL  11  72.471  -2.226   9.465
   93    H    HIS  12           H        HIS  12  69.341  -5.477   6.432
   94    HA   HIS  12           HA       HIS  12  67.502  -6.745   8.432
   95   1HB   HIS  12          2HB       HIS  12  67.359  -6.285   5.473
   96   2HB   HIS  12          1HB       HIS  12  66.561  -7.708   6.151
   97    HD1  HIS  12           HD1      HIS  12  66.789  -4.003   7.095
   98    HD2  HIS  12           HD2      HIS  12  63.988  -7.083   6.897
   99    HE1  HIS  12           HE1      HIS  12  64.583  -3.013   7.848
  100    H    ARG  13           H        ARG  13  67.263  -9.163   7.919
  101    HA   ARG  13           HA       ARG  13  69.553 -10.581   8.511
  102   1HB   ARG  13          2HB       ARG  13  67.122 -11.325   6.874
  103   2HB   ARG  13          1HB       ARG  13  68.278 -12.527   7.462
  104   1HG   ARG  13          2HG       ARG  13  67.893 -11.679   9.788
  105   2HG   ARG  13          1HG       ARG  13  66.644 -10.608   9.152
  106   1HD   ARG  13          2HD       ARG  13  65.471 -12.646   8.222
  107   2HD   ARG  13          1HD       ARG  13  66.645 -13.643   9.105
  108    HE   ARG  13           HE       ARG  13  65.369 -11.577  10.747
  109   1HH1  ARG  13          1HH1      ARG  13  65.170 -14.890   9.605
  110   2HH1  ARG  13          2HH1      ARG  13  64.186 -15.387  10.936
  111   1HH2  ARG  13          1HH2      ARG  13  64.097 -12.277  12.440
  112   2HH2  ARG  13          2HH2      ARG  13  63.585 -13.930  12.521
  113    H    ILE  14           H        ILE  14  71.084 -11.829   7.335
  114    HA   ILE  14           HA       ILE  14  72.632 -12.289   5.629
  115    HB   ILE  14           HB       ILE  14  70.398 -11.385   3.781
  116   1HG1  ILE  14          2HG1      ILE  14  71.034 -14.210   4.667
  117   2HG1  ILE  14          1HG1      ILE  14  69.799 -13.225   5.454
  118   1HG2  ILE  14          1HG2      ILE  14  72.203 -11.611   2.371
  119   2HG2  ILE  14          2HG2      ILE  14  71.688 -13.297   2.433
  120   3HG2  ILE  14          3HG2      ILE  14  73.028 -12.747   3.438
  121   1HD1  ILE  14          1HD1      ILE  14  69.046 -12.855   2.904
  122   2HD1  ILE  14          2HD1      ILE  14  68.469 -14.221   3.862
  123   3HD1  ILE  14          3HD1      ILE  14  69.804 -14.438   2.731
  124    H    GLY  15           H        GLY  15  71.787  -9.221   6.489
  125   1HA   GLY  15          2HA       GLY  15  73.010  -7.227   6.214
  126   2HA   GLY  15          1HA       GLY  15  74.041  -8.066   5.060
  127    H    ARG  16           H        ARG  16  70.658  -8.335   4.402
  128    HA   ARG  16           HA       ARG  16  71.021  -6.875   1.890
  129   1HB   ARG  16          2HB       ARG  16  69.816  -9.050   2.183
  130   2HB   ARG  16          1HB       ARG  16  68.597  -8.211   3.140
  131   1HG   ARG  16          2HG       ARG  16  68.140  -6.727   1.183
  132   2HG   ARG  16          1HG       ARG  16  69.275  -7.688   0.232
  133   1HD   ARG  16          2HD       ARG  16  67.875  -9.735   0.827
  134   2HD   ARG  16          1HD       ARG  16  66.662  -8.607   1.465
  135    HE   ARG  16           HE       ARG  16  67.609  -7.949  -1.230
  136   1HH1  ARG  16          1HH1      ARG  16  65.217  -9.702   0.649
  137   2HH1  ARG  16          2HH1      ARG  16  64.077  -9.720  -0.649
  138   1HH2  ARG  16          1HH2      ARG  16  66.096  -8.011  -2.870
  139   2HH2  ARG  16          2HH2      ARG  16  64.565  -8.778  -2.615
  140    H    ILE  17           H        ILE  17  70.109  -4.884   1.366
  141    HA   ILE  17           HA       ILE  17  68.220  -3.635   3.314
  142    HB   ILE  17           HB       ILE  17  69.443  -1.495   3.059
  143   1HG1  ILE  17          2HG1      ILE  17  71.575  -3.069   1.589
  144   2HG1  ILE  17          1HG1      ILE  17  70.348  -2.122   0.750
  145   1HG2  ILE  17          1HG2      ILE  17  71.532  -2.170   4.261
  146   2HG2  ILE  17          2HG2      ILE  17  71.155  -3.853   3.893
  147   3HG2  ILE  17          3HG2      ILE  17  70.078  -2.912   4.927
  148   1HD1  ILE  17          1HD1      ILE  17  71.707  -0.671   2.931
  149   2HD1  ILE  17          2HD1      ILE  17  71.330  -0.141   1.291
  150   3HD1  ILE  17          3HD1      ILE  17  72.761  -1.125   1.593
  151    H    ILE  18           H        ILE  18  66.769  -2.079   2.286
  152    HA   ILE  18           HA       ILE  18  66.702  -2.276  -0.712
  153    HB   ILE  18           HB       ILE  18  64.405  -1.905   1.242
  154   1HG1  ILE  18          2HG1      ILE  18  65.354  -4.163   1.462
  155   2HG1  ILE  18          1HG1      ILE  18  63.795  -4.241   0.648
  156   1HG2  ILE  18          1HG2      ILE  18  64.628  -2.095  -1.751
  157   2HG2  ILE  18          2HG2      ILE  18  63.671  -0.979  -0.772
  158   3HG2  ILE  18          3HG2      ILE  18  63.164  -2.661  -0.946
  159   1HD1  ILE  18          1HD1      ILE  18  66.512  -4.816  -0.400
  160   2HD1  ILE  18          2HD1      ILE  18  65.427  -3.966  -1.501
  161   3HD1  ILE  18          3HD1      ILE  18  64.962  -5.534  -0.840
  162    H    ILE  19           H        ILE  19  66.886  -0.331  -1.747
  163    HA   ILE  19           HA       ILE  19  66.954   2.185  -0.213
  164    HB   ILE  19           HB       ILE  19  67.111   1.575  -3.200
  165   1HG1  ILE  19          2HG1      ILE  19  69.224   1.917  -1.030
  166   2HG1  ILE  19          1HG1      ILE  19  68.910   0.468  -1.972
  167   1HG2  ILE  19          1HG2      ILE  19  67.920   3.822  -3.460
  168   2HG2  ILE  19          2HG2      ILE  19  68.068   4.049  -1.717
  169   3HG2  ILE  19          3HG2      ILE  19  66.471   3.949  -2.460
  170   1HD1  ILE  19          1HD1      ILE  19  70.633   2.689  -2.593
  171   2HD1  ILE  19          2HD1      ILE  19  69.398   2.536  -3.844
  172   3HD1  ILE  19          3HD1      ILE  19  70.442   1.166  -3.463
  173    HA   PRO  20           HA       PRO  20  62.623   3.144  -0.870
  174   1HB   PRO  20          2HB       PRO  20  62.792   5.878  -0.962
  175   2HB   PRO  20          1HB       PRO  20  62.867   4.965   0.556
  176   1HG   PRO  20          2HG       PRO  20  65.131   5.969  -1.136
  177   2HG   PRO  20          1HG       PRO  20  64.883   6.163   0.611
  178   1HD   PRO  20          2HD       PRO  20  66.519   4.284  -0.261
  179   2HD   PRO  20          1HD       PRO  20  65.369   3.901   1.048
  180    H    ALA  21           H        ALA  21  61.404   3.509  -2.727
  181    HA   ALA  21           HA       ALA  21  62.607   3.391  -5.285
  182   1HB   ALA  21          1HB       ALA  21  60.281   4.004  -6.052
  183   2HB   ALA  21          2HB       ALA  21  59.878   4.356  -4.372
  184   3HB   ALA  21          3HB       ALA  21  60.314   2.715  -4.848
  185    H    GLY  22           H        GLY  22  61.825   6.169  -3.271
  186   1HA   GLY  22          2HA       GLY  22  61.822   8.182  -5.318
  187   2HA   GLY  22          1HA       GLY  22  62.146   8.476  -3.609
  188    H    THR  23           H        THR  23  64.440   6.932  -3.245
  189    HA   THR  23           HA       THR  23  66.478   8.683  -4.312
  190    HB   THR  23           HB       THR  23  66.641   5.983  -2.922
  191    HG1  THR  23           HG1      THR  23  65.562   7.784  -1.830
  192   1HG2  THR  23          1HG2      THR  23  68.896   6.190  -2.867
  193   2HG2  THR  23          2HG2      THR  23  68.812   7.917  -2.520
  194   3HG2  THR  23          3HG2      THR  23  68.695   7.346  -4.185
  195    H    ARG  24           H        ARG  24  65.355   5.411  -5.169
  196    HA   ARG  24           HA       ARG  24  67.383   4.674  -7.041
  197   1HB   ARG  24          2HB       ARG  24  64.416   4.163  -7.396
  198   2HB   ARG  24          1HB       ARG  24  65.749   3.151  -7.934
  199   1HG   ARG  24          2HG       ARG  24  66.296   3.084  -5.334
  200   2HG   ARG  24          1HG       ARG  24  64.582   3.453  -5.207
  201   1HD   ARG  24          2HD       ARG  24  64.391   1.501  -7.019
  202   2HD   ARG  24          1HD       ARG  24  65.904   0.993  -6.233
  203    HE   ARG  24           HE       ARG  24  64.360   1.565  -4.075
  204   1HH1  ARG  24          1HH1      ARG  24  63.653  -0.329  -6.944
  205   2HH1  ARG  24          2HH1      ARG  24  62.521  -1.331  -6.109
  206   1HH2  ARG  24          1HH2      ARG  24  62.913   0.234  -3.055
  207   2HH2  ARG  24          2HH2      ARG  24  62.107  -1.023  -3.932
  208    H    LYS  25           H        LYS  25  64.422   6.604  -7.471
  209    HA   LYS  25           HA       LYS  25  64.619   6.935 -10.313
  210   1HB   LYS  25          2HB       LYS  25  62.583   7.311  -8.979
  211   2HB   LYS  25          1HB       LYS  25  63.358   8.654  -8.143
  212   1HG   LYS  25          2HG       LYS  25  61.886   9.501  -9.918
  213   2HG   LYS  25          1HG       LYS  25  63.569   9.855 -10.309
  214   1HD   LYS  25          2HD       LYS  25  63.672   7.926 -11.789
  215   2HD   LYS  25          1HD       LYS  25  62.024   7.470 -11.356
  216   1HE   LYS  25          2HE       LYS  25  61.135   9.508 -12.361
  217   2HE   LYS  25          1HE       LYS  25  62.778  10.102 -12.680
  218   1HZ   LYS  25          1HZ       LYS  25  61.735   8.940 -14.604
  219   2HZ   LYS  25          2HZ       LYS  25  61.734   7.510 -13.686
  220   3HZ   LYS  25          3HZ       LYS  25  63.203   8.255 -14.101
  221    H    PHE  26           H        PHE  26  65.555   9.109  -7.665
  222    HA   PHE  26           HA       PHE  26  66.631  11.249  -9.180
  223   1HB   PHE  26          2HB       PHE  26  66.171  11.216  -6.736
  224   2HB   PHE  26          1HB       PHE  26  67.542  10.132  -6.506
  225    HD1  PHE  26           HD1      PHE  26  69.779  10.964  -6.320
  226    HD2  PHE  26           HD2      PHE  26  66.588  13.550  -7.772
  227    HE1  PHE  26           HE1      PHE  26  71.334  12.938  -6.224
  228    HE2  PHE  26           HE2      PHE  26  68.143  15.525  -7.673
  229    HZ   PHE  26           HZ       PHE  26  70.516  15.219  -6.899
  230    H    TYR  27           H        TYR  27  68.156   8.229  -8.128
  231    HA   TYR  27           HA       TYR  27  70.799   9.013  -9.171
  232   1HB   TYR  27          2HB       TYR  27  70.364   7.741  -7.071
  233   2HB   TYR  27          1HB       TYR  27  69.729   6.415  -8.029
  234    HD1  TYR  27           HD1      TYR  27  71.327   5.362  -9.852
  235    HD2  TYR  27           HD2      TYR  27  72.674   7.913  -6.593
  236    HE1  TYR  27           HE1      TYR  27  73.641   4.418 -10.074
  237    HE2  TYR  27           HE2      TYR  27  74.996   6.979  -6.831
  238    HH   TYR  27           HH       TYR  27  76.020   4.791  -7.722
  239    H    GLY  28           H        GLY  28  67.992   7.425 -10.477
  240   1HA   GLY  28          2HA       GLY  28  67.656   6.606 -12.655
  241   2HA   GLY  28          1HA       GLY  28  69.337   7.005 -13.014
  242    H    ILE  29           H        ILE  29  68.052   4.848 -10.474
  243    HA   ILE  29           HA       ILE  29  70.007   2.789 -11.259
  244    HB   ILE  29           HB       ILE  29  67.924   2.939  -9.046
  245   1HG1  ILE  29          2HG1      ILE  29  70.915   3.457  -9.016
  246   2HG1  ILE  29          1HG1      ILE  29  69.670   4.701  -8.986
  247   1HG2  ILE  29          1HG2      ILE  29  69.876   1.260  -8.143
  248   2HG2  ILE  29          2HG2      ILE  29  69.887   0.870  -9.862
  249   3HG2  ILE  29          3HG2      ILE  29  68.399   0.707  -8.931
  250   1HD1  ILE  29          1HD1      ILE  29  69.752   4.542  -6.735
  251   2HD1  ILE  29          2HD1      ILE  29  70.688   3.044  -6.803
  252   3HD1  ILE  29          3HD1      ILE  29  68.926   2.993  -6.917
  253    H    GLU  30           H        GLU  30  69.541   1.111 -12.546
  254    HA   GLU  30           HA       GLU  30  66.736   0.069 -12.645
  255   1HB   GLU  30          2HB       GLU  30  67.385   1.374 -14.700
  256   2HB   GLU  30          1HB       GLU  30  68.702   0.230 -14.957
  257   1HG   GLU  30          2HG       GLU  30  67.034  -1.623 -15.031
  258   2HG   GLU  30          1HG       GLU  30  65.743  -0.436 -14.878
  259    H    GLN  31           H        GLN  31  66.684  -2.284 -12.953
  260    HA   GLN  31           HA       GLN  31  68.559  -3.755 -11.441
  261   1HB   GLN  31          2HB       GLN  31  66.663  -4.555 -13.667
  262   2HB   GLN  31          1HB       GLN  31  67.494  -5.725 -12.641
  263   1HG   GLN  31          2HG       GLN  31  66.459  -4.779 -10.647
  264   2HG   GLN  31          1HG       GLN  31  65.705  -3.505 -11.607
  265   1HE2  GLN  31          1HE2      GLN  31  63.841  -4.856 -10.274
  266   2HE2  GLN  31          2HE2      GLN  31  63.054  -6.025 -11.221
  267    H    GLY  32           H        GLY  32  70.489  -4.755 -11.902
  268   1HA   GLY  32          2HA       GLY  32  72.114  -5.824 -13.308
  269   2HA   GLY  32          1HA       GLY  32  71.338  -5.101 -14.715
  270    H    ASP  33           H        ASP  33  71.417  -2.441 -12.942
  271    HA   ASP  33           HA       ASP  33  73.925  -1.444 -14.085
  272   1HB   ASP  33          2HB       ASP  33  71.850  -0.319 -12.178
  273   2HB   ASP  33          1HB       ASP  33  73.199   0.620 -12.818
  274    H    PHE  34           H        PHE  34  75.711  -0.573 -12.749
  275    HA   PHE  34           HA       PHE  34  75.932  -1.929 -10.081
  276   1HB   PHE  34          2HB       PHE  34  77.950  -1.076 -12.172
  277   2HB   PHE  34          1HB       PHE  34  78.417  -1.583 -10.549
  278    HD1  PHE  34           HD1      PHE  34  76.971  -2.671 -13.798
  279    HD2  PHE  34           HD2      PHE  34  78.155  -3.921  -9.797
  280    HE1  PHE  34           HE1      PHE  34  76.809  -5.079 -14.504
  281    HE2  PHE  34           HE2      PHE  34  77.994  -6.331 -10.503
  282    HZ   PHE  34           HZ       PHE  34  77.321  -6.909 -12.856
  283    H    VAL  35           H        VAL  35  76.294  -0.608  -8.321
  284    HA   VAL  35           HA       VAL  35  76.992   2.252  -8.839
  285    HB   VAL  35           HB       VAL  35  75.387   2.865  -7.038
  286   1HG1  VAL  35          1HG1      VAL  35  74.758   2.644  -9.529
  287   2HG1  VAL  35          2HG1      VAL  35  73.429   2.676  -8.371
  288   3HG1  VAL  35          3HG1      VAL  35  73.953   1.143  -9.069
  289   1HG2  VAL  35          1HG2      VAL  35  74.799  -0.110  -7.093
  290   2HG2  VAL  35          2HG2      VAL  35  73.721   1.082  -6.359
  291   3HG2  VAL  35          3HG2      VAL  35  75.349   0.845  -5.715
  292    H    GLU  36           H        GLU  36  78.288   3.191  -7.145
  293    HA   GLU  36           HA       GLU  36  79.589   1.170  -5.349
  294   1HB   GLU  36          2HB       GLU  36  80.958   2.196  -7.187
  295   2HB   GLU  36          1HB       GLU  36  80.634   3.786  -6.496
  296   1HG   GLU  36          2HG       GLU  36  81.652   2.984  -4.341
  297   2HG   GLU  36          1HG       GLU  36  82.115   1.498  -5.172
  298    H    ILE  37           H        ILE  37  79.136   1.500  -3.234
  299    HA   ILE  37           HA       ILE  37  78.232   4.225  -2.389
  300    HB   ILE  37           HB       ILE  37  76.393   2.754  -3.115
  301   1HG1  ILE  37          2HG1      ILE  37  76.254   2.790  -0.110
  302   2HG1  ILE  37          1HG1      ILE  37  76.285   4.302  -1.018
  303   1HG2  ILE  37          1HG2      ILE  37  75.908   0.679  -1.823
  304   2HG2  ILE  37          2HG2      ILE  37  77.443   0.877  -0.978
  305   3HG2  ILE  37          3HG2      ILE  37  77.426   0.581  -2.718
  306   1HD1  ILE  37          1HD1      ILE  37  74.088   2.434  -0.652
  307   2HD1  ILE  37          2HD1      ILE  37  74.403   2.699  -2.366
  308   3HD1  ILE  37          3HD1      ILE  37  74.059   4.068  -1.310
  309    H    LYS  38           H        LYS  38  78.271   4.551  -0.049
  310    HA   LYS  38           HA       LYS  38  79.923   2.598   1.497
  311   1HB   LYS  38          2HB       LYS  38  81.178   4.611   0.565
  312   2HB   LYS  38          1HB       LYS  38  80.182   5.614   1.628
  313   1HG   LYS  38          2HG       LYS  38  80.964   4.346   3.580
  314   2HG   LYS  38          1HG       LYS  38  81.935   3.312   2.531
  315   1HD   LYS  38          2HD       LYS  38  83.182   5.346   1.767
  316   2HD   LYS  38          1HD       LYS  38  82.274   6.300   2.940
  317   1HE   LYS  38          2HE       LYS  38  83.194   4.247   4.521
  318   2HE   LYS  38          1HE       LYS  38  84.540   4.459   3.383
  319   1HZ   LYS  38          1HZ       LYS  38  84.697   5.999   5.266
  320   2HZ   LYS  38          2HZ       LYS  38  83.183   6.654   4.860
  321   3HZ   LYS  38          3HZ       LYS  38  84.498   6.826   3.799
  322    H    ILE  39           H        ILE  39  79.358   2.434   3.693
  323    HA   ILE  39           HA       ILE  39  76.908   3.955   4.540
  324    HB   ILE  39           HB       ILE  39  76.514   1.955   5.998
  325   1HG1  ILE  39          2HG1      ILE  39  78.726   0.626   4.416
  326   2HG1  ILE  39          1HG1      ILE  39  79.005   1.338   6.006
  327   1HG2  ILE  39          1HG2      ILE  39  75.228   1.641   4.154
  328   2HG2  ILE  39          2HG2      ILE  39  76.380   0.349   3.818
  329   3HG2  ILE  39          3HG2      ILE  39  76.567   1.921   3.040
  330   1HD1  ILE  39          1HD1      ILE  39  76.827  -0.119   6.589
  331   2HD1  ILE  39          2HD1      ILE  39  78.458  -0.785   6.685
  332   3HD1  ILE  39          3HD1      ILE  39  77.460  -1.096   5.264
  333    H    VAL  40           H        VAL  40  76.852   4.731   6.696
  334    HA   VAL  40           HA       VAL  40  79.337   4.471   8.329
  335    HB   VAL  40           HB       VAL  40  77.866   7.048   7.663
  336   1HG1  VAL  40          1HG1      VAL  40  80.062   7.950   8.793
  337   2HG1  VAL  40          2HG1      VAL  40  80.118   6.351   9.536
  338   3HG1  VAL  40          3HG1      VAL  40  78.730   7.403   9.811
  339   1HG2  VAL  40          1HG2      VAL  40  80.307   5.712   6.574
  340   2HG2  VAL  40          2HG2      VAL  40  80.369   7.462   6.783
  341   3HG2  VAL  40          3HG2      VAL  40  79.131   6.740   5.755
  342    H    LYS  41           H        LYS  41  78.767   3.899  10.370
  343    HA   LYS  41           HA       LYS  41  76.169   4.862  11.494
  344   1HB   LYS  41          2HB       LYS  41  76.026   2.487  10.710
  345   2HB   LYS  41          1HB       LYS  41  77.353   2.085  11.801
  346   1HG   LYS  41          2HG       LYS  41  75.976   2.982  13.701
  347   2HG   LYS  41          1HG       LYS  41  74.630   3.161  12.575
  348   1HD   LYS  41          2HD       LYS  41  74.821   0.716  12.048
  349   2HD   LYS  41          1HD       LYS  41  76.041   0.583  13.314
  350   1HE   LYS  41          2HE       LYS  41  73.196   1.570  13.746
  351   2HE   LYS  41          1HE       LYS  41  73.800  -0.041  14.182
  352   1HZ   LYS  41          1HZ       LYS  41  75.596   1.134  15.445
  353   2HZ   LYS  41          2HZ       LYS  41  74.038   1.310  16.099
  354   3HZ   LYS  41          3HZ       LYS  41  74.739   2.579  15.213
  355    H    TYR  42           H        TYR  42  76.319   5.422  13.683
  356    HA   TYR  42           HA       TYR  42  79.090   5.468  14.811
  357   1HB   TYR  42          2HB       TYR  42  77.748   7.572  14.353
  358   2HB   TYR  42          1HB       TYR  42  76.631   7.049  15.614
  359    HD1  TYR  42           HD1      TYR  42  80.222   7.917  14.929
  360    HD2  TYR  42           HD2      TYR  42  77.135   7.352  17.951
  361    HE1  TYR  42           HE1      TYR  42  81.761   8.862  16.677
  362    HE2  TYR  42           HE2      TYR  42  78.674   8.299  19.700
  363    HH   TYR  42           HH       TYR  42  81.588   9.952  18.907
  364    H    GLU  43           H        GLU  43  79.531   4.219  16.593
  365    HA   GLU  43           HA       GLU  43  77.251   3.399  18.352
  366   1HB   GLU  43          2HB       GLU  43  78.284   1.139  18.456
  367   2HB   GLU  43          1HB       GLU  43  77.811   1.563  16.812
  368   1HG   GLU  43          2HG       GLU  43  80.152   2.275  16.350
  369   2HG   GLU  43          1HG       GLU  43  80.608   1.759  17.972
  370    H    GLY  44           H        GLY  44  77.697   3.781  20.480
  371   1HA   GLY  44          2HA       GLY  44  78.871   4.417  22.407
  372   2HA   GLY  44          1HA       GLY  44  80.243   3.520  21.755
  373    H    GLU  45           H        GLU  45  81.981   4.851  21.734
  374    HA   GLU  45           HA       GLU  45  81.602   7.716  20.974
  375   1HB   GLU  45          2HB       GLU  45  83.713   8.071  22.156
  376   2HB   GLU  45          1HB       GLU  45  82.612   7.159  23.181
  377   1HG   GLU  45          2HG       GLU  45  83.755   5.061  22.563
  378   2HG   GLU  45          1HG       GLU  45  84.843   5.960  21.506
  379    H    GLU  46           H        GLU  46  82.109   5.075  19.223
  380    HA   GLU  46           HA       GLU  46  84.252   6.337  17.563
  381   1HB   GLU  46          2HB       GLU  46  85.130   4.072  17.165
  382   2HB   GLU  46          1HB       GLU  46  85.086   4.431  18.888
  383   1HG   GLU  46          2HG       GLU  46  82.787   3.259  18.896
  384   2HG   GLU  46          1HG       GLU  46  83.232   2.649  17.303
  385    HA   PRO  47           HA       PRO  47  81.051   5.616  14.429
  386   1HB   PRO  47          2HB       PRO  47  82.732   6.977  12.508
  387   2HB   PRO  47          1HB       PRO  47  81.223   7.547  13.239
  388   1HG   PRO  47          2HG       PRO  47  83.717   8.612  13.714
  389   2HG   PRO  47          1HG       PRO  47  82.303   8.807  14.757
  390   1HD   PRO  47          2HD       PRO  47  84.664   7.041  15.088
  391   2HD   PRO  47          1HD       PRO  47  83.646   7.824  16.318
  392    H    LYS  48           H        LYS  48  80.976   3.977  12.858
  393    HA   LYS  48           HA       LYS  48  83.584   2.872  11.882
  394   1HB   LYS  48          2HB       LYS  48  81.006   1.443  12.592
  395   2HB   LYS  48          1HB       LYS  48  82.373   0.672  11.785
  396   1HG   LYS  48          2HG       LYS  48  83.685   1.784  13.850
  397   2HG   LYS  48          1HG       LYS  48  82.103   1.582  14.605
  398   1HD   LYS  48          2HD       LYS  48  82.102  -0.802  13.942
  399   2HD   LYS  48          1HD       LYS  48  83.704  -0.593  13.231
  400   1HE   LYS  48          2HE       LYS  48  84.744  -0.351  15.315
  401   2HE   LYS  48          1HE       LYS  48  83.247   0.179  16.109
  402   1HZ   LYS  48          1HZ       LYS  48  83.893  -2.191  16.553
  403   2HZ   LYS  48          2HZ       LYS  48  83.582  -2.517  14.914
  404   3HZ   LYS  48          3HZ       LYS  48  82.329  -1.980  15.929
  405    H    GLU  49           H        GLU  49  83.602   2.263   9.672
  406    HA   GLU  49           HA       GLU  49  81.209   3.053   8.049
  407   1HB   GLU  49          2HB       GLU  49  84.108   3.871   7.679
  408   2HB   GLU  49          1HB       GLU  49  82.800   4.262   6.561
  409   1HG   GLU  49          2HG       GLU  49  81.613   5.442   8.404
  410   2HG   GLU  49          1HG       GLU  49  82.976   5.108   9.469
  411    H    GLY  50           H        GLY  50  81.447   2.283   5.747
  412   1HA   GLY  50          2HA       GLY  50  83.397   0.177   5.190
  413   2HA   GLY  50          1HA       GLY  50  81.743  -0.411   5.367
  414    H    THR  51           H        THR  51  83.728   0.080   2.987
  415    HA   THR  51           HA       THR  51  81.693   1.415   1.221
  416    HB   THR  51           HB       THR  51  84.677   1.298   0.730
  417    HG1  THR  51           HG1      THR  51  84.957   3.017   1.961
  418   1HG2  THR  51          1HG2      THR  51  84.264   2.786  -0.958
  419   2HG2  THR  51          2HG2      THR  51  82.965   3.587  -0.074
  420   3HG2  THR  51          3HG2      THR  51  82.657   2.059  -0.900
  421    H    PHE  52           H        PHE  52  81.102   0.227  -0.601
  422    HA   PHE  52           HA       PHE  52  82.870  -1.877  -1.632
  423   1HB   PHE  52          2HB       PHE  52  81.442  -3.737  -1.138
  424   2HB   PHE  52          1HB       PHE  52  81.585  -2.827   0.359
  425    HD1  PHE  52           HD1      PHE  52  79.326  -4.277  -2.034
  426    HD2  PHE  52           HD2      PHE  52  79.678  -1.050   0.872
  427    HE1  PHE  52           HE1      PHE  52  76.825  -4.066  -1.968
  428    HE2  PHE  52           HE2      PHE  52  77.170  -0.840   0.937
  429    HZ   PHE  52           HZ       PHE  52  75.745  -2.350  -0.491
  430    H    THR  53           H        THR  53  81.738  -3.013  -3.562
  431    HA   THR  53           HA       THR  53  80.037  -1.035  -5.044
  432    HB   THR  53           HB       THR  53  81.781  -3.312  -6.042
  433    HG1  THR  53           HG1      THR  53  83.151  -1.795  -5.326
  434   1HG2  THR  53          1HG2      THR  53  80.071  -2.869  -7.651
  435   2HG2  THR  53          2HG2      THR  53  81.507  -2.017  -8.223
  436   3HG2  THR  53          3HG2      THR  53  80.214  -1.126  -7.421
  437    H    ALA  54           H        ALA  54  78.032  -1.751  -5.791
  438    HA   ALA  54           HA       ALA  54  77.301  -4.618  -5.369
  439   1HB   ALA  54          1HB       ALA  54  75.284  -2.628  -4.561
  440   2HB   ALA  54          2HB       ALA  54  76.757  -2.567  -3.596
  441   3HB   ALA  54          3HB       ALA  54  75.838  -4.068  -3.706
  442    H    ARG  55           H        ARG  55  75.723  -5.377  -6.798
  443    HA   ARG  55           HA       ARG  55  74.954  -3.573  -9.038
  444   1HB   ARG  55          2HB       ARG  55  75.962  -5.941  -9.255
  445   2HB   ARG  55          1HB       ARG  55  74.384  -6.526  -8.723
  446   1HG   ARG  55          2HG       ARG  55  73.304  -5.313 -10.583
  447   2HG   ARG  55          1HG       ARG  55  74.882  -4.740 -11.123
  448   1HD   ARG  55          2HD       ARG  55  74.454  -6.651 -12.482
  449   2HD   ARG  55          1HD       ARG  55  75.530  -7.260 -11.209
  450    HE   ARG  55           HE       ARG  55  72.674  -7.382 -10.539
  451   1HH1  ARG  55          1HH1      ARG  55  75.392  -9.097 -11.952
  452   2HH1  ARG  55          2HH1      ARG  55  74.687 -10.646 -11.652
  453   1HH2  ARG  55          1HH2      ARG  55  71.816  -9.408 -10.181
  454   2HH2  ARG  55          2HH2      ARG  55  72.690 -10.822 -10.665
  455    H    VAL  56           H        VAL  56  72.773  -3.133  -9.479
  456    HA   VAL  56           HA       VAL  56  70.943  -3.206  -7.208
  457    HB   VAL  56           HB       VAL  56  70.687  -2.321 -10.103
  458   1HG1  VAL  56          1HG1      VAL  56  68.544  -1.707  -9.732
  459   2HG1  VAL  56          2HG1      VAL  56  68.919  -1.042  -8.140
  460   3HG1  VAL  56          3HG1      VAL  56  68.590  -2.762  -8.319
  461   1HG2  VAL  56          1HG2      VAL  56  71.467  -0.261  -9.417
  462   2HG2  VAL  56          2HG2      VAL  56  72.322  -1.274  -8.256
  463   3HG2  VAL  56          3HG2      VAL  56  70.836  -0.453  -7.782
  464    H    GLY  57           H        GLY  57  69.528  -4.796  -6.779
  465   1HA   GLY  57          2HA       GLY  57  68.932  -6.817  -8.891
  466   2HA   GLY  57          1HA       GLY  57  68.785  -7.101  -7.157
  467    H    GLU  58           H        GLU  58  66.614  -7.865  -7.888
  468    HA   GLU  58           HA       GLU  58  64.598  -6.150  -8.955
  469   1HB   GLU  58          2HB       GLU  58  64.558  -8.653  -8.731
  470   2HB   GLU  58          1HB       GLU  58  64.308  -8.453  -6.997
  471   1HG   GLU  58          2HG       GLU  58  62.244  -7.150  -7.471
  472   2HG   GLU  58          1HG       GLU  58  62.476  -7.437  -9.192
  473    H    GLN  59           H        GLN  59  62.915  -4.993  -7.872
  474    HA   GLN  59           HA       GLN  59  62.073  -3.487  -6.272
  475   1HB   GLN  59          2HB       GLN  59  63.080  -5.831  -4.656
  476   2HB   GLN  59          1HB       GLN  59  62.243  -4.476  -3.896
  477   1HG   GLN  59          2HG       GLN  59  60.300  -4.824  -5.339
  478   2HG   GLN  59          1HG       GLN  59  61.134  -6.126  -6.185
  479   1HE2  GLN  59          1HE2      GLN  59  61.155  -8.205  -5.207
  480   2HE2  GLN  59          2HE2      GLN  59  60.415  -8.542  -3.717
  481    H    GLY  60           H        GLY  60  65.140  -3.392  -7.006
  482   1HA   GLY  60          2HA       GLY  60  66.738  -1.740  -6.529
  483   2HA   GLY  60          1HA       GLY  60  65.577  -1.055  -5.393
  484    H    SER  61           H        SER  61  66.468  -4.380  -4.913
  485    HA   SER  61           HA       SER  61  67.497  -3.744  -2.263
  486   1HB   SER  61          2HB       SER  61  67.438  -6.118  -1.986
  487   2HB   SER  61          1HB       SER  61  66.077  -5.733  -3.035
  488    HG   SER  61           HG       SER  61  66.988  -6.869  -4.540
  489    H    VAL  62           H        VAL  62  69.622  -4.063  -1.514
  490    HA   VAL  62           HA       VAL  62  71.719  -4.866  -3.464
  491    HB   VAL  62           HB       VAL  62  71.558  -2.405  -3.496
  492   1HG1  VAL  62          1HG1      VAL  62  70.575  -2.077  -1.267
  493   2HG1  VAL  62          2HG1      VAL  62  72.045  -1.116  -1.438
  494   3HG1  VAL  62          3HG1      VAL  62  72.077  -2.619  -0.515
  495   1HG2  VAL  62          1HG2      VAL  62  73.854  -1.980  -3.246
  496   2HG2  VAL  62          2HG2      VAL  62  73.807  -3.729  -3.464
  497   3HG2  VAL  62          3HG2      VAL  62  73.995  -3.047  -1.849
  498    H    ILE  63           H        ILE  63  73.492  -5.925  -2.433
  499    HA   ILE  63           HA       ILE  63  72.967  -6.692   0.412
  500    HB   ILE  63           HB       ILE  63  74.599  -8.024  -1.778
  501   1HG1  ILE  63          2HG1      ILE  63  72.201  -7.969  -2.349
  502   2HG1  ILE  63          1HG1      ILE  63  72.697  -9.608  -1.939
  503   1HG2  ILE  63          1HG2      ILE  63  75.434  -8.853   0.256
  504   2HG2  ILE  63          2HG2      ILE  63  74.198 -10.033  -0.178
  505   3HG2  ILE  63          3HG2      ILE  63  73.853  -8.800   1.036
  506   1HD1  ILE  63          1HD1      ILE  63  71.284  -7.667  -0.081
  507   2HD1  ILE  63          2HD1      ILE  63  71.806  -9.295   0.353
  508   3HD1  ILE  63          3HD1      ILE  63  70.550  -9.066  -0.864
  509    H    ILE  64           H        ILE  64  74.325  -5.836   1.914
  510    HA   ILE  64           HA       ILE  64  76.928  -4.635   1.210
  511    HB   ILE  64           HB       ILE  64  75.542  -5.208   3.857
  512   1HG1  ILE  64          2HG1      ILE  64  75.772  -2.570   2.390
  513   2HG1  ILE  64          1HG1      ILE  64  74.391  -3.647   2.182
  514   1HG2  ILE  64          1HG2      ILE  64  77.109  -3.633   4.828
  515   2HG2  ILE  64          2HG2      ILE  64  77.808  -3.288   3.247
  516   3HG2  ILE  64          3HG2      ILE  64  78.033  -4.874   3.983
  517   1HD1  ILE  64          1HD1      ILE  64  74.201  -1.790   3.976
  518   2HD1  ILE  64          2HD1      ILE  64  75.296  -2.793   4.929
  519   3HD1  ILE  64          3HD1      ILE  64  73.724  -3.425   4.436
  520    HA   PRO  65           HA       PRO  65  79.178  -8.447   1.643
  521   1HB   PRO  65          2HB       PRO  65  81.630  -7.493   2.386
  522   2HB   PRO  65          1HB       PRO  65  81.002  -7.331   0.729
  523   1HG   PRO  65          2HG       PRO  65  80.887  -5.351   2.977
  524   2HG   PRO  65          1HG       PRO  65  81.454  -5.107   1.313
  525   1HD   PRO  65          2HD       PRO  65  79.010  -4.355   1.989
  526   2HD   PRO  65          1HD       PRO  65  79.279  -5.186   0.436
  527    H    LYS  66           H        LYS  66  79.200  -9.878   3.331
  528    HA   LYS  66           HA       LYS  66  78.475  -9.262   5.994
  529   1HB   LYS  66          2HB       LYS  66  78.386 -11.483   4.851
  530   2HB   LYS  66          1HB       LYS  66  80.143 -11.587   4.982
  531   1HG   LYS  66          2HG       LYS  66  79.953 -11.402   7.450
  532   2HG   LYS  66          1HG       LYS  66  78.197 -11.367   7.297
  533   1HD   LYS  66          2HD       LYS  66  78.307 -13.589   6.143
  534   2HD   LYS  66          1HD       LYS  66  80.038 -13.632   6.481
  535   1HE   LYS  66          2HE       LYS  66  79.019 -14.859   8.271
  536   2HE   LYS  66          1HE       LYS  66  79.374 -13.262   8.959
  537   1HZ   LYS  66          1HZ       LYS  66  77.171 -12.543   8.550
  538   2HZ   LYS  66          2HZ       LYS  66  77.035 -14.062   9.300
  539   3HZ   LYS  66          3HZ       LYS  66  76.807 -13.916   7.622
  540    H    ALA  67           H        ALA  67  81.676  -9.455   4.514
  541    HA   ALA  67           HA       ALA  67  83.306  -9.520   6.843
  542   1HB   ALA  67          1HB       ALA  67  84.579  -9.785   4.960
  543   2HB   ALA  67          2HB       ALA  67  84.743  -8.031   5.052
  544   3HB   ALA  67          3HB       ALA  67  83.528  -8.749   3.993
  545    H    LEU  68           H        LEU  68  81.804  -6.779   5.161
  546    HA   LEU  68           HA       LEU  68  83.015  -4.762   6.897
  547   1HB   LEU  68          2HB       LEU  68  80.755  -4.746   4.876
  548   2HB   LEU  68          1HB       LEU  68  81.337  -3.296   5.690
  549    HG   LEU  68           HG       LEU  68  83.014  -5.133   3.946
  550   1HD1  LEU  68          1HD1      LEU  68  82.527  -2.258   3.316
  551   2HD1  LEU  68          2HD1      LEU  68  81.196  -3.379   3.034
  552   3HD1  LEU  68          3HD1      LEU  68  82.744  -3.627   2.224
  553   1HD2  LEU  68          1HD2      LEU  68  83.652  -2.619   5.513
  554   2HD2  LEU  68          2HD2      LEU  68  84.655  -3.173   4.172
  555   3HD2  LEU  68          3HD2      LEU  68  84.460  -4.184   5.604
  556    H    ARG  69           H        ARG  69  79.961  -6.581   6.832
  557    HA   ARG  69           HA       ARG  69  78.448  -5.073   8.732
  558   1HB   ARG  69          2HB       ARG  69  78.638  -8.096   8.456
  559   2HB   ARG  69          1HB       ARG  69  77.284  -7.200   9.125
  560   1HG   ARG  69          2HG       ARG  69  77.013  -6.109   6.850
  561   2HG   ARG  69          1HG       ARG  69  78.196  -7.270   6.242
  562   1HD   ARG  69          2HD       ARG  69  76.618  -9.009   7.513
  563   2HD   ARG  69          1HD       ARG  69  75.404  -7.757   7.202
  564    HE   ARG  69           HE       ARG  69  76.599  -7.942   4.765
  565   1HH1  ARG  69          1HH1      ARG  69  75.379 -10.428   6.929
  566   2HH1  ARG  69          2HH1      ARG  69  75.094 -11.537   5.637
  567   1HH2  ARG  69          1HH2      ARG  69  76.196  -9.421   3.147
  568   2HH2  ARG  69          2HH2      ARG  69  75.545 -10.979   3.526
  569    H    ASP  70           H        ASP  70  80.766  -7.731   9.203
  570    HA   ASP  70           HA       ASP  70  80.472  -7.892  12.055
  571   1HB   ASP  70          2HB       ASP  70  82.703  -8.734  10.173
  572   2HB   ASP  70          1HB       ASP  70  82.550  -9.277  11.844
  573    H    VAL  71           H        VAL  71  82.991  -6.361  10.024
  574    HA   VAL  71           HA       VAL  71  84.647  -5.406  12.147
  575    HB   VAL  71           HB       VAL  71  84.074  -4.336   9.357
  576   1HG1  VAL  71          1HG1      VAL  71  85.176  -2.618  10.725
  577   2HG1  VAL  71          2HG1      VAL  71  86.300  -3.261   9.525
  578   3HG1  VAL  71          3HG1      VAL  71  86.414  -3.778  11.208
  579   1HG2  VAL  71          1HG2      VAL  71  84.873  -6.663   9.422
  580   2HG2  VAL  71          2HG2      VAL  71  86.230  -6.178  10.438
  581   3HG2  VAL  71          3HG2      VAL  71  86.123  -5.601   8.775
  582    H    ILE  72           H        ILE  72  81.827  -3.951  10.565
  583    HA   ILE  72           HA       ILE  72  82.066  -1.433  12.028
  584    HB   ILE  72           HB       ILE  72  79.894  -2.603  10.252
  585   1HG1  ILE  72          2HG1      ILE  72  82.103  -0.624   9.602
  586   2HG1  ILE  72          1HG1      ILE  72  82.176  -2.345   9.221
  587   1HG2  ILE  72          1HG2      ILE  72  79.169  -0.701  11.742
  588   2HG2  ILE  72          2HG2      ILE  72  79.092  -0.319  10.023
  589   3HG2  ILE  72          3HG2      ILE  72  80.425   0.292  11.004
  590   1HD1  ILE  72          1HD1      ILE  72  79.896  -1.971   8.046
  591   2HD1  ILE  72          2HD1      ILE  72  81.349  -1.377   7.237
  592   3HD1  ILE  72          3HD1      ILE  72  80.310  -0.255   8.115
  593    H    GLY  73           H        GLY  73  80.567  -4.505  12.711
  594   1HA   GLY  73          2HA       GLY  73  79.470  -5.159  14.691
  595   2HA   GLY  73          1HA       GLY  73  79.644  -3.505  15.277
  596    H    ILE  74           H        ILE  74  78.072  -4.424  12.244
  597    HA   ILE  74           HA       ILE  74  75.702  -2.867  13.047
  598    HB   ILE  74           HB       ILE  74  76.444  -4.309  10.479
  599   1HG1  ILE  74          2HG1      ILE  74  78.097  -2.587  11.094
  600   2HG1  ILE  74          1HG1      ILE  74  77.161  -2.070   9.695
  601   1HG2  ILE  74          1HG2      ILE  74  74.847  -2.350   9.649
  602   2HG2  ILE  74          2HG2      ILE  74  74.192  -2.510  11.279
  603   3HG2  ILE  74          3HG2      ILE  74  74.189  -3.895  10.188
  604   1HD1  ILE  74          1HD1      ILE  74  76.851  -0.150  10.874
  605   2HD1  ILE  74          2HD1      ILE  74  77.295  -0.909  12.403
  606   3HD1  ILE  74          3HD1      ILE  74  75.656  -1.081  11.777
  607    H    LYS  75           H        LYS  75  73.655  -3.699  13.382
  608    HA   LYS  75           HA       LYS  75  73.301  -6.679  13.236
  609   1HB   LYS  75          2HB       LYS  75  72.932  -4.669  15.426
  610   2HB   LYS  75          1HB       LYS  75  71.840  -6.053  15.374
  611   1HG   LYS  75          2HG       LYS  75  73.466  -7.524  15.984
  612   2HG   LYS  75          1HG       LYS  75  74.686  -6.743  14.979
  613   1HD   LYS  75          2HD       LYS  75  74.781  -4.884  16.682
  614   2HD   LYS  75          1HD       LYS  75  73.739  -5.859  17.717
  615   1HE   LYS  75          2HE       LYS  75  75.423  -7.699  17.648
  616   2HE   LYS  75          1HE       LYS  75  76.489  -6.651  16.691
  617   1HZ   LYS  75          1HZ       LYS  75  76.905  -6.511  19.118
  618   2HZ   LYS  75          2HZ       LYS  75  75.334  -5.900  19.323
  619   3HZ   LYS  75          3HZ       LYS  75  76.478  -5.023  18.424
  620    HA   PRO  76           HA       PRO  76  69.445  -6.023  11.139
  621   1HB   PRO  76          2HB       PRO  76  68.072  -7.673  13.186
  622   2HB   PRO  76          1HB       PRO  76  68.166  -7.903  11.430
  623   1HG   PRO  76          2HG       PRO  76  69.537  -9.422  13.182
  624   2HG   PRO  76          1HG       PRO  76  70.117  -9.062  11.550
  625   1HD   PRO  76          2HD       PRO  76  71.067  -8.027  14.149
  626   2HD   PRO  76          1HD       PRO  76  71.931  -8.207  12.611
  627    H    GLY  77           H        GLY  77  67.991  -4.353  11.280
  628   1HA   GLY  77          2HA       GLY  77  66.238  -3.080  12.273
  629   2HA   GLY  77          1HA       GLY  77  66.672  -3.748  13.842
  630    H    GLU  78           H        GLU  78  69.548  -2.707  12.488
  631    HA   GLU  78           HA       GLU  78  69.439  -0.182  14.057
  632   1HB   GLU  78          2HB       GLU  78  71.499  -2.148  13.182
  633   2HB   GLU  78          1HB       GLU  78  72.024  -0.476  13.388
  634   1HG   GLU  78          2HG       GLU  78  70.979  -0.483  15.664
  635   2HG   GLU  78          1HG       GLU  78  70.632  -2.199  15.457
  636    H    VAL  79           H        VAL  79  69.542   1.784  13.078
  637    HA   VAL  79           HA       VAL  79  69.367   1.838  10.136
  638    HB   VAL  79           HB       VAL  79  67.740   2.968  11.608
  639   1HG1  VAL  79          1HG1      VAL  79  69.425   5.226  12.372
  640   2HG1  VAL  79          2HG1      VAL  79  70.008   3.720  13.078
  641   3HG1  VAL  79          3HG1      VAL  79  68.350   4.243  13.367
  642   1HG2  VAL  79          1HG2      VAL  79  67.494   4.800  10.222
  643   2HG2  VAL  79          2HG2      VAL  79  68.692   3.900   9.293
  644   3HG2  VAL  79          3HG2      VAL  79  69.200   5.238  10.323
  645    H    ILE  80           H        ILE  80  70.924   2.579   8.809
  646    HA   ILE  80           HA       ILE  80  73.233   4.110   9.943
  647    HB   ILE  80           HB       ILE  80  74.610   2.935   8.232
  648   1HG1  ILE  80          2HG1      ILE  80  72.088   1.343   7.678
  649   2HG1  ILE  80          1HG1      ILE  80  72.734   2.597   6.618
  650   1HG2  ILE  80          1HG2      ILE  80  74.782   0.895   9.400
  651   2HG2  ILE  80          2HG2      ILE  80  73.050   0.832   9.727
  652   3HG2  ILE  80          3HG2      ILE  80  74.069   1.987  10.588
  653   1HD1  ILE  80          1HD1      ILE  80  74.614   1.332   6.046
  654   2HD1  ILE  80          2HD1      ILE  80  73.373   0.086   6.177
  655   3HD1  ILE  80          3HD1      ILE  80  74.512   0.339   7.499
  656    H    GLU  81           H        GLU  81  74.158   5.638   8.376
  657    HA   GLU  81           HA       GLU  81  72.160   6.710   6.437
  658   1HB   GLU  81          2HB       GLU  81  73.149   8.146   8.250
  659   2HB   GLU  81          1HB       GLU  81  74.741   7.879   7.538
  660   1HG   GLU  81          2HG       GLU  81  73.928   8.864   5.406
  661   2HG   GLU  81          1HG       GLU  81  72.372   9.188   6.171
  662    H    VAL  82           H        VAL  82  72.558   6.473   4.292
  663    HA   VAL  82           HA       VAL  82  75.107   5.134   3.509
  664    HB   VAL  82           HB       VAL  82  72.279   5.046   2.399
  665   1HG1  VAL  82          1HG1      VAL  82  74.811   3.578   1.621
  666   2HG1  VAL  82          2HG1      VAL  82  73.800   4.598   0.596
  667   3HG1  VAL  82          3HG1      VAL  82  73.198   3.036   1.152
  668   1HG2  VAL  82          1HG2      VAL  82  72.226   3.862   4.428
  669   2HG2  VAL  82          2HG2      VAL  82  73.886   3.296   4.248
  670   3HG2  VAL  82          3HG2      VAL  82  72.605   2.596   3.259
  671    H    LEU  83           H        LEU  83  76.377   6.120   2.039
  672    HA   LEU  83           HA       LEU  83  75.293   8.433   0.457
  673   1HB   LEU  83          2HB       LEU  83  78.180   7.824   1.212
  674   2HB   LEU  83          1HB       LEU  83  77.545   9.338   0.581
  675    HG   LEU  83           HG       LEU  83  76.874   8.138   3.287
  676   1HD1  LEU  83          1HD1      LEU  83  79.203   9.055   2.999
  677   2HD1  LEU  83          2HD1      LEU  83  78.237   9.907   4.208
  678   3HD1  LEU  83          3HD1      LEU  83  78.478  10.617   2.611
  679   1HD2  LEU  83          1HD2      LEU  83  76.186  10.875   2.185
  680   2HD2  LEU  83          2HD2      LEU  83  75.610  10.143   3.684
  681   3HD2  LEU  83          3HD2      LEU  83  75.080   9.502   2.129
  682    H    LEU  84           H        LEU  84  75.362   8.131  -1.774
  683    HA   LEU  84           HA       LEU  84  76.692   5.759  -2.935
  684   1HB   LEU  84          2HB       LEU  84  74.911   7.988  -3.848
  685   2HB   LEU  84          1HB       LEU  84  75.862   7.115  -5.055
  686    HG   LEU  84           HG       LEU  84  74.392   5.497  -3.024
  687   1HD1  LEU  84          1HD1      LEU  84  72.646   5.804  -5.251
  688   2HD1  LEU  84          2HD1      LEU  84  73.061   7.427  -4.708
  689   3HD1  LEU  84          3HD1      LEU  84  72.354   6.277  -3.580
  690   1HD2  LEU  84          1HD2      LEU  84  75.458   5.263  -5.801
  691   2HD2  LEU  84          2HD2      LEU  84  74.036   4.297  -5.406
  692   3HD2  LEU  84          3HD2      LEU  84  75.520   4.105  -4.472
  693    H    LEU  85           H        LEU  85  78.633   5.836  -4.057
  694    HA   LEU  85           HA       LEU  85  80.167   8.387  -3.853
  695   1HB   LEU  85          2HB       LEU  85  80.730   5.469  -3.614
  696   2HB   LEU  85          1HB       LEU  85  82.031   6.493  -4.227
  697    HG   LEU  85           HG       LEU  85  80.495   7.238  -1.741
  698   1HD1  LEU  85          1HD1      LEU  85  82.136   6.096  -0.390
  699   2HD1  LEU  85          2HD1      LEU  85  83.069   5.642  -1.816
  700   3HD1  LEU  85          3HD1      LEU  85  81.485   4.921  -1.532
  701   1HD2  LEU  85          1HD2      LEU  85  82.892   8.239  -1.335
  702   2HD2  LEU  85          2HD2      LEU  85  81.794   9.056  -2.448
  703   3HD2  LEU  85          3HD2      LEU  85  83.075   8.020  -3.076
  704    H    GLY  86           H        GLY  86  79.190   5.830  -6.105
  705   1HA   GLY  86          2HA       GLY  86  79.755   7.542  -8.409
  706   2HA   GLY  86          1HA       GLY  86  80.938   6.247  -8.248
  707    H    HIS  87           H        HIS  87  79.678   6.040 -10.509
  708    HA   HIS  87           HA       HIS  87  77.699   3.828 -10.131
  709   1HB   HIS  87          2HB       HIS  87  76.315   4.881 -11.920
  710   2HB   HIS  87          1HB       HIS  87  76.472   5.933 -10.519
  711    HD1  HIS  87           HD1      HIS  87  77.635   5.556 -14.080
  712    HD2  HIS  87           HD2      HIS  87  77.934   8.320 -10.974
  713    HE1  HIS  87           HE1      HIS  87  78.607   7.665 -15.089
  714    H    TYR  88           H        TYR  88  77.857   2.204 -11.772
  715    HA   TYR  88           HA       TYR  88  79.910   2.669 -13.909
  716   1HB   TYR  88          2HB       TYR  88  79.519   0.148 -12.257
  717   2HB   TYR  88          1HB       TYR  88  80.774   0.423 -13.460
  718    HD1  TYR  88           HD1      TYR  88  81.632   3.244 -12.812
  719    HD2  TYR  88           HD2      TYR  88  80.682  -0.111 -10.197
  720    HE1  TYR  88           HE1      TYR  88  83.095   4.226 -11.015
  721    HE2  TYR  88           HE2      TYR  88  82.148   0.871  -8.408
  722    HH   TYR  88           HH       TYR  88  83.451   4.110  -8.646
  723    H    LYS  89           H        LYS  89  79.317   1.883 -15.915
  724    HA   LYS  89           HA       LYS  89  76.565   0.888 -16.270
  725   1HB   LYS  89          2HB       LYS  89  77.161   1.128 -18.675
  726   2HB   LYS  89          1HB       LYS  89  77.534   2.587 -17.761
  727   1HG   LYS  89          2HG       LYS  89  79.818   2.280 -17.933
  728   2HG   LYS  89          1HG       LYS  89  79.686   0.525 -18.030
  729   1HD   LYS  89          2HD       LYS  89  79.134   0.559 -20.304
  730   2HD   LYS  89          1HD       LYS  89  78.590   2.236 -20.246
  731   1HE   LYS  89          2HE       LYS  89  81.469   1.643 -19.619
  732   2HE   LYS  89          1HE       LYS  89  80.942   1.673 -21.314
  733   1HZ   LYS  89          1HZ       LYS  89  79.813   3.816 -20.794
  734   2HZ   LYS  89          2HZ       LYS  89  81.508   3.891 -20.715
  735   3HZ   LYS  89          3HZ       LYS  89  80.592   3.813 -19.287
  736    HA   PRO  90           HA       PRO  90  77.371  -3.467 -16.479
  737   1HB   PRO  90          2HB       PRO  90  75.986  -3.371 -19.144
  738   2HB   PRO  90          1HB       PRO  90  75.683  -4.443 -17.757
  739   1HG   PRO  90          2HG       PRO  90  74.031  -2.474 -18.190
  740   2HG   PRO  90          1HG       PRO  90  74.613  -2.757 -16.536
  741   1HD   PRO  90          2HD       PRO  90  75.509  -0.685 -18.514
  742   2HD   PRO  90          1HD       PRO  90  75.158  -0.508 -16.776
  743    H    ARG  91           H        ARG  91  79.024  -4.765 -17.323
  744    HA   ARG  91           HA       ARG  91  80.396  -3.811 -19.817
  745   1HB   ARG  91          2HB       ARG  91  81.519  -3.179 -17.669
  746   2HB   ARG  91          1HB       ARG  91  81.635  -4.893 -17.266
  747   1HG   ARG  91          2HG       ARG  91  82.946  -5.279 -19.335
  748   2HG   ARG  91          1HG       ARG  91  82.866  -3.553 -19.692
  749   1HD   ARG  91          2HD       ARG  91  84.009  -3.086 -17.511
  750   2HD   ARG  91          1HD       ARG  91  84.194  -4.835 -17.279
  751    HE   ARG  91           HE       ARG  91  85.136  -3.883 -19.885
  752   1HH1  ARG  91          1HH1      ARG  91  86.023  -4.510 -16.547
  753   2HH1  ARG  91          2HH1      ARG  91  87.701  -4.671 -16.928
  754   1HH2  ARG  91          1HH2      ARG  91  87.313  -4.102 -20.314
  755   2HH2  ARG  91          2HH2      ARG  91  88.424  -4.444 -19.031
  756    H    ASN  92           H        ASN  92  81.047  -5.444 -21.224
  757    HA   ASN  92           HA       ASN  92  79.994  -8.157 -20.739
  758   1HB   ASN  92          2HB       ASN  92  81.415  -6.813 -23.063
  759   2HB   ASN  92          1HB       ASN  92  80.715  -8.431 -23.124
  760   1HD2  ASN  92          1HD2      ASN  92  79.809  -6.216 -24.787
  761   2HD2  ASN  92          2HD2      ASN  92  78.204  -5.879 -24.350
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  84.960  14.681  -3.387
    2   2H    MET   1          2H        MET   1  85.012  12.986  -3.308
    3   3H    MET   1          3H        MET   1  86.075  13.914  -2.362
    4    HA   MET   1           HA       MET   1  84.080  12.927  -1.168
    5   1HB   MET   1          2HB       MET   1  83.866  15.054   0.131
    6   2HB   MET   1          1HB       MET   1  85.544  14.698  -0.279
    7   1HG   MET   1          2HG       MET   1  85.402  16.229  -2.210
    8   2HG   MET   1          1HG       MET   1  83.722  16.582  -1.809
    9   1HE   MET   1          1HE       MET   1  83.537  18.514   1.172
   10   2HE   MET   1          2HE       MET   1  84.061  16.931   1.739
   11   3HE   MET   1          3HE       MET   1  82.980  17.047   0.355
   12    H    ASP   2           H        ASP   2  83.092  13.164  -3.833
   13    HA   ASP   2           HA       ASP   2  80.650  14.862  -3.594
   14   1HB   ASP   2          2HB       ASP   2  81.916  13.311  -5.878
   15   2HB   ASP   2          1HB       ASP   2  80.466  14.305  -6.030
   16    H    VAL   3           H        VAL   3  78.569  13.912  -3.687
   17    HA   VAL   3           HA       VAL   3  78.455  10.935  -3.633
   18    HB   VAL   3           HB       VAL   3  78.313  12.210  -1.409
   19   1HG1  VAL   3          1HG1      VAL   3  76.279  13.311  -0.800
   20   2HG1  VAL   3          2HG1      VAL   3  75.487  12.813  -2.298
   21   3HG1  VAL   3          3HG1      VAL   3  76.780  14.015  -2.339
   22   1HG2  VAL   3          1HG2      VAL   3  76.187  10.298  -2.373
   23   2HG2  VAL   3          2HG2      VAL   3  76.276  10.811  -0.688
   24   3HG2  VAL   3          3HG2      VAL   3  77.626   9.944  -1.418
   25    H    LEU   4           H        LEU   4  76.761  10.051  -4.825
   26    HA   LEU   4           HA       LEU   4  75.413  11.871  -6.702
   27   1HB   LEU   4          2HB       LEU   4  75.284   8.850  -6.444
   28   2HB   LEU   4          1HB       LEU   4  74.874   9.800  -7.867
   29    HG   LEU   4           HG       LEU   4  77.630   9.454  -6.635
   30   1HD1  LEU   4          1HD1      LEU   4  76.294   8.520  -9.170
   31   2HD1  LEU   4          2HD1      LEU   4  77.164   7.569  -7.966
   32   3HD1  LEU   4          3HD1      LEU   4  78.050   8.637  -9.054
   33   1HD2  LEU   4          1HD2      LEU   4  78.258  10.783  -8.819
   34   2HD2  LEU   4          2HD2      LEU   4  77.737  11.676  -7.386
   35   3HD2  LEU   4          3HD2      LEU   4  76.604  11.385  -8.708
   36    H    ALA   5           H        ALA   5  74.605  10.240  -3.736
   37    HA   ALA   5           HA       ALA   5  72.030  11.529  -3.603
   38   1HB   ALA   5          1HB       ALA   5  70.590   9.829  -4.206
   39   2HB   ALA   5          2HB       ALA   5  71.691   8.567  -3.651
   40   3HB   ALA   5          3HB       ALA   5  71.963   9.353  -5.206
   41    H    LYS   6           H        LYS   6  71.034  11.160  -1.496
   42    HA   LYS   6           HA       LYS   6  72.696   9.585   0.444
   43   1HB   LYS   6          2HB       LYS   6  73.230  12.014   0.481
   44   2HB   LYS   6          1HB       LYS   6  71.528  12.371   0.782
   45   1HG   LYS   6          2HG       LYS   6  71.705  10.889   2.844
   46   2HG   LYS   6          1HG       LYS   6  73.450  10.891   2.591
   47   1HD   LYS   6          2HD       LYS   6  71.786  13.409   2.856
   48   2HD   LYS   6          1HD       LYS   6  72.657  12.660   4.196
   49   1HE   LYS   6          2HE       LYS   6  74.785  12.888   2.911
   50   2HE   LYS   6          1HE       LYS   6  73.889  13.733   1.632
   51   1HZ   LYS   6          1HZ       LYS   6  73.223  15.411   3.142
   52   2HZ   LYS   6          2HZ       LYS   6  74.896  15.217   3.365
   53   3HZ   LYS   6          3HZ       LYS   6  73.806  14.549   4.482
   54    H    PHE   7           H        PHE   7  71.401   8.174   1.575
   55    HA   PHE   7           HA       PHE   7  68.635   8.984   2.291
   56   1HB   PHE   7          2HB       PHE   7  67.700   6.960   1.240
   57   2HB   PHE   7          1HB       PHE   7  68.536   7.952   0.050
   58    HD1  PHE   7           HD1      PHE   7  68.251   4.664   1.493
   59    HD2  PHE   7           HD2      PHE   7  71.058   7.365  -0.457
   60    HE1  PHE   7           HE1      PHE   7  69.714   2.709   0.884
   61    HE2  PHE   7           HE2      PHE   7  72.522   5.410  -1.057
   62    HZ   PHE   7           HZ       PHE   7  71.847   3.078  -0.382
   63    H    HIS   8           H        HIS   8  67.668   7.476   3.893
   64    HA   HIS   8           HA       HIS   8  69.795   6.222   5.605
   65   1HB   HIS   8          2HB       HIS   8  67.054   7.393   6.212
   66   2HB   HIS   8          1HB       HIS   8  68.153   6.727   7.419
   67    HD1  HIS   8           HD1      HIS   8  70.384   8.050   7.864
   68    HD2  HIS   8           HD2      HIS   8  67.725   9.974   5.294
   69    HE1  HIS   8           HE1      HIS   8  71.181  10.446   7.671
   70    H    THR   9           H        THR   9  69.559   4.082   6.196
   71    HA   THR   9           HA       THR   9  66.955   2.713   5.927
   72    HB   THR   9           HB       THR   9  68.088   2.657   3.676
   73    HG1  THR   9           HG1      THR   9  66.828   0.969   3.831
   74   1HG2  THR   9          1HG2      THR   9  70.425   2.596   4.429
   75   2HG2  THR   9          2HG2      THR   9  70.073   1.198   3.412
   76   3HG2  THR   9          3HG2      THR   9  70.155   1.015   5.165
   77    H    THR  10           H        THR  10  67.073   0.497   6.944
   78    HA   THR  10           HA       THR  10  69.324   0.321   8.913
   79    HB   THR  10           HB       THR  10  66.941   0.741   9.748
   80    HG1  THR  10           HG1      THR  10  67.680  -0.148  11.462
   81   1HG2  THR  10          1HG2      THR  10  65.243  -0.697   9.340
   82   2HG2  THR  10          2HG2      THR  10  66.272  -2.103   9.639
   83   3HG2  THR  10          3HG2      THR  10  66.259  -1.337   8.046
   84    H    VAL  11           H        VAL  11  70.047  -1.887   9.419
   85    HA   VAL  11           HA       VAL  11  70.391  -3.459   6.991
   86    HB   VAL  11           HB       VAL  11  71.167  -3.990   9.883
   87   1HG1  VAL  11          1HG1      VAL  11  71.858  -5.285   7.260
   88   2HG1  VAL  11          2HG1      VAL  11  71.508  -6.038   8.815
   89   3HG1  VAL  11          3HG1      VAL  11  73.061  -5.249   8.549
   90   1HG2  VAL  11          1HG2      VAL  11  72.208  -2.170   7.806
   91   2HG2  VAL  11          2HG2      VAL  11  73.442  -3.205   8.525
   92   3HG2  VAL  11          3HG2      VAL  11  72.468  -2.154   9.551
   93    H    HIS  12           H        HIS  12  69.396  -5.358   6.442
   94    HA   HIS  12           HA       HIS  12  67.436  -6.543   8.377
   95   1HB   HIS  12          2HB       HIS  12  67.377  -6.055   5.417
   96   2HB   HIS  12          1HB       HIS  12  66.489  -7.434   6.073
   97    HD1  HIS  12           HD1      HIS  12  66.894  -3.739   6.998
   98    HD2  HIS  12           HD2      HIS  12  63.946  -6.680   6.801
   99    HE1  HIS  12           HE1      HIS  12  64.732  -2.633   7.712
  100    H    ARG  13           H        ARG  13  67.093  -8.937   7.829
  101    HA   ARG  13           HA       ARG  13  69.304 -10.467   8.448
  102   1HB   ARG  13          2HB       ARG  13  66.858 -11.076   6.780
  103   2HB   ARG  13          1HB       ARG  13  67.949 -12.341   7.356
  104   1HG   ARG  13          2HG       ARG  13  66.715 -10.310   9.227
  105   2HG   ARG  13          1HG       ARG  13  65.907 -11.826   8.830
  106   1HD   ARG  13          2HD       ARG  13  68.769 -11.836   9.794
  107   2HD   ARG  13          1HD       ARG  13  67.421 -11.796  10.947
  108    HE   ARG  13           HE       ARG  13  68.126 -14.046   9.213
  109   1HH1  ARG  13          1HH1      ARG  13  65.545 -12.483  11.005
  110   2HH1  ARG  13          2HH1      ARG  13  64.622 -13.939  11.128
  111   1HH2  ARG  13          1HH2      ARG  13  66.889 -15.895   9.404
  112   2HH2  ARG  13          2HH2      ARG  13  65.371 -15.846  10.234
  113    H    ILE  14           H        ILE  14  70.776 -11.799   7.278
  114    HA   ILE  14           HA       ILE  14  72.319 -12.331   5.589
  115    HB   ILE  14           HB       ILE  14  70.196 -11.237   3.712
  116   1HG1  ILE  14          2HG1      ILE  14  70.609 -14.120   4.544
  117   2HG1  ILE  14          1HG1      ILE  14  69.434 -13.068   5.335
  118   1HG2  ILE  14          1HG2      ILE  14  71.379 -13.204   2.353
  119   2HG2  ILE  14          2HG2      ILE  14  72.730 -12.778   3.404
  120   3HG2  ILE  14          3HG2      ILE  14  72.018 -11.560   2.345
  121   1HD1  ILE  14          1HD1      ILE  14  68.082 -13.968   3.692
  122   2HD1  ILE  14          2HD1      ILE  14  69.419 -14.175   2.559
  123   3HD1  ILE  14          3HD1      ILE  14  68.719 -12.575   2.814
  124    H    GLY  15           H        GLY  15  71.646  -9.228   6.492
  125   1HA   GLY  15          2HA       GLY  15  72.993  -7.308   6.290
  126   2HA   GLY  15          1HA       GLY  15  74.011  -8.190   5.155
  127    H    ARG  16           H        ARG  16  70.640  -8.247   4.383
  128    HA   ARG  16           HA       ARG  16  71.168  -6.713   1.938
  129   1HB   ARG  16          2HB       ARG  16  69.904  -8.846   2.014
  130   2HB   ARG  16          1HB       ARG  16  68.689  -8.082   3.039
  131   1HG   ARG  16          2HG       ARG  16  68.270  -6.413   1.222
  132   2HG   ARG  16          1HG       ARG  16  69.387  -7.308   0.191
  133   1HD   ARG  16          2HD       ARG  16  66.949  -8.576   1.486
  134   2HD   ARG  16          1HD       ARG  16  66.960  -7.930  -0.167
  135    HE   ARG  16           HE       ARG  16  69.178  -9.757   0.400
  136   1HH1  ARG  16          1HH1      ARG  16  65.871  -9.502  -0.744
  137   2HH1  ARG  16          2HH1      ARG  16  65.963 -10.989  -1.621
  138   1HH2  ARG  16          1HH2      ARG  16  69.238 -11.667  -0.748
  139   2HH2  ARG  16          2HH2      ARG  16  67.841 -12.200  -1.624
  140    H    ILE  17           H        ILE  17  70.198  -4.737   1.403
  141    HA   ILE  17           HA       ILE  17  68.315  -3.517   3.368
  142    HB   ILE  17           HB       ILE  17  69.500  -1.355   3.109
  143   1HG1  ILE  17          2HG1      ILE  17  71.640  -2.902   1.619
  144   2HG1  ILE  17          1HG1      ILE  17  70.404  -1.948   0.799
  145   1HG2  ILE  17          1HG2      ILE  17  71.105  -1.838   4.686
  146   2HG2  ILE  17          2HG2      ILE  17  71.708  -3.238   3.798
  147   3HG2  ILE  17          3HG2      ILE  17  70.217  -3.360   4.730
  148   1HD1  ILE  17          1HD1      ILE  17  71.782  -0.522   2.988
  149   2HD1  ILE  17          2HD1      ILE  17  71.381   0.031   1.361
  150   3HD1  ILE  17          3HD1      ILE  17  72.820  -0.953   1.630
  151    H    ILE  18           H        ILE  18  66.811  -2.015   2.334
  152    HA   ILE  18           HA       ILE  18  66.747  -2.240  -0.661
  153    HB   ILE  18           HB       ILE  18  64.450  -1.879   1.294
  154   1HG1  ILE  18          2HG1      ILE  18  65.439  -4.118   1.544
  155   2HG1  ILE  18          1HG1      ILE  18  63.880  -4.235   0.733
  156   1HG2  ILE  18          1HG2      ILE  18  63.225  -2.697  -0.887
  157   2HG2  ILE  18          2HG2      ILE  18  64.673  -2.094  -1.695
  158   3HG2  ILE  18          3HG2      ILE  18  63.683  -1.000  -0.724
  159   1HD1  ILE  18          1HD1      ILE  18  66.610  -4.756  -0.323
  160   2HD1  ILE  18          2HD1      ILE  18  65.483  -3.970  -1.429
  161   3HD1  ILE  18          3HD1      ILE  18  65.080  -5.537  -0.725
  162    H    ILE  19           H        ILE  19  66.928  -0.321  -1.720
  163    HA   ILE  19           HA       ILE  19  66.944   2.225  -0.231
  164    HB   ILE  19           HB       ILE  19  67.158   1.563  -3.204
  165   1HG1  ILE  19          2HG1      ILE  19  69.243   1.981  -1.019
  166   2HG1  ILE  19          1HG1      ILE  19  68.939   0.493  -1.904
  167   1HG2  ILE  19          1HG2      ILE  19  67.980   3.811  -3.477
  168   2HG2  ILE  19          2HG2      ILE  19  68.056   4.068  -1.734
  169   3HG2  ILE  19          3HG2      ILE  19  66.492   3.942  -2.540
  170   1HD1  ILE  19          1HD1      ILE  19  70.473   1.134  -3.417
  171   2HD1  ILE  19          2HD1      ILE  19  70.663   2.687  -2.603
  172   3HD1  ILE  19          3HD1      ILE  19  69.432   2.491  -3.852
  173    HA   PRO  20           HA       PRO  20  62.609   3.109  -0.966
  174   1HB   PRO  20          2HB       PRO  20  62.738   5.845  -1.070
  175   2HB   PRO  20          1HB       PRO  20  62.800   4.941   0.454
  176   1HG   PRO  20          2HG       PRO  20  65.076   5.970  -1.206
  177   2HG   PRO  20          1HG       PRO  20  64.798   6.170   0.536
  178   1HD   PRO  20          2HD       PRO  20  66.477   4.312  -0.298
  179   2HD   PRO  20          1HD       PRO  20  65.312   3.918   0.994
  180    H    ALA  21           H        ALA  21  61.415   3.452  -2.844
  181    HA   ALA  21           HA       ALA  21  62.669   3.328  -5.377
  182   1HB   ALA  21          1HB       ALA  21  60.371   3.819  -6.213
  183   2HB   ALA  21          2HB       ALA  21  59.907   4.317  -4.586
  184   3HB   ALA  21          3HB       ALA  21  60.358   2.641  -4.902
  185    H    GLY  22           H        GLY  22  61.808   6.115  -3.408
  186   1HA   GLY  22          2HA       GLY  22  61.839   8.110  -5.484
  187   2HA   GLY  22          1HA       GLY  22  62.108   8.426  -3.768
  188    H    THR  23           H        THR  23  64.412   6.888  -3.328
  189    HA   THR  23           HA       THR  23  66.467   8.647  -4.356
  190    HB   THR  23           HB       THR  23  66.659   5.940  -2.990
  191    HG1  THR  23           HG1      THR  23  66.703   7.157  -1.114
  192   1HG2  THR  23          1HG2      THR  23  68.897   6.324  -2.709
  193   2HG2  THR  23          2HG2      THR  23  68.684   8.070  -2.582
  194   3HG2  THR  23          3HG2      THR  23  68.692   7.296  -4.167
  195    H    ARG  24           H        ARG  24  65.415   5.344  -5.201
  196    HA   ARG  24           HA       ARG  24  67.463   4.661  -7.090
  197   1HB   ARG  24          2HB       ARG  24  64.518   4.062  -7.475
  198   2HB   ARG  24          1HB       ARG  24  65.891   3.076  -7.957
  199   1HG   ARG  24          2HG       ARG  24  66.365   3.031  -5.352
  200   2HG   ARG  24          1HG       ARG  24  64.646   3.402  -5.262
  201   1HD   ARG  24          2HD       ARG  24  64.492   1.427  -7.054
  202   2HD   ARG  24          1HD       ARG  24  65.989   0.930  -6.234
  203    HE   ARG  24           HE       ARG  24  64.409   1.528  -4.111
  204   1HH1  ARG  24          1HH1      ARG  24  63.752  -0.404  -6.967
  205   2HH1  ARG  24          2HH1      ARG  24  62.598  -1.388  -6.143
  206   1HH2  ARG  24          1HH2      ARG  24  62.932   0.222  -3.104
  207   2HH2  ARG  24          2HH2      ARG  24  62.136  -1.044  -3.979
  208    H    LYS  25           H        LYS  25  64.467   6.516  -7.446
  209    HA   LYS  25           HA       LYS  25  64.544   6.875 -10.282
  210   1HB   LYS  25          2HB       LYS  25  62.587   7.210  -8.783
  211   2HB   LYS  25          1HB       LYS  25  63.375   8.623  -8.085
  212   1HG   LYS  25          2HG       LYS  25  63.402   9.697 -10.307
  213   2HG   LYS  25          1HG       LYS  25  62.583   8.292 -10.990
  214   1HD   LYS  25          2HD       LYS  25  60.708   8.674  -9.366
  215   2HD   LYS  25          1HD       LYS  25  61.506  10.165  -8.865
  216   1HE   LYS  25          2HE       LYS  25  60.090  11.009 -10.511
  217   2HE   LYS  25          1HE       LYS  25  61.498  10.606 -11.515
  218   1HZ   LYS  25          1HZ       LYS  25  60.563   8.420 -11.909
  219   2HZ   LYS  25          2HZ       LYS  25  59.460   9.615 -12.400
  220   3HZ   LYS  25          3HZ       LYS  25  59.220   8.784 -10.938
  221    H    PHE  26           H        PHE  26  65.567   9.058  -7.649
  222    HA   PHE  26           HA       PHE  26  66.589  11.192  -9.232
  223   1HB   PHE  26          2HB       PHE  26  66.182  11.203  -6.779
  224   2HB   PHE  26          1HB       PHE  26  67.552  10.116  -6.559
  225    HD1  PHE  26           HD1      PHE  26  69.764  10.963  -6.332
  226    HD2  PHE  26           HD2      PHE  26  66.617  13.493  -7.967
  227    HE1  PHE  26           HE1      PHE  26  71.331  12.931  -6.302
  228    HE2  PHE  26           HE2      PHE  26  68.184  15.461  -7.935
  229    HZ   PHE  26           HZ       PHE  26  70.540  15.180  -7.104
  230    H    TYR  27           H        TYR  27  68.133   8.189  -8.156
  231    HA   TYR  27           HA       TYR  27  70.754   8.951  -9.260
  232   1HB   TYR  27          2HB       TYR  27  70.342   7.714  -7.129
  233   2HB   TYR  27          1HB       TYR  27  69.707   6.370  -8.060
  234    HD1  TYR  27           HD1      TYR  27  72.643   7.863  -6.633
  235    HD2  TYR  27           HD2      TYR  27  71.309   5.339  -9.919
  236    HE1  TYR  27           HE1      TYR  27  74.967   6.937  -6.876
  237    HE2  TYR  27           HE2      TYR  27  73.631   4.414 -10.155
  238    HH   TYR  27           HH       TYR  27  75.671   4.141  -8.633
  239    H    GLY  28           H        GLY  28  67.924   7.343 -10.494
  240   1HA   GLY  28          2HA       GLY  28  67.550   6.490 -12.651
  241   2HA   GLY  28          1HA       GLY  28  69.217   6.906 -13.051
  242    H    ILE  29           H        ILE  29  68.028   4.755 -10.462
  243    HA   ILE  29           HA       ILE  29  69.989   2.716 -11.285
  244    HB   ILE  29           HB       ILE  29  67.973   2.835  -9.010
  245   1HG1  ILE  29          2HG1      ILE  29  70.945   3.442  -9.046
  246   2HG1  ILE  29          1HG1      ILE  29  69.670   4.657  -9.027
  247   1HG2  ILE  29          1HG2      ILE  29  70.039   0.859  -9.838
  248   2HG2  ILE  29          2HG2      ILE  29  68.537   0.609  -8.950
  249   3HG2  ILE  29          3HG2      ILE  29  69.960   1.235  -8.117
  250   1HD1  ILE  29          1HD1      ILE  29  69.835   4.544  -6.771
  251   2HD1  ILE  29          2HD1      ILE  29  70.719   3.015  -6.829
  252   3HD1  ILE  29          3HD1      ILE  29  68.956   3.021  -6.919
  253    H    GLU  30           H        GLU  30  69.511   0.964 -12.474
  254    HA   GLU  30           HA       GLU  30  66.715  -0.097 -12.467
  255   1HB   GLU  30          2HB       GLU  30  68.619   0.147 -14.825
  256   2HB   GLU  30          1HB       GLU  30  67.043  -0.643 -14.875
  257   1HG   GLU  30          2HG       GLU  30  65.975   1.501 -14.199
  258   2HG   GLU  30          1HG       GLU  30  67.555   2.279 -14.243
  259    H    GLN  31           H        GLN  31  66.702  -2.477 -12.801
  260    HA   GLN  31           HA       GLN  31  68.644  -3.886 -11.288
  261   1HB   GLN  31          2HB       GLN  31  66.313  -4.599 -11.916
  262   2HB   GLN  31          1HB       GLN  31  66.918  -4.962 -13.532
  263   1HG   GLN  31          2HG       GLN  31  68.516  -6.573 -12.596
  264   2HG   GLN  31          1HG       GLN  31  67.962  -6.192 -10.965
  265   1HE2  GLN  31          1HE2      GLN  31  67.747  -8.844 -11.769
  266   2HE2  GLN  31          2HE2      GLN  31  66.122  -9.243 -12.058
  267    H    GLY  32           H        GLY  32  70.530  -4.940 -11.824
  268   1HA   GLY  32          2HA       GLY  32  72.130  -5.961 -13.292
  269   2HA   GLY  32          1HA       GLY  32  71.326  -5.201 -14.661
  270    H    ASP  33           H        ASP  33  71.426  -2.584 -12.848
  271    HA   ASP  33           HA       ASP  33  73.916  -1.569 -14.015
  272   1HB   ASP  33          2HB       ASP  33  71.848  -0.455 -12.095
  273   2HB   ASP  33          1HB       ASP  33  73.182   0.493 -12.751
  274    H    PHE  34           H        PHE  34  75.693  -0.664 -12.702
  275    HA   PHE  34           HA       PHE  34  75.970  -1.990 -10.022
  276   1HB   PHE  34          2HB       PHE  34  77.953  -1.121 -12.142
  277   2HB   PHE  34          1HB       PHE  34  78.443  -1.601 -10.517
  278    HD1  PHE  34           HD1      PHE  34  76.910  -2.760 -13.714
  279    HD2  PHE  34           HD2      PHE  34  78.318  -3.930  -9.760
  280    HE1  PHE  34           HE1      PHE  34  76.794  -5.181 -14.389
  281    HE2  PHE  34           HE2      PHE  34  78.200  -6.350 -10.435
  282    HZ   PHE  34           HZ       PHE  34  77.438  -6.975 -12.750
  283    H    VAL  35           H        VAL  35  76.340  -0.638  -8.278
  284    HA   VAL  35           HA       VAL  35  76.998   2.222  -8.843
  285    HB   VAL  35           HB       VAL  35  75.392   2.853  -7.049
  286   1HG1  VAL  35          1HG1      VAL  35  73.865   1.098  -8.959
  287   2HG1  VAL  35          2HG1      VAL  35  74.791   2.465  -9.581
  288   3HG1  VAL  35          3HG1      VAL  35  73.497   2.735  -8.415
  289   1HG2  VAL  35          1HG2      VAL  35  74.854  -0.129  -7.041
  290   2HG2  VAL  35          2HG2      VAL  35  73.734   1.052  -6.357
  291   3HG2  VAL  35          3HG2      VAL  35  75.356   0.876  -5.681
  292    H    GLU  36           H        GLU  36  78.243   3.216  -7.110
  293    HA   GLU  36           HA       GLU  36  79.574   1.217  -5.305
  294   1HB   GLU  36          2HB       GLU  36  80.938   2.201  -7.167
  295   2HB   GLU  36          1HB       GLU  36  80.620   3.807  -6.509
  296   1HG   GLU  36          2HG       GLU  36  81.665   3.085  -4.356
  297   2HG   GLU  36          1HG       GLU  36  82.071   1.542  -5.106
  298    H    ILE  37           H        ILE  37  79.149   1.588  -3.190
  299    HA   ILE  37           HA       ILE  37  78.225   4.320  -2.393
  300    HB   ILE  37           HB       ILE  37  76.399   2.816  -3.092
  301   1HG1  ILE  37          2HG1      ILE  37  76.256   2.925  -0.090
  302   2HG1  ILE  37          1HG1      ILE  37  76.274   4.413  -1.034
  303   1HG2  ILE  37          1HG2      ILE  37  77.454   0.662  -2.638
  304   2HG2  ILE  37          2HG2      ILE  37  75.931   0.768  -1.755
  305   3HG2  ILE  37          3HG2      ILE  37  77.460   1.000  -0.906
  306   1HD1  ILE  37          1HD1      ILE  37  74.050   4.149  -1.313
  307   2HD1  ILE  37          2HD1      ILE  37  74.097   2.525  -0.631
  308   3HD1  ILE  37          3HD1      ILE  37  74.411   2.769  -2.349
  309    H    LYS  38           H        LYS  38  78.255   4.690  -0.061
  310    HA   LYS  38           HA       LYS  38  79.916   2.774   1.526
  311   1HB   LYS  38          2HB       LYS  38  81.157   4.790   0.576
  312   2HB   LYS  38          1HB       LYS  38  80.144   5.794   1.619
  313   1HG   LYS  38          2HG       LYS  38  80.928   4.570   3.593
  314   2HG   LYS  38          1HG       LYS  38  81.905   3.519   2.568
  315   1HD   LYS  38          2HD       LYS  38  83.164   5.525   1.776
  316   2HD   LYS  38          1HD       LYS  38  82.234   6.518   2.900
  317   1HE   LYS  38          2HE       LYS  38  83.123   4.532   4.573
  318   2HE   LYS  38          1HE       LYS  38  84.488   4.688   3.449
  319   1HZ   LYS  38          1HZ       LYS  38  84.413   7.088   3.750
  320   2HZ   LYS  38          2HZ       LYS  38  84.662   6.308   5.239
  321   3HZ   LYS  38          3HZ       LYS  38  83.131   6.932   4.849
  322    H    ILE  39           H        ILE  39  79.328   2.634   3.724
  323    HA   ILE  39           HA       ILE  39  76.873   4.169   4.529
  324    HB   ILE  39           HB       ILE  39  76.458   2.193   6.011
  325   1HG1  ILE  39          2HG1      ILE  39  78.707   0.859   4.481
  326   2HG1  ILE  39          1HG1      ILE  39  78.932   1.560   6.084
  327   1HG2  ILE  39          1HG2      ILE  39  75.197   1.861   4.149
  328   2HG2  ILE  39          2HG2      ILE  39  76.341   0.549   3.862
  329   3HG2  ILE  39          3HG2      ILE  39  76.557   2.101   3.053
  330   1HD1  ILE  39          1HD1      ILE  39  78.194  -1.013   5.694
  331   2HD1  ILE  39          2HD1      ILE  39  76.603  -0.256   5.774
  332   3HD1  ILE  39          3HD1      ILE  39  77.731  -0.086   7.120
  333    H    VAL  40           H        VAL  40  76.805   4.979   6.670
  334    HA   VAL  40           HA       VAL  40  79.280   4.740   8.322
  335    HB   VAL  40           HB       VAL  40  77.806   7.307   7.624
  336   1HG1  VAL  40          1HG1      VAL  40  80.066   6.637   9.500
  337   2HG1  VAL  40          2HG1      VAL  40  78.666   7.675   9.775
  338   3HG1  VAL  40          3HG1      VAL  40  79.990   8.232   8.751
  339   1HG2  VAL  40          1HG2      VAL  40  79.077   6.998   5.721
  340   2HG2  VAL  40          2HG2      VAL  40  80.243   5.961   6.542
  341   3HG2  VAL  40          3HG2      VAL  40  80.320   7.710   6.750
  342    H    LYS  41           H        LYS  41  78.670   4.127  10.334
  343    HA   LYS  41           HA       LYS  41  76.104   5.154  11.471
  344   1HB   LYS  41          2HB       LYS  41  75.898   2.795  10.628
  345   2HB   LYS  41          1HB       LYS  41  77.187   2.332  11.742
  346   1HG   LYS  41          2HG       LYS  41  75.799   3.277  13.620
  347   2HG   LYS  41          1HG       LYS  41  74.484   3.487  12.464
  348   1HD   LYS  41          2HD       LYS  41  74.616   1.037  11.950
  349   2HD   LYS  41          1HD       LYS  41  75.812   0.877  13.236
  350   1HE   LYS  41          2HE       LYS  41  73.706   0.328  14.242
  351   2HE   LYS  41          1HE       LYS  41  74.062   1.980  14.776
  352   1HZ   LYS  41          1HZ       LYS  41  71.781   1.635  13.804
  353   2HZ   LYS  41          2HZ       LYS  41  72.536   1.382  12.304
  354   3HZ   LYS  41          3HZ       LYS  41  72.692   2.877  13.095
  355    H    TYR  42           H        TYR  42  76.251   5.579  13.722
  356    HA   TYR  42           HA       TYR  42  79.034   5.567  14.818
  357   1HB   TYR  42          2HB       TYR  42  77.560   7.657  14.569
  358   2HB   TYR  42          1HB       TYR  42  76.591   6.997  15.888
  359    HD1  TYR  42           HD1      TYR  42  80.100   7.972  14.938
  360    HD2  TYR  42           HD2      TYR  42  77.280   7.236  18.174
  361    HE1  TYR  42           HE1      TYR  42  81.777   8.846  16.593
  362    HE2  TYR  42           HE2      TYR  42  78.956   8.112  19.833
  363    HH   TYR  42           HH       TYR  42  81.498   9.966  19.098
  364    H    GLU  43           H        GLU  43  79.532   4.137  16.433
  365    HA   GLU  43           HA       GLU  43  77.323   3.084  18.157
  366   1HB   GLU  43          2HB       GLU  43  79.520   1.526  16.754
  367   2HB   GLU  43          1HB       GLU  43  78.378   0.836  17.909
  368   1HG   GLU  43          2HG       GLU  43  76.501   1.563  16.436
  369   2HG   GLU  43          1HG       GLU  43  77.680   2.141  15.260
  370    H    GLY  44           H        GLY  44  77.905   2.959  20.310
  371   1HA   GLY  44          2HA       GLY  44  79.183   3.256  22.252
  372   2HA   GLY  44          1HA       GLY  44  80.541   2.599  21.337
  373    H    GLU  45           H        GLU  45  82.214   3.998  21.495
  374    HA   GLU  45           HA       GLU  45  81.664   6.931  21.377
  375   1HB   GLU  45          2HB       GLU  45  83.835   7.154  22.474
  376   2HB   GLU  45          1HB       GLU  45  82.852   5.988  23.351
  377   1HG   GLU  45          2HG       GLU  45  84.037   4.133  22.227
  378   2HG   GLU  45          1HG       GLU  45  85.014   5.298  21.334
  379    H    GLU  46           H        GLU  46  82.335   4.602  19.153
  380    HA   GLU  46           HA       GLU  46  84.143   6.412  17.596
  381   1HB   GLU  46          2HB       GLU  46  85.247   4.337  16.781
  382   2HB   GLU  46          1HB       GLU  46  85.365   4.503  18.531
  383   1HG   GLU  46          2HG       GLU  46  83.433   2.977  18.800
  384   2HG   GLU  46          1HG       GLU  46  83.341   2.795  17.048
  385    HA   PRO  47           HA       PRO  47  81.040   5.689  14.416
  386   1HB   PRO  47          2HB       PRO  47  82.769   6.763  12.379
  387   2HB   PRO  47          1HB       PRO  47  81.385   7.547  13.156
  388   1HG   PRO  47          2HG       PRO  47  84.048   8.267  13.455
  389   2HG   PRO  47          1HG       PRO  47  82.706   8.773  14.487
  390   1HD   PRO  47          2HD       PRO  47  84.805   6.760  14.990
  391   2HD   PRO  47          1HD       PRO  47  83.856   7.729  16.137
  392    H    LYS  48           H        LYS  48  80.747   3.947  13.041
  393    HA   LYS  48           HA       LYS  48  83.162   2.413  12.139
  394   1HB   LYS  48          2HB       LYS  48  80.291   1.533  12.613
  395   2HB   LYS  48          1HB       LYS  48  81.606   0.485  12.085
  396   1HG   LYS  48          2HG       LYS  48  81.677   2.065  14.665
  397   2HG   LYS  48          1HG       LYS  48  81.138   0.388  14.565
  398   1HD   LYS  48          2HD       LYS  48  83.346  -0.170  13.483
  399   2HD   LYS  48          1HD       LYS  48  83.875   1.473  13.853
  400   1HE   LYS  48          2HE       LYS  48  83.202   0.946  16.298
  401   2HE   LYS  48          1HE       LYS  48  83.194  -0.753  15.784
  402   1HZ   LYS  48          1HZ       LYS  48  85.426  -0.396  14.842
  403   2HZ   LYS  48          2HZ       LYS  48  85.395  -0.168  16.526
  404   3HZ   LYS  48          3HZ       LYS  48  85.438   1.174  15.485
  405    H    GLU  49           H        GLU  49  83.369   2.138   9.909
  406    HA   GLU  49           HA       GLU  49  81.119   3.086   8.169
  407   1HB   GLU  49          2HB       GLU  49  84.067   3.800   8.051
  408   2HB   GLU  49          1HB       GLU  49  82.857   4.315   6.874
  409   1HG   GLU  49          2HG       GLU  49  81.591   5.433   8.702
  410   2HG   GLU  49          1HG       GLU  49  82.858   4.973   9.836
  411    H    GLY  50           H        GLY  50  81.401   2.399   5.878
  412   1HA   GLY  50          2HA       GLY  50  83.316   0.269   5.274
  413   2HA   GLY  50          1HA       GLY  50  81.645  -0.283   5.402
  414    H    THR  51           H        THR  51  83.687   0.233   3.077
  415    HA   THR  51           HA       THR  51  81.672   1.578   1.297
  416    HB   THR  51           HB       THR  51  84.650   1.515   0.797
  417    HG1  THR  51           HG1      THR  51  84.808   2.677   2.538
  418   1HG2  THR  51          1HG2      THR  51  84.196   3.044  -0.842
  419   2HG2  THR  51          2HG2      THR  51  82.910   3.813   0.087
  420   3HG2  THR  51          3HG2      THR  51  82.594   2.307  -0.777
  421    H    PHE  52           H        PHE  52  81.118   0.382  -0.528
  422    HA   PHE  52           HA       PHE  52  82.931  -1.690  -1.548
  423   1HB   PHE  52          2HB       PHE  52  81.524  -3.574  -1.064
  424   2HB   PHE  52          1HB       PHE  52  81.668  -2.669   0.436
  425    HD1  PHE  52           HD1      PHE  52  79.406  -4.155  -1.919
  426    HD2  PHE  52           HD2      PHE  52  79.747  -0.890   0.943
  427    HE1  PHE  52           HE1      PHE  52  76.903  -3.971  -1.836
  428    HE2  PHE  52           HE2      PHE  52  77.237  -0.706   1.027
  429    HZ   PHE  52           HZ       PHE  52  75.817  -2.248  -0.370
  430    H    THR  53           H        THR  53  81.825  -2.855  -3.475
  431    HA   THR  53           HA       THR  53  80.083  -0.923  -4.970
  432    HB   THR  53           HB       THR  53  81.861  -3.186  -5.945
  433    HG1  THR  53           HG1      THR  53  83.295  -1.586  -6.452
  434   1HG2  THR  53          1HG2      THR  53  80.244  -2.873  -7.616
  435   2HG2  THR  53          2HG2      THR  53  81.542  -1.792  -8.125
  436   3HG2  THR  53          3HG2      THR  53  80.123  -1.141  -7.304
  437    H    ALA  54           H        ALA  54  78.090  -1.685  -5.707
  438    HA   ALA  54           HA       ALA  54  77.394  -4.545  -5.188
  439   1HB   ALA  54          1HB       ALA  54  75.374  -2.520  -4.454
  440   2HB   ALA  54          2HB       ALA  54  76.843  -2.458  -3.482
  441   3HB   ALA  54          3HB       ALA  54  75.902  -3.947  -3.564
  442    H    ARG  55           H        ARG  55  75.785  -5.370  -6.546
  443    HA   ARG  55           HA       ARG  55  75.026  -3.705  -8.895
  444   1HB   ARG  55          2HB       ARG  55  75.997  -6.076  -8.988
  445   2HB   ARG  55          1HB       ARG  55  74.452  -6.625  -8.337
  446   1HG   ARG  55          2HG       ARG  55  73.303  -5.476 -10.247
  447   2HG   ARG  55          1HG       ARG  55  74.889  -5.114 -10.928
  448   1HD   ARG  55          2HD       ARG  55  75.372  -7.617 -10.850
  449   2HD   ARG  55          1HD       ARG  55  73.651  -7.844 -10.483
  450    HE   ARG  55           HE       ARG  55  74.138  -6.098 -12.781
  451   1HH1  ARG  55          1HH1      ARG  55  73.646  -9.411 -11.727
  452   2HH1  ARG  55          2HH1      ARG  55  73.101  -9.923 -13.285
  453   1HH2  ARG  55          1HH2      ARG  55  73.428  -6.818 -14.770
  454   2HH2  ARG  55          2HH2      ARG  55  72.978  -8.478 -14.986
  455    H    VAL  56           H        VAL  56  72.849  -3.245  -9.342
  456    HA   VAL  56           HA       VAL  56  70.999  -3.236  -7.076
  457    HB   VAL  56           HB       VAL  56  70.764  -2.421  -9.993
  458   1HG1  VAL  56          1HG1      VAL  56  68.660  -2.824  -8.219
  459   2HG1  VAL  56          2HG1      VAL  56  68.623  -1.771  -9.633
  460   3HG1  VAL  56          3HG1      VAL  56  68.998  -1.103  -8.044
  461   1HG2  VAL  56          1HG2      VAL  56  70.902  -0.485  -7.732
  462   2HG2  VAL  56          2HG2      VAL  56  71.555  -0.351  -9.365
  463   3HG2  VAL  56          3HG2      VAL  56  72.391  -1.326  -8.157
  464    H    GLY  57           H        GLY  57  69.601  -4.828  -6.629
  465   1HA   GLY  57          2HA       GLY  57  69.062  -6.917  -8.684
  466   2HA   GLY  57          1HA       GLY  57  68.872  -7.136  -6.945
  467    H    GLU  58           H        GLU  58  66.724  -7.947  -7.707
  468    HA   GLU  58           HA       GLU  58  64.713  -6.276  -8.861
  469   1HB   GLU  58          2HB       GLU  58  64.682  -8.770  -8.578
  470   2HB   GLU  58          1HB       GLU  58  64.421  -8.535  -6.850
  471   1HG   GLU  58          2HG       GLU  58  62.345  -7.273  -7.353
  472   2HG   GLU  58          1HG       GLU  58  62.592  -7.571  -9.070
  473    H    GLN  59           H        GLN  59  63.022  -5.081  -7.842
  474    HA   GLN  59           HA       GLN  59  62.152  -3.536  -6.293
  475   1HB   GLN  59          2HB       GLN  59  63.107  -5.844  -4.593
  476   2HB   GLN  59          1HB       GLN  59  62.218  -4.483  -3.908
  477   1HG   GLN  59          2HG       GLN  59  60.312  -4.914  -5.293
  478   2HG   GLN  59          1HG       GLN  59  61.204  -6.072  -6.273
  479   1HE2  GLN  59          1HE2      GLN  59  59.414  -7.622  -5.644
  480   2HE2  GLN  59          2HE2      GLN  59  59.514  -8.414  -4.146
  481    H    GLY  60           H        GLY  60  65.230  -3.464  -6.947
  482   1HA   GLY  60          2HA       GLY  60  66.818  -1.806  -6.458
  483   2HA   GLY  60          1HA       GLY  60  65.637  -1.110  -5.350
  484    H    SER  61           H        SER  61  66.522  -4.429  -4.820
  485    HA   SER  61           HA       SER  61  67.541  -3.766  -2.168
  486   1HB   SER  61          2HB       SER  61  67.508  -6.149  -1.881
  487   2HB   SER  61          1HB       SER  61  66.131  -5.769  -2.911
  488    HG   SER  61           HG       SER  61  67.068  -7.255  -4.110
  489    H    VAL  62           H        VAL  62  69.676  -4.021  -1.435
  490    HA   VAL  62           HA       VAL  62  71.772  -4.839  -3.385
  491    HB   VAL  62           HB       VAL  62  71.572  -2.380  -3.458
  492   1HG1  VAL  62          1HG1      VAL  62  70.598  -2.012  -1.239
  493   2HG1  VAL  62          2HG1      VAL  62  72.068  -1.055  -1.418
  494   3HG1  VAL  62          3HG1      VAL  62  72.096  -2.546  -0.476
  495   1HG2  VAL  62          1HG2      VAL  62  73.823  -3.519  -3.580
  496   2HG2  VAL  62          2HG2      VAL  62  74.024  -3.170  -1.863
  497   3HG2  VAL  62          3HG2      VAL  62  73.888  -1.848  -3.022
  498    H    ILE  63           H        ILE  63  73.552  -5.871  -2.355
  499    HA   ILE  63           HA       ILE  63  73.061  -6.576   0.514
  500    HB   ILE  63           HB       ILE  63  74.647  -7.982  -1.663
  501   1HG1  ILE  63          2HG1      ILE  63  72.252  -7.901  -2.236
  502   2HG1  ILE  63          1HG1      ILE  63  72.717  -9.538  -1.781
  503   1HG2  ILE  63          1HG2      ILE  63  75.395  -8.612   0.561
  504   2HG2  ILE  63          2HG2      ILE  63  74.448  -9.936  -0.116
  505   3HG2  ILE  63          3HG2      ILE  63  73.732  -8.865   1.087
  506   1HD1  ILE  63          1HD1      ILE  63  71.368  -7.525   0.049
  507   2HD1  ILE  63          2HD1      ILE  63  71.814  -9.175   0.484
  508   3HD1  ILE  63          3HD1      ILE  63  70.571  -8.889  -0.734
  509    H    ILE  64           H        ILE  64  74.481  -5.776   1.990
  510    HA   ILE  64           HA       ILE  64  77.081  -4.604   1.224
  511    HB   ILE  64           HB       ILE  64  75.752  -5.190   3.898
  512   1HG1  ILE  64          2HG1      ILE  64  75.997  -2.551   2.427
  513   2HG1  ILE  64          1HG1      ILE  64  74.573  -3.586   2.312
  514   1HG2  ILE  64          1HG2      ILE  64  77.376  -3.646   4.847
  515   2HG2  ILE  64          2HG2      ILE  64  78.059  -3.329   3.252
  516   3HG2  ILE  64          3HG2      ILE  64  78.243  -4.920   3.990
  517   1HD1  ILE  64          1HD1      ILE  64  74.175  -1.933   4.044
  518   2HD1  ILE  64          2HD1      ILE  64  75.703  -2.332   4.830
  519   3HD1  ILE  64          3HD1      ILE  64  74.387  -3.505   4.815
  520    HA   PRO  65           HA       PRO  65  79.279  -8.458   1.554
  521   1HB   PRO  65          2HB       PRO  65  81.753  -7.560   2.298
  522   2HB   PRO  65          1HB       PRO  65  81.118  -7.359   0.650
  523   1HG   PRO  65          2HG       PRO  65  81.049  -5.418   2.932
  524   2HG   PRO  65          1HG       PRO  65  81.609  -5.153   1.267
  525   1HD   PRO  65          2HD       PRO  65  79.182  -4.372   1.968
  526   2HD   PRO  65          1HD       PRO  65  79.426  -5.189   0.403
  527    H    LYS  66           H        LYS  66  79.426  -9.943   3.204
  528    HA   LYS  66           HA       LYS  66  78.648  -9.424   5.874
  529   1HB   LYS  66          2HB       LYS  66  78.688 -11.623   4.685
  530   2HB   LYS  66          1HB       LYS  66  80.446 -11.635   4.826
  531   1HG   LYS  66          2HG       LYS  66  80.229 -11.511   7.298
  532   2HG   LYS  66          1HG       LYS  66  78.474 -11.576   7.129
  533   1HD   LYS  66          2HD       LYS  66  78.726 -13.762   5.927
  534   2HD   LYS  66          1HD       LYS  66  80.453 -13.710   6.283
  535   1HE   LYS  66          2HE       LYS  66  79.653 -14.974   8.090
  536   2HE   LYS  66          1HE       LYS  66  79.593 -13.336   8.773
  537   1HZ   LYS  66          1HZ       LYS  66  77.311 -13.134   7.974
  538   2HZ   LYS  66          2HZ       LYS  66  77.463 -14.441   9.050
  539   3HZ   LYS  66          3HZ       LYS  66  77.364 -14.721   7.377
  540    H    ALA  67           H        ALA  67  81.866  -9.427   4.417
  541    HA   ALA  67           HA       ALA  67  83.478  -9.441   6.762
  542   1HB   ALA  67          1HB       ALA  67  83.922  -9.438   4.116
  543   2HB   ALA  67          2HB       ALA  67  85.174  -8.957   5.262
  544   3HB   ALA  67          3HB       ALA  67  84.224  -7.728   4.427
  545    H    LEU  68           H        LEU  68  81.870  -6.752   5.084
  546    HA   LEU  68           HA       LEU  68  82.989  -4.703   6.839
  547   1HB   LEU  68          2HB       LEU  68  80.750  -4.768   4.797
  548   2HB   LEU  68          1HB       LEU  68  81.248  -3.299   5.633
  549    HG   LEU  68           HG       LEU  68  83.043  -5.036   3.902
  550   1HD1  LEU  68          1HD1      LEU  68  81.159  -3.407   2.944
  551   2HD1  LEU  68          2HD1      LEU  68  82.752  -3.504   2.194
  552   3HD1  LEU  68          3HD1      LEU  68  82.379  -2.183   3.301
  553   1HD2  LEU  68          1HD2      LEU  68  83.516  -2.569   5.580
  554   2HD2  LEU  68          2HD2      LEU  68  84.516  -2.899   4.165
  555   3HD2  LEU  68          3HD2      LEU  68  84.475  -4.048   5.502
  556    H    ARG  69           H        ARG  69  79.992  -6.624   6.757
  557    HA   ARG  69           HA       ARG  69  78.434  -5.165   8.659
  558   1HB   ARG  69          2HB       ARG  69  78.708  -8.177   8.327
  559   2HB   ARG  69          1HB       ARG  69  77.335  -7.338   9.036
  560   1HG   ARG  69          2HG       ARG  69  77.020  -6.185   6.794
  561   2HG   ARG  69          1HG       ARG  69  78.221  -7.306   6.144
  562   1HD   ARG  69          2HD       ARG  69  76.687  -9.110   7.382
  563   2HD   ARG  69          1HD       ARG  69  75.446  -7.873   7.116
  564    HE   ARG  69           HE       ARG  69  76.636  -7.974   4.666
  565   1HH1  ARG  69          1HH1      ARG  69  75.441 -10.521   6.772
  566   2HH1  ARG  69          2HH1      ARG  69  75.133 -11.591   5.453
  567   1HH2  ARG  69          1HH2      ARG  69  76.206  -9.404   3.009
  568   2HH2  ARG  69          2HH2      ARG  69  75.556 -10.971   3.352
  569    H    ASP  70           H        ASP  70  80.811  -7.774   9.118
  570    HA   ASP  70           HA       ASP  70  80.523  -7.948  11.973
  571   1HB   ASP  70          2HB       ASP  70  82.761  -8.749  10.083
  572   2HB   ASP  70          1HB       ASP  70  82.625  -9.295  11.753
  573    H    VAL  71           H        VAL  71  83.007  -6.364   9.937
  574    HA   VAL  71           HA       VAL  71  84.654  -5.387  12.055
  575    HB   VAL  71           HB       VAL  71  84.047  -4.323   9.271
  576   1HG1  VAL  71          1HG1      VAL  71  85.114  -2.582  10.642
  577   2HG1  VAL  71          2HG1      VAL  71  86.241  -3.189   9.428
  578   3HG1  VAL  71          3HG1      VAL  71  86.386  -3.712  11.106
  579   1HG2  VAL  71          1HG2      VAL  71  86.350  -6.019  10.276
  580   2HG2  VAL  71          2HG2      VAL  71  86.007  -5.586   8.602
  581   3HG2  VAL  71          3HG2      VAL  71  84.924  -6.672   9.472
  582    H    ILE  72           H        ILE  72  81.795  -3.986  10.499
  583    HA   ILE  72           HA       ILE  72  81.983  -1.469  11.970
  584    HB   ILE  72           HB       ILE  72  79.811  -2.690  10.225
  585   1HG1  ILE  72          2HG1      ILE  72  81.982  -0.679   9.540
  586   2HG1  ILE  72          1HG1      ILE  72  82.061  -2.396   9.143
  587   1HG2  ILE  72          1HG2      ILE  72  78.784  -0.586  10.150
  588   2HG2  ILE  72          2HG2      ILE  72  80.242   0.254  10.671
  589   3HG2  ILE  72          3HG2      ILE  72  79.295  -0.670  11.834
  590   1HD1  ILE  72          1HD1      ILE  72  79.698  -1.954   8.061
  591   2HD1  ILE  72          2HD1      ILE  72  81.166  -1.523   7.179
  592   3HD1  ILE  72          3HD1      ILE  72  80.254  -0.276   8.031
  593    H    GLY  73           H        GLY  73  80.548  -4.585  12.617
  594   1HA   GLY  73          2HA       GLY  73  79.518  -5.310  14.604
  595   2HA   GLY  73          1HA       GLY  73  79.707  -3.675  15.237
  596    H    ILE  74           H        ILE  74  78.038  -4.500  12.234
  597    HA   ILE  74           HA       ILE  74  75.691  -2.987  13.193
  598    HB   ILE  74           HB       ILE  74  76.355  -4.231  10.505
  599   1HG1  ILE  74          2HG1      ILE  74  78.065  -2.593  11.181
  600   2HG1  ILE  74          1HG1      ILE  74  77.082  -1.943   9.872
  601   1HG2  ILE  74          1HG2      ILE  74  74.239  -2.310  11.457
  602   2HG2  ILE  74          2HG2      ILE  74  74.048  -3.766  10.479
  603   3HG2  ILE  74          3HG2      ILE  74  74.766  -2.317   9.775
  604   1HD1  ILE  74          1HD1      ILE  74  77.196  -0.148  11.391
  605   2HD1  ILE  74          2HD1      ILE  74  77.059  -1.205  12.795
  606   3HD1  ILE  74          3HD1      ILE  74  75.647  -0.896  11.785
  607    H    LYS  75           H        LYS  75  73.625  -3.836  13.439
  608    HA   LYS  75           HA       LYS  75  73.236  -6.769  12.954
  609   1HB   LYS  75          2HB       LYS  75  72.108  -6.874  15.150
  610   2HB   LYS  75          1HB       LYS  75  73.773  -6.324  15.320
  611   1HG   LYS  75          2HG       LYS  75  72.289  -3.971  14.918
  612   2HG   LYS  75          1HG       LYS  75  71.293  -4.943  15.996
  613   1HD   LYS  75          2HD       LYS  75  74.230  -4.342  16.454
  614   2HD   LYS  75          1HD       LYS  75  72.900  -3.484  17.231
  615   1HE   LYS  75          2HE       LYS  75  72.096  -5.806  18.032
  616   2HE   LYS  75          1HE       LYS  75  73.716  -6.375  17.582
  617   1HZ   LYS  75          1HZ       LYS  75  73.205  -4.005  19.297
  618   2HZ   LYS  75          2HZ       LYS  75  74.709  -4.720  18.960
  619   3HZ   LYS  75          3HZ       LYS  75  73.564  -5.546  19.906
  620    HA   PRO  76           HA       PRO  76  69.354  -5.880  11.037
  621   1HB   PRO  76          2HB       PRO  76  67.942  -7.516  13.074
  622   2HB   PRO  76          1HB       PRO  76  67.956  -7.679  11.309
  623   1HG   PRO  76          2HG       PRO  76  69.302  -9.340  12.952
  624   2HG   PRO  76          1HG       PRO  76  69.829  -8.962  11.307
  625   1HD   PRO  76          2HD       PRO  76  70.982  -8.111  13.880
  626   2HD   PRO  76          1HD       PRO  76  71.736  -8.228  12.279
  627    H    GLY  77           H        GLY  77  67.946  -4.172  11.246
  628   1HA   GLY  77          2HA       GLY  77  66.259  -2.871  12.311
  629   2HA   GLY  77          1HA       GLY  77  66.730  -3.566  13.858
  630    H    GLU  78           H        GLU  78  69.597  -2.595  12.471
  631    HA   GLU  78           HA       GLU  78  69.586  -0.079  14.057
  632   1HB   GLU  78          2HB       GLU  78  71.555  -2.103  13.129
  633   2HB   GLU  78          1HB       GLU  78  72.149  -0.448  13.266
  634   1HG   GLU  78          2HG       GLU  78  71.178  -0.368  15.589
  635   2HG   GLU  78          1HG       GLU  78  70.814  -2.086  15.440
  636    H    VAL  79           H        VAL  79  69.598   1.883  13.091
  637    HA   VAL  79           HA       VAL  79  69.384   1.970  10.155
  638    HB   VAL  79           HB       VAL  79  67.746   3.024  11.675
  639   1HG1  VAL  79          1HG1      VAL  79  68.341   4.324  13.423
  640   2HG1  VAL  79          2HG1      VAL  79  69.386   5.328  12.419
  641   3HG1  VAL  79          3HG1      VAL  79  70.005   3.832  13.114
  642   1HG2  VAL  79          1HG2      VAL  79  69.299   4.542   9.649
  643   2HG2  VAL  79          2HG2      VAL  79  68.237   5.500  10.680
  644   3HG2  VAL  79          3HG2      VAL  79  67.574   4.184   9.711
  645    H    ILE  80           H        ILE  80  70.868   2.822   8.805
  646    HA   ILE  80           HA       ILE  80  73.177   4.362   9.925
  647    HB   ILE  80           HB       ILE  80  74.559   3.192   8.215
  648   1HG1  ILE  80          2HG1      ILE  80  72.043   1.583   7.668
  649   2HG1  ILE  80          1HG1      ILE  80  72.683   2.837   6.603
  650   1HG2  ILE  80          1HG2      ILE  80  73.750   2.208  10.600
  651   2HG2  ILE  80          2HG2      ILE  80  74.871   1.349   9.542
  652   3HG2  ILE  80          3HG2      ILE  80  73.157   0.927   9.541
  653   1HD1  ILE  80          1HD1      ILE  80  73.334   0.316   6.188
  654   2HD1  ILE  80          2HD1      ILE  80  74.487   0.606   7.491
  655   3HD1  ILE  80          3HD1      ILE  80  74.555   1.576   6.019
  656    H    GLU  81           H        GLU  81  74.089   5.891   8.351
  657    HA   GLU  81           HA       GLU  81  72.100   6.925   6.383
  658   1HB   GLU  81          2HB       GLU  81  73.058   8.439   8.118
  659   2HB   GLU  81          1HB       GLU  81  74.674   8.097   7.500
  660   1HG   GLU  81          2HG       GLU  81  73.974   8.978   5.275
  661   2HG   GLU  81          1HG       GLU  81  72.408   9.396   5.958
  662    H    VAL  82           H        VAL  82  72.509   6.638   4.240
  663    HA   VAL  82           HA       VAL  82  75.073   5.300   3.497
  664    HB   VAL  82           HB       VAL  82  72.252   5.158   2.374
  665   1HG1  VAL  82          1HG1      VAL  82  73.209   3.139   1.166
  666   2HG1  VAL  82          2HG1      VAL  82  74.809   3.720   1.628
  667   3HG1  VAL  82          3HG1      VAL  82  73.781   4.703   0.584
  668   1HG2  VAL  82          1HG2      VAL  82  73.873   3.458   4.257
  669   2HG2  VAL  82          2HG2      VAL  82  72.606   2.727   3.272
  670   3HG2  VAL  82          3HG2      VAL  82  72.204   4.004   4.421
  671    H    LEU  83           H        LEU  83  76.338   6.280   2.019
  672    HA   LEU  83           HA       LEU  83  75.239   8.562   0.405
  673   1HB   LEU  83          2HB       LEU  83  78.122   7.980   1.187
  674   2HB   LEU  83          1HB       LEU  83  77.489   9.479   0.521
  675    HG   LEU  83           HG       LEU  83  76.784   8.329   3.238
  676   1HD1  LEU  83          1HD1      LEU  83  79.121   9.241   2.951
  677   2HD1  LEU  83          2HD1      LEU  83  78.146  10.095   4.150
  678   3HD1  LEU  83          3HD1      LEU  83  78.394  10.800   2.553
  679   1HD2  LEU  83          1HD2      LEU  83  74.933   9.592   2.296
  680   2HD2  LEU  83          2HD2      LEU  83  76.013  10.912   1.847
  681   3HD2  LEU  83          3HD2      LEU  83  75.702  10.567   3.549
  682    H    LEU  84           H        LEU  84  75.298   8.222  -1.820
  683    HA   LEU  84           HA       LEU  84  76.630   5.839  -2.948
  684   1HB   LEU  84          2HB       LEU  84  74.842   8.051  -3.889
  685   2HB   LEU  84          1HB       LEU  84  75.788   7.160  -5.087
  686    HG   LEU  84           HG       LEU  84  74.330   5.573  -3.023
  687   1HD1  LEU  84          1HD1      LEU  84  72.285   6.328  -3.582
  688   2HD1  LEU  84          2HD1      LEU  84  72.577   5.852  -5.253
  689   3HD1  LEU  84          3HD1      LEU  84  72.985   7.479  -4.715
  690   1HD2  LEU  84          1HD2      LEU  84  73.959   4.355  -5.408
  691   2HD2  LEU  84          2HD2      LEU  84  75.420   4.136  -4.447
  692   3HD2  LEU  84          3HD2      LEU  84  75.409   5.286  -5.785
  693    H    LEU  85           H        LEU  85  78.574   5.885  -4.042
  694    HA   LEU  85           HA       LEU  85  80.130   8.420  -3.877
  695   1HB   LEU  85          2HB       LEU  85  80.654   5.489  -3.704
  696   2HB   LEU  85          1HB       LEU  85  81.957   6.505  -4.326
  697    HG   LEU  85           HG       LEU  85  80.486   7.232  -1.796
  698   1HD1  LEU  85          1HD1      LEU  85  81.375   4.925  -1.546
  699   2HD1  LEU  85          2HD1      LEU  85  82.240   6.075  -0.525
  700   3HD1  LEU  85          3HD1      LEU  85  82.971   5.505  -2.025
  701   1HD2  LEU  85          1HD2      LEU  85  82.649   8.393  -1.346
  702   2HD2  LEU  85          2HD2      LEU  85  81.886   8.958  -2.832
  703   3HD2  LEU  85          3HD2      LEU  85  83.245   7.837  -2.910
  704    H    GLY  86           H        GLY  86  79.205   5.829  -6.138
  705   1HA   GLY  86          2HA       GLY  86  79.625   7.570  -8.450
  706   2HA   GLY  86          1HA       GLY  86  80.897   6.366  -8.295
  707    H    HIS  87           H        HIS  87  79.746   5.942 -10.533
  708    HA   HIS  87           HA       HIS  87  77.791   3.716 -10.117
  709   1HB   HIS  87          2HB       HIS  87  76.418   4.689 -11.952
  710   2HB   HIS  87          1HB       HIS  87  76.552   5.795 -10.591
  711    HD1  HIS  87           HD1      HIS  87  77.750   5.295 -14.124
  712    HD2  HIS  87           HD2      HIS  87  78.004   8.173 -11.119
  713    HE1  HIS  87           HE1      HIS  87  78.719   7.371 -15.202
  714    H    TYR  88           H        TYR  88  77.812   2.137 -11.840
  715    HA   TYR  88           HA       TYR  88  79.861   2.516 -13.981
  716   1HB   TYR  88          2HB       TYR  88  79.494   0.152 -12.115
  717   2HB   TYR  88          1HB       TYR  88  80.514   0.115 -13.553
  718    HD1  TYR  88           HD1      TYR  88  80.115   1.471 -10.122
  719    HD2  TYR  88           HD2      TYR  88  82.596   1.461 -13.703
  720    HE1  TYR  88           HE1      TYR  88  81.986   2.547  -8.830
  721    HE2  TYR  88           HE2      TYR  88  84.467   2.536 -12.410
  722    HH   TYR  88           HH       TYR  88  84.744   3.919 -10.354
  723    H    LYS  89           H        LYS  89  79.169   1.738 -15.970
  724    HA   LYS  89           HA       LYS  89  76.407   0.623 -16.095
  725   1HB   LYS  89          2HB       LYS  89  77.560   2.725 -17.337
  726   2HB   LYS  89          1HB       LYS  89  77.927   1.463 -18.514
  727   1HG   LYS  89          2HG       LYS  89  75.149   1.598 -17.415
  728   2HG   LYS  89          1HG       LYS  89  75.628   2.799 -18.615
  729   1HD   LYS  89          2HD       LYS  89  76.322  -0.048 -19.178
  730   2HD   LYS  89          1HD       LYS  89  74.626   0.417 -19.326
  731   1HE   LYS  89          2HE       LYS  89  76.669   2.216 -20.580
  732   2HE   LYS  89          1HE       LYS  89  76.284   0.687 -21.396
  733   1HZ   LYS  89          1HZ       LYS  89  74.239   2.593 -20.393
  734   2HZ   LYS  89          2HZ       LYS  89  73.970   1.208 -21.339
  735   3HZ   LYS  89          3HZ       LYS  89  74.773   2.551 -22.002
  736    HA   PRO  90           HA       PRO  90  78.079  -3.442 -17.049
  737   1HB   PRO  90          2HB       PRO  90  75.541  -3.620 -18.644
  738   2HB   PRO  90          1HB       PRO  90  76.209  -4.768 -17.461
  739   1HG   PRO  90          2HG       PRO  90  74.208  -3.261 -16.739
  740   2HG   PRO  90          1HG       PRO  90  75.592  -3.432 -15.641
  741   1HD   PRO  90          2HD       PRO  90  74.929  -1.158 -17.485
  742   2HD   PRO  90          1HD       PRO  90  75.462  -1.111 -15.786
  743    H    ARG  91           H        ARG  91  79.088  -4.430 -18.878
  744    HA   ARG  91           HA       ARG  91  78.990  -2.847 -21.429
  745   1HB   ARG  91          2HB       ARG  91  81.079  -2.664 -20.069
  746   2HB   ARG  91          1HB       ARG  91  81.280  -4.412 -20.195
  747   1HG   ARG  91          2HG       ARG  91  81.304  -4.190 -22.683
  748   2HG   ARG  91          1HG       ARG  91  81.237  -2.438 -22.495
  749   1HD   ARG  91          2HD       ARG  91  83.427  -4.221 -21.365
  750   2HD   ARG  91          1HD       ARG  91  83.578  -3.199 -22.808
  751    HE   ARG  91           HE       ARG  91  82.668  -1.414 -20.942
  752   1HH1  ARG  91          1HH1      ARG  91  85.302  -3.735 -20.873
  753   2HH1  ARG  91          2HH1      ARG  91  86.235  -2.780 -19.775
  754   1HH2  ARG  91          1HH2      ARG  91  83.919  -0.227 -19.528
  755   2HH2  ARG  91          2HH2      ARG  91  85.466  -0.821 -19.022
  756    H    ASN  92           H        ASN  92  78.762  -4.033 -23.332
  757    HA   ASN  92           HA       ASN  92  79.006  -6.985 -23.300
  758   1HB   ASN  92          2HB       ASN  92  76.694  -6.187 -22.472
  759   2HB   ASN  92          1HB       ASN  92  76.419  -5.658 -24.131
  760   1HD2  ASN  92          1HD2      ASN  92  74.693  -7.343 -24.277
  761   2HD2  ASN  92          2HD2      ASN  92  75.120  -8.967 -24.519
  Start of MODEL   21
    1   1H    MET   1          1H        MET   1  82.585  12.871   1.055
    2   2H    MET   1          2H        MET   1  82.673  14.568   1.060
    3   3H    MET   1          3H        MET   1  84.069  13.641   1.336
    4    HA   MET   1           HA       MET   1  84.206  14.418  -0.898
    5   1HB   MET   1          2HB       MET   1  83.369  11.547  -0.458
    6   2HB   MET   1          1HB       MET   1  83.983  12.107  -2.014
    7   1HG   MET   1          2HG       MET   1  86.021  12.959  -0.853
    8   2HG   MET   1          1HG       MET   1  85.424  12.247   0.647
    9   1HE   MET   1          1HE       MET   1  86.125  11.983  -2.848
   10   2HE   MET   1          2HE       MET   1  85.649  10.337  -3.256
   11   3HE   MET   1          3HE       MET   1  87.347  10.709  -2.968
   12    H    ASP   2           H        ASP   2  83.085  13.482  -3.154
   13    HA   ASP   2           HA       ASP   2  80.550  14.910  -3.354
   14   1HB   ASP   2          2HB       ASP   2  82.097  13.105  -5.245
   15   2HB   ASP   2          1HB       ASP   2  80.710  14.086  -5.720
   16    H    VAL   3           H        VAL   3  78.476  14.019  -3.511
   17    HA   VAL   3           HA       VAL   3  78.242  11.053  -3.311
   18    HB   VAL   3           HB       VAL   3  77.934  12.490  -1.183
   19   1HG1  VAL   3          1HG1      VAL   3  75.207  13.029  -2.371
   20   2HG1  VAL   3          2HG1      VAL   3  76.501  14.232  -2.357
   21   3HG1  VAL   3          3HG1      VAL   3  75.851  13.620  -0.835
   22   1HG2  VAL   3          1HG2      VAL   3  77.229  10.188  -1.221
   23   2HG2  VAL   3          2HG2      VAL   3  75.790  10.590  -2.157
   24   3HG2  VAL   3          3HG2      VAL   3  75.929  11.126  -0.482
   25    H    LEU   4           H        LEU   4  76.740  10.177  -4.714
   26    HA   LEU   4           HA       LEU   4  75.440  11.971  -6.664
   27   1HB   LEU   4          2HB       LEU   4  75.359   8.949  -6.410
   28   2HB   LEU   4          1HB       LEU   4  74.995   9.892  -7.848
   29    HG   LEU   4           HG       LEU   4  77.703   9.580  -6.505
   30   1HD1  LEU   4          1HD1      LEU   4  77.323   7.690  -7.851
   31   2HD1  LEU   4          2HD1      LEU   4  78.221   8.775  -8.914
   32   3HD1  LEU   4          3HD1      LEU   4  76.472   8.624  -9.083
   33   1HD2  LEU   4          1HD2      LEU   4  77.839  11.794  -7.251
   34   2HD2  LEU   4          2HD2      LEU   4  76.730  11.513  -8.598
   35   3HD2  LEU   4          3HD2      LEU   4  78.385  10.911  -8.681
   36    H    ALA   5           H        ALA   5  74.594  10.302  -3.734
   37    HA   ALA   5           HA       ALA   5  72.011  11.535  -3.593
   38   1HB   ALA   5          1HB       ALA   5  70.589   9.878  -4.335
   39   2HB   ALA   5          2HB       ALA   5  71.648   8.587  -3.767
   40   3HB   ALA   5          3HB       ALA   5  71.993   9.404  -5.291
   41    H    LYS   6           H        LYS   6  71.092  11.178  -1.477
   42    HA   LYS   6           HA       LYS   6  72.707   9.440   0.358
   43   1HB   LYS   6          2HB       LYS   6  73.462  11.790   0.421
   44   2HB   LYS   6          1HB       LYS   6  71.815  12.314   0.762
   45   1HG   LYS   6          2HG       LYS   6  71.825  11.362   2.916
   46   2HG   LYS   6          1HG       LYS   6  73.181  10.301   2.540
   47   1HD   LYS   6          2HD       LYS   6  73.955  12.130   3.965
   48   2HD   LYS   6          1HD       LYS   6  74.655  12.305   2.356
   49   1HE   LYS   6          2HE       LYS   6  73.530  14.249   1.946
   50   2HE   LYS   6          1HE       LYS   6  72.045  13.662   2.724
   51   1HZ   LYS   6          1HZ       LYS   6  73.084  13.927   4.876
   52   2HZ   LYS   6          2HZ       LYS   6  73.127  15.407   4.042
   53   3HZ   LYS   6          3HZ       LYS   6  74.527  14.452   4.156
   54    H    PHE   7           H        PHE   7  71.408   8.140   1.562
   55    HA   PHE   7           HA       PHE   7  68.675   9.032   2.323
   56   1HB   PHE   7          2HB       PHE   7  67.693   7.031   1.258
   57   2HB   PHE   7          1HB       PHE   7  68.535   8.024   0.072
   58    HD1  PHE   7           HD1      PHE   7  68.204   4.721   1.472
   59    HD2  PHE   7           HD2      PHE   7  71.049   7.397  -0.456
   60    HE1  PHE   7           HE1      PHE   7  69.628   2.749   0.829
   61    HE2  PHE   7           HE2      PHE   7  72.474   5.424  -1.091
   62    HZ   PHE   7           HZ       PHE   7  71.763   3.097  -0.443
   63    H    HIS   8           H        HIS   8  67.674   7.491   3.897
   64    HA   HIS   8           HA       HIS   8  69.790   6.181   5.582
   65   1HB   HIS   8          2HB       HIS   8  67.085   7.413   6.225
   66   2HB   HIS   8          1HB       HIS   8  68.171   6.699   7.416
   67    HD1  HIS   8           HD1      HIS   8  67.487   9.663   7.690
   68    HD2  HIS   8           HD2      HIS   8  70.766   8.288   5.513
   69    HE1  HIS   8           HE1      HIS   8  69.124  11.592   7.564
   70    H    THR   9           H        THR   9  69.521   4.044   6.140
   71    HA   THR   9           HA       THR   9  66.889   2.725   5.885
   72    HB   THR   9           HB       THR   9  68.004   2.667   3.624
   73    HG1  THR   9           HG1      THR   9  66.939   0.893   3.493
   74   1HG2  THR   9          1HG2      THR   9  70.345   2.554   4.358
   75   2HG2  THR   9          2HG2      THR   9  69.958   1.170   3.334
   76   3HG2  THR   9          3HG2      THR   9  70.050   0.974   5.086
   77    H    THR  10           H        THR  10  66.983   0.496   6.897
   78    HA   THR  10           HA       THR  10  69.211   0.339   8.888
   79    HB   THR  10           HB       THR  10  66.788   0.721   9.647
   80    HG1  THR  10           HG1      THR  10  67.520  -0.093  11.399
   81   1HG2  THR  10          1HG2      THR  10  66.211  -1.424   7.991
   82   2HG2  THR  10          2HG2      THR  10  65.148  -0.785   9.246
   83   3HG2  THR  10          3HG2      THR  10  66.218  -2.146   9.603
   84    H    VAL  11           H        VAL  11  69.959  -1.849   9.433
   85    HA   VAL  11           HA       VAL  11  70.379  -3.439   7.024
   86    HB   VAL  11           HB       VAL  11  71.151  -3.887   9.930
   87   1HG1  VAL  11          1HG1      VAL  11  71.802  -5.283   7.366
   88   2HG1  VAL  11          2HG1      VAL  11  71.613  -5.948   8.989
   89   3HG1  VAL  11          3HG1      VAL  11  73.096  -5.099   8.551
   90   1HG2  VAL  11          1HG2      VAL  11  73.406  -3.084   8.521
   91   2HG2  VAL  11          2HG2      VAL  11  72.438  -2.051   9.569
   92   3HG2  VAL  11          3HG2      VAL  11  72.136  -2.073   7.832
   93    H    HIS  12           H        HIS  12  69.397  -5.329   6.468
   94    HA   HIS  12           HA       HIS  12  67.465  -6.565   8.399
   95   1HB   HIS  12          2HB       HIS  12  67.421  -6.068   5.443
   96   2HB   HIS  12          1HB       HIS  12  66.572  -7.482   6.077
   97    HD1  HIS  12           HD1      HIS  12  66.844  -3.791   7.066
   98    HD2  HIS  12           HD2      HIS  12  63.991  -6.814   6.753
   99    HE1  HIS  12           HE1      HIS  12  64.634  -2.765   7.754
  100    H    ARG  13           H        ARG  13  67.179  -8.972   7.856
  101    HA   ARG  13           HA       ARG  13  69.421 -10.460   8.477
  102   1HB   ARG  13          2HB       ARG  13  66.995 -11.109   6.795
  103   2HB   ARG  13          1HB       ARG  13  68.113 -12.354   7.364
  104   1HG   ARG  13          2HG       ARG  13  66.712 -10.380   9.191
  105   2HG   ARG  13          1HG       ARG  13  66.114 -12.006   8.863
  106   1HD   ARG  13          2HD       ARG  13  68.313 -12.918   9.686
  107   2HD   ARG  13          1HD       ARG  13  68.756 -11.271  10.172
  108    HE   ARG  13           HE       ARG  13  66.281 -11.543  11.306
  109   1HH1  ARG  13          1HH1      ARG  13  69.125 -13.601  11.378
  110   2HH1  ARG  13          2HH1      ARG  13  68.733 -14.244  12.934
  111   1HH2  ARG  13          1HH2      ARG  13  65.829 -12.409  13.311
  112   2HH2  ARG  13          2HH2      ARG  13  66.893 -13.579  14.015
  113    H    ILE  14           H        ILE  14  70.924 -11.755   7.306
  114    HA   ILE  14           HA       ILE  14  72.483 -12.245   5.619
  115    HB   ILE  14           HB       ILE  14  70.334 -11.201   3.744
  116   1HG1  ILE  14          2HG1      ILE  14  70.819 -14.075   4.568
  117   2HG1  ILE  14          1HG1      ILE  14  69.620 -13.054   5.366
  118   1HG2  ILE  14          1HG2      ILE  14  72.162 -11.478   2.374
  119   2HG2  ILE  14          2HG2      ILE  14  71.564 -13.137   2.381
  120   3HG2  ILE  14          3HG2      ILE  14  72.905 -12.678   3.431
  121   1HD1  ILE  14          1HD1      ILE  14  68.284 -13.974   3.723
  122   2HD1  ILE  14          2HD1      ILE  14  69.623 -14.157   2.589
  123   3HD1  ILE  14          3HD1      ILE  14  68.892 -12.570   2.844
  124    H    GLY  15           H        GLY  15  71.737  -9.156   6.522
  125   1HA   GLY  15          2HA       GLY  15  73.042  -7.208   6.318
  126   2HA   GLY  15          1HA       GLY  15  74.079  -8.071   5.186
  127    H    ARG  16           H        ARG  16  70.711  -8.199   4.410
  128    HA   ARG  16           HA       ARG  16  71.213  -6.665   1.960
  129   1HB   ARG  16          2HB       ARG  16  69.977  -8.815   2.047
  130   2HB   ARG  16          1HB       ARG  16  68.753  -8.064   3.070
  131   1HG   ARG  16          2HG       ARG  16  68.295  -6.416   1.253
  132   2HG   ARG  16          1HG       ARG  16  69.441  -7.275   0.224
  133   1HD   ARG  16          2HD       ARG  16  67.036  -8.619   1.501
  134   2HD   ARG  16          1HD       ARG  16  67.031  -7.961  -0.147
  135    HE   ARG  16           HE       ARG  16  69.301  -9.727   0.415
  136   1HH1  ARG  16          1HH1      ARG  16  65.990  -9.559  -0.739
  137   2HH1  ARG  16          2HH1      ARG  16  66.129 -11.034  -1.629
  138   1HH2  ARG  16          1HH2      ARG  16  69.418 -11.624  -0.752
  139   2HH2  ARG  16          2HH2      ARG  16  68.042 -12.189  -1.638
  140    H    ILE  17           H        ILE  17  70.249  -4.691   1.432
  141    HA   ILE  17           HA       ILE  17  68.357  -3.476   3.395
  142    HB   ILE  17           HB       ILE  17  69.539  -1.313   3.119
  143   1HG1  ILE  17          2HG1      ILE  17  71.686  -2.863   1.642
  144   2HG1  ILE  17          1HG1      ILE  17  70.440  -1.936   0.809
  145   1HG2  ILE  17          1HG2      ILE  17  70.230  -2.631   5.005
  146   2HG2  ILE  17          2HG2      ILE  17  71.697  -1.992   4.264
  147   3HG2  ILE  17          3HG2      ILE  17  71.229  -3.670   3.989
  148   1HD1  ILE  17          1HD1      ILE  17  72.843  -0.901   1.623
  149   2HD1  ILE  17          2HD1      ILE  17  71.801  -0.461   2.976
  150   3HD1  ILE  17          3HD1      ILE  17  71.392   0.062   1.340
  151    H    ILE  18           H        ILE  18  66.856  -1.966   2.368
  152    HA   ILE  18           HA       ILE  18  66.765  -2.206  -0.626
  153    HB   ILE  18           HB       ILE  18  64.491  -1.818   1.350
  154   1HG1  ILE  18          2HG1      ILE  18  65.464  -4.063   1.598
  155   2HG1  ILE  18          1HG1      ILE  18  63.895  -4.171   0.805
  156   1HG2  ILE  18          1HG2      ILE  18  64.675  -2.063  -1.641
  157   2HG2  ILE  18          2HG2      ILE  18  63.722  -0.935  -0.671
  158   3HG2  ILE  18          3HG2      ILE  18  63.226  -2.625  -0.804
  159   1HD1  ILE  18          1HD1      ILE  18  65.482  -3.925  -1.373
  160   2HD1  ILE  18          2HD1      ILE  18  65.066  -5.486  -0.663
  161   3HD1  ILE  18          3HD1      ILE  18  66.609  -4.723  -0.275
  162    H    ILE  19           H        ILE  19  66.928  -0.289  -1.702
  163    HA   ILE  19           HA       ILE  19  66.994   2.263  -0.226
  164    HB   ILE  19           HB       ILE  19  67.123   1.588  -3.201
  165   1HG1  ILE  19          2HG1      ILE  19  69.257   1.984  -1.061
  166   2HG1  ILE  19          1HG1      ILE  19  68.939   0.515  -1.971
  167   1HG2  ILE  19          1HG2      ILE  19  66.476   3.967  -2.549
  168   2HG2  ILE  19          2HG2      ILE  19  67.957   3.837  -3.498
  169   3HG2  ILE  19          3HG2      ILE  19  68.047   4.101  -1.756
  170   1HD1  ILE  19          1HD1      ILE  19  70.624   2.759  -2.661
  171   2HD1  ILE  19          2HD1      ILE  19  69.396   2.514  -3.905
  172   3HD1  ILE  19          3HD1      ILE  19  70.480   1.195  -3.464
  173    HA   PRO  20           HA       PRO  20  62.652   3.178  -0.857
  174   1HB   PRO  20          2HB       PRO  20  62.796   5.910  -1.002
  175   2HB   PRO  20          1HB       PRO  20  62.901   5.027   0.533
  176   1HG   PRO  20          2HG       PRO  20  65.130   6.021  -1.213
  177   2HG   PRO  20          1HG       PRO  20  64.906   6.245   0.534
  178   1HD   PRO  20          2HD       PRO  20  66.547   4.364  -0.329
  179   2HD   PRO  20          1HD       PRO  20  65.424   3.999   1.008
  180    H    ALA  21           H        ALA  21  61.407   3.503  -2.707
  181    HA   ALA  21           HA       ALA  21  62.582   3.342  -5.276
  182   1HB   ALA  21          1HB       ALA  21  60.215   2.792  -4.498
  183   2HB   ALA  21          2HB       ALA  21  60.320   3.605  -6.060
  184   3HB   ALA  21          3HB       ALA  21  59.863   4.515  -4.619
  185    H    GLY  22           H        GLY  22  61.817   6.153  -3.301
  186   1HA   GLY  22          2HA       GLY  22  61.785   8.132  -5.379
  187   2HA   GLY  22          1HA       GLY  22  62.131   8.453  -3.679
  188    H    THR  23           H        THR  23  64.432   6.922  -3.316
  189    HA   THR  23           HA       THR  23  66.461   8.650  -4.443
  190    HB   THR  23           HB       THR  23  66.682   5.949  -3.068
  191    HG1  THR  23           HG1      THR  23  66.717   8.585  -2.019
  192   1HG2  THR  23          1HG2      THR  23  68.860   7.380  -2.311
  193   2HG2  THR  23          2HG2      THR  23  68.630   8.009  -3.944
  194   3HG2  THR  23          3HG2      THR  23  68.856   6.278  -3.687
  195    H    ARG  24           H        ARG  24  65.326   5.364  -5.228
  196    HA   ARG  24           HA       ARG  24  67.329   4.599  -7.110
  197   1HB   ARG  24          2HB       ARG  24  64.360   4.069  -7.418
  198   2HB   ARG  24          1HB       ARG  24  65.690   3.051  -7.953
  199   1HG   ARG  24          2HG       ARG  24  66.272   3.042  -5.358
  200   2HG   ARG  24          1HG       ARG  24  64.556   3.401  -5.217
  201   1HD   ARG  24          2HD       ARG  24  64.362   1.409  -6.987
  202   2HD   ARG  24          1HD       ARG  24  65.886   0.931  -6.208
  203    HE   ARG  24           HE       ARG  24  64.358   1.537  -4.047
  204   1HH1  ARG  24          1HH1      ARG  24  63.648  -0.430  -6.865
  205   2HH1  ARG  24          2HH1      ARG  24  62.542  -1.432  -5.996
  206   1HH2  ARG  24          1HH2      ARG  24  62.948   0.203  -2.981
  207   2HH2  ARG  24          2HH2      ARG  24  62.152  -1.087  -3.820
  208    H    LYS  25           H        LYS  25  64.360   6.514  -7.537
  209    HA   LYS  25           HA       LYS  25  64.526   6.788 -10.389
  210   1HB   LYS  25          2HB       LYS  25  62.498   7.164  -9.042
  211   2HB   LYS  25          1HB       LYS  25  63.265   8.535  -8.243
  212   1HG   LYS  25          2HG       LYS  25  61.767   9.328 -10.020
  213   2HG   LYS  25          1HG       LYS  25  63.442   9.692 -10.436
  214   1HD   LYS  25          2HD       LYS  25  63.551   7.737 -11.878
  215   2HD   LYS  25          1HD       LYS  25  61.917   7.263 -11.412
  216   1HE   LYS  25          2HE       LYS  25  61.393   9.775 -12.248
  217   2HE   LYS  25          1HE       LYS  25  62.797   9.420 -13.274
  218   1HZ   LYS  25          1HZ       LYS  25  60.498   7.575 -12.914
  219   2HZ   LYS  25          2HZ       LYS  25  61.787   7.404 -14.006
  220   3HZ   LYS  25          3HZ       LYS  25  60.648   8.645 -14.222
  221    H    PHE  26           H        PHE  26  65.460   9.030  -7.793
  222    HA   PHE  26           HA       PHE  26  66.493  11.143  -9.378
  223   1HB   PHE  26          2HB       PHE  26  66.042  11.164  -6.926
  224   2HB   PHE  26          1HB       PHE  26  67.450  10.132  -6.678
  225    HD1  PHE  26           HD1      PHE  26  69.693  11.023  -6.661
  226    HD2  PHE  26           HD2      PHE  26  66.338  13.494  -7.931
  227    HE1  PHE  26           HE1      PHE  26  71.181  13.051  -6.650
  228    HE2  PHE  26           HE2      PHE  26  67.826  15.521  -7.919
  229    HZ   PHE  26           HZ       PHE  26  70.248  15.300  -7.278
  230    H    TYR  27           H        TYR  27  68.070   8.189  -8.225
  231    HA   TYR  27           HA       TYR  27  70.696   8.972  -9.306
  232   1HB   TYR  27          2HB       TYR  27  70.265   7.757  -7.163
  233   2HB   TYR  27          1HB       TYR  27  69.672   6.390  -8.088
  234    HD1  TYR  27           HD1      TYR  27  72.548   7.944  -6.617
  235    HD2  TYR  27           HD2      TYR  27  71.328   5.381  -9.917
  236    HE1  TYR  27           HE1      TYR  27  74.894   7.062  -6.807
  237    HE2  TYR  27           HE2      TYR  27  73.673   4.500 -10.103
  238    HH   TYR  27           HH       TYR  27  76.006   4.947  -7.683
  239    H    GLY  28           H        GLY  28  67.903   7.309 -10.552
  240   1HA   GLY  28          2HA       GLY  28  67.565   6.432 -12.706
  241   2HA   GLY  28          1HA       GLY  28  69.233   6.862 -13.088
  242    H    ILE  29           H        ILE  29  68.040   4.726 -10.492
  243    HA   ILE  29           HA       ILE  29  70.023   2.692 -11.289
  244    HB   ILE  29           HB       ILE  29  68.014   2.816  -9.007
  245   1HG1  ILE  29          2HG1      ILE  29  70.971   3.495  -9.058
  246   2HG1  ILE  29          1HG1      ILE  29  69.671   4.680  -9.055
  247   1HG2  ILE  29          1HG2      ILE  29  68.918   0.887  -8.179
  248   2HG2  ILE  29          2HG2      ILE  29  70.538   1.278  -8.756
  249   3HG2  ILE  29          3HG2      ILE  29  69.349   0.596  -9.863
  250   1HD1  ILE  29          1HD1      ILE  29  68.989   3.068  -6.921
  251   2HD1  ILE  29          2HD1      ILE  29  69.854   4.600  -6.795
  252   3HD1  ILE  29          3HD1      ILE  29  70.753   3.080  -6.836
  253    H    GLU  30           H        GLU  30  69.540   0.943 -12.488
  254    HA   GLU  30           HA       GLU  30  66.747  -0.132 -12.447
  255   1HB   GLU  30          2HB       GLU  30  68.638   0.096 -14.817
  256   2HB   GLU  30          1HB       GLU  30  67.059  -0.686 -14.854
  257   1HG   GLU  30          2HG       GLU  30  66.008   1.469 -14.177
  258   2HG   GLU  30          1HG       GLU  30  67.594   2.238 -14.253
  259    H    GLN  31           H        GLN  31  66.734  -2.513 -12.808
  260    HA   GLN  31           HA       GLN  31  68.645  -3.930 -11.269
  261   1HB   GLN  31          2HB       GLN  31  66.328  -4.637 -11.951
  262   2HB   GLN  31          1HB       GLN  31  66.969  -4.998 -13.554
  263   1HG   GLN  31          2HG       GLN  31  68.615  -6.555 -12.495
  264   2HG   GLN  31          1HG       GLN  31  67.826  -6.271 -10.943
  265   1HE2  GLN  31          1HE2      GLN  31  66.347  -7.887 -10.454
  266   2HE2  GLN  31          2HE2      GLN  31  65.408  -8.732 -11.589
  267    H    GLY  32           H        GLY  32  70.550  -4.941 -11.755
  268   1HA   GLY  32          2HA       GLY  32  72.185  -5.987 -13.158
  269   2HA   GLY  32          1HA       GLY  32  71.393  -5.282 -14.565
  270    H    ASP  33           H        ASP  33  71.457  -2.604 -12.835
  271    HA   ASP  33           HA       ASP  33  73.941  -1.599 -14.016
  272   1HB   ASP  33          2HB       ASP  33  71.871  -0.462 -12.113
  273   2HB   ASP  33          1HB       ASP  33  73.199   0.481 -12.785
  274    H    PHE  34           H        PHE  34  75.706  -0.639 -12.708
  275    HA   PHE  34           HA       PHE  34  76.005  -1.951 -10.026
  276   1HB   PHE  34          2HB       PHE  34  77.976  -1.054 -12.146
  277   2HB   PHE  34          1HB       PHE  34  78.470  -1.542 -10.524
  278    HD1  PHE  34           HD1      PHE  34  76.988  -2.686 -13.745
  279    HD2  PHE  34           HD2      PHE  34  78.324  -3.881  -9.774
  280    HE1  PHE  34           HE1      PHE  34  76.894  -5.101 -14.441
  281    HE2  PHE  34           HE2      PHE  34  78.229  -6.297 -10.470
  282    HZ   PHE  34           HZ       PHE  34  77.514  -6.907 -12.804
  283    H    VAL  35           H        VAL  35  76.347  -0.597  -8.288
  284    HA   VAL  35           HA       VAL  35  76.986   2.269  -8.845
  285    HB   VAL  35           HB       VAL  35  75.384   2.879  -7.040
  286   1HG1  VAL  35          1HG1      VAL  35  73.882   1.125  -8.975
  287   2HG1  VAL  35          2HG1      VAL  35  74.772   2.530  -9.562
  288   3HG1  VAL  35          3HG1      VAL  35  73.471   2.738  -8.391
  289   1HG2  VAL  35          1HG2      VAL  35  75.367   0.888  -5.687
  290   2HG2  VAL  35          2HG2      VAL  35  74.855  -0.106  -7.051
  291   3HG2  VAL  35          3HG2      VAL  35  73.740   1.068  -6.348
  292    H    GLU  36           H        GLU  36  78.251   3.256  -7.132
  293    HA   GLU  36           HA       GLU  36  79.584   1.258  -5.329
  294   1HB   GLU  36          2HB       GLU  36  80.931   2.278  -7.196
  295   2HB   GLU  36          1HB       GLU  36  80.625   3.867  -6.495
  296   1HG   GLU  36          2HG       GLU  36  81.684   3.097  -4.371
  297   2HG   GLU  36          1HG       GLU  36  82.068   1.564  -5.148
  298    H    ILE  37           H        ILE  37  79.127   1.606  -3.219
  299    HA   ILE  37           HA       ILE  37  78.222   4.335  -2.394
  300    HB   ILE  37           HB       ILE  37  76.385   2.859  -3.128
  301   1HG1  ILE  37          2HG1      ILE  37  76.194   2.911  -0.130
  302   2HG1  ILE  37          1HG1      ILE  37  76.290   4.426  -1.028
  303   1HG2  ILE  37          1HG2      ILE  37  75.884   0.796  -1.836
  304   2HG2  ILE  37          2HG2      ILE  37  77.393   1.005  -0.948
  305   3HG2  ILE  37          3HG2      ILE  37  77.429   0.690  -2.683
  306   1HD1  ILE  37          1HD1      ILE  37  74.032   2.626  -0.720
  307   2HD1  ILE  37          2HD1      ILE  37  74.397   2.878  -2.427
  308   3HD1  ILE  37          3HD1      ILE  37  74.070   4.259  -1.382
  309    H    LYS  38           H        LYS  38  78.232   4.659  -0.054
  310    HA   LYS  38           HA       LYS  38  79.874   2.707   1.509
  311   1HB   LYS  38          2HB       LYS  38  81.145   4.722   0.645
  312   2HB   LYS  38          1HB       LYS  38  80.083   5.730   1.637
  313   1HG   LYS  38          2HG       LYS  38  80.791   4.565   3.655
  314   2HG   LYS  38          1HG       LYS  38  81.761   3.443   2.700
  315   1HD   LYS  38          2HD       LYS  38  83.192   5.182   3.681
  316   2HD   LYS  38          1HD       LYS  38  83.163   5.339   1.924
  317   1HE   LYS  38          2HE       LYS  38  82.083   7.359   2.004
  318   2HE   LYS  38          1HE       LYS  38  81.076   6.876   3.384
  319   1HZ   LYS  38          1HZ       LYS  38  82.762   8.519   4.025
  320   2HZ   LYS  38          2HZ       LYS  38  83.988   7.461   3.513
  321   3HZ   LYS  38          3HZ       LYS  38  82.993   7.041   4.824
  322    H    ILE  39           H        ILE  39  79.252   2.511   3.697
  323    HA   ILE  39           HA       ILE  39  76.807   4.052   4.520
  324    HB   ILE  39           HB       ILE  39  76.366   2.052   5.964
  325   1HG1  ILE  39          2HG1      ILE  39  78.547   0.669   4.392
  326   2HG1  ILE  39          1HG1      ILE  39  78.863   1.401   5.964
  327   1HG2  ILE  39          1HG2      ILE  39  75.096   1.787   4.094
  328   2HG2  ILE  39          2HG2      ILE  39  76.213   0.455   3.786
  329   3HG2  ILE  39          3HG2      ILE  39  76.463   2.016   3.003
  330   1HD1  ILE  39          1HD1      ILE  39  77.295  -1.027   5.289
  331   2HD1  ILE  39          2HD1      ILE  39  76.634  -0.003   6.563
  332   3HD1  ILE  39          3HD1      ILE  39  78.259  -0.670   6.722
  333    H    VAL  40           H        VAL  40  76.761   4.834   6.671
  334    HA   VAL  40           HA       VAL  40  79.234   4.529   8.313
  335    HB   VAL  40           HB       VAL  40  77.845   7.137   7.596
  336   1HG1  VAL  40          1HG1      VAL  40  79.191   8.208   9.118
  337   2HG1  VAL  40          2HG1      VAL  40  80.524   7.075   8.897
  338   3HG1  VAL  40          3HG1      VAL  40  79.155   6.635   9.915
  339   1HG2  VAL  40          1HG2      VAL  40  80.283   7.519   6.644
  340   2HG2  VAL  40          2HG2      VAL  40  79.098   6.635   5.682
  341   3HG2  VAL  40          3HG2      VAL  40  80.327   5.757   6.593
  342    H    LYS  41           H        LYS  41  78.605   3.926  10.320
  343    HA   LYS  41           HA       LYS  41  76.088   5.042  11.474
  344   1HB   LYS  41          2HB       LYS  41  75.651   2.780  10.594
  345   2HB   LYS  41          1HB       LYS  41  77.018   2.150  11.510
  346   1HG   LYS  41          2HG       LYS  41  74.936   1.689  12.717
  347   2HG   LYS  41          1HG       LYS  41  75.901   2.857  13.619
  348   1HD   LYS  41          2HD       LYS  41  74.533   4.681  12.914
  349   2HD   LYS  41          1HD       LYS  41  73.738   3.701  11.685
  350   1HE   LYS  41          2HE       LYS  41  72.487   2.486  13.289
  351   2HE   LYS  41          1HE       LYS  41  73.559   2.977  14.616
  352   1HZ   LYS  41          1HZ       LYS  41  72.887   5.267  14.280
  353   2HZ   LYS  41          2HZ       LYS  41  71.520   4.304  14.582
  354   3HZ   LYS  41          3HZ       LYS  41  71.870   4.815  13.001
  355    H    TYR  42           H        TYR  42  76.222   5.369  13.727
  356    HA   TYR  42           HA       TYR  42  79.007   5.332  14.804
  357   1HB   TYR  42          2HB       TYR  42  77.501   7.402  14.623
  358   2HB   TYR  42          1HB       TYR  42  76.553   6.696  15.934
  359    HD1  TYR  42           HD1      TYR  42  80.014   7.810  14.976
  360    HD2  TYR  42           HD2      TYR  42  77.282   6.832  18.225
  361    HE1  TYR  42           HE1      TYR  42  81.688   8.672  16.641
  362    HE2  TYR  42           HE2      TYR  42  78.956   7.695  19.892
  363    HH   TYR  42           HH       TYR  42  82.237   8.498  18.979
  364    H    GLU  43           H        GLU  43  79.557   3.921  16.417
  365    HA   GLU  43           HA       GLU  43  77.388   2.765  18.126
  366   1HB   GLU  43          2HB       GLU  43  79.660   1.306  16.735
  367   2HB   GLU  43          1HB       GLU  43  78.528   0.563  17.866
  368   1HG   GLU  43          2HG       GLU  43  76.647   1.226  16.366
  369   2HG   GLU  43          1HG       GLU  43  77.820   1.862  15.216
  370    H    GLY  44           H        GLY  44  77.961   2.688  20.280
  371   1HA   GLY  44          2HA       GLY  44  79.221   3.037  22.227
  372   2HA   GLY  44          1HA       GLY  44  80.601   2.414  21.323
  373    H    GLU  45           H        GLU  45  82.232   3.864  21.480
  374    HA   GLU  45           HA       GLU  45  81.595   6.779  21.360
  375   1HB   GLU  45          2HB       GLU  45  83.753   7.065  22.469
  376   2HB   GLU  45          1HB       GLU  45  82.803   5.863  23.337
  377   1HG   GLU  45          2HG       GLU  45  84.052   4.052  22.210
  378   2HG   GLU  45          1HG       GLU  45  84.992   5.251  21.323
  379    H    GLU  46           H        GLU  46  82.320   4.495  19.122
  380    HA   GLU  46           HA       GLU  46  84.104   6.349  17.587
  381   1HB   GLU  46          2HB       GLU  46  85.241   4.298  16.755
  382   2HB   GLU  46          1HB       GLU  46  85.351   4.447  18.507
  383   1HG   GLU  46          2HG       GLU  46  83.443   2.890  18.755
  384   2HG   GLU  46          1HG       GLU  46  83.353   2.729  17.002
  385    HA   PRO  47           HA       PRO  47  81.014   5.625  14.401
  386   1HB   PRO  47          2HB       PRO  47  82.732   6.731  12.370
  387   2HB   PRO  47          1HB       PRO  47  81.343   7.497  13.157
  388   1HG   PRO  47          2HG       PRO  47  84.002   8.232  13.459
  389   2HG   PRO  47          1HG       PRO  47  82.658   8.721  14.496
  390   1HD   PRO  47          2HD       PRO  47  84.773   6.720  14.983
  391   2HD   PRO  47          1HD       PRO  47  83.815   7.671  16.137
  392    H    LYS  48           H        LYS  48  80.729   3.877  13.041
  393    HA   LYS  48           HA       LYS  48  83.152   2.368  12.116
  394   1HB   LYS  48          2HB       LYS  48  80.290   1.471  12.613
  395   2HB   LYS  48          1HB       LYS  48  81.606   0.430  12.074
  396   1HG   LYS  48          2HG       LYS  48  81.659   2.006  14.659
  397   2HG   LYS  48          1HG       LYS  48  81.182   0.311  14.548
  398   1HD   LYS  48          2HD       LYS  48  83.401  -0.176  13.478
  399   2HD   LYS  48          1HD       LYS  48  83.873   1.491  13.809
  400   1HE   LYS  48          2HE       LYS  48  84.693   0.488  15.738
  401   2HE   LYS  48          1HE       LYS  48  83.032   0.802  16.280
  402   1HZ   LYS  48          1HZ       LYS  48  83.568  -1.517  16.615
  403   2HZ   LYS  48          2HZ       LYS  48  84.017  -1.687  14.985
  404   3HZ   LYS  48          3HZ       LYS  48  82.397  -1.379  15.396
  405    H    GLU  49           H        GLU  49  83.355   2.104   9.891
  406    HA   GLU  49           HA       GLU  49  81.085   3.018   8.158
  407   1HB   GLU  49          2HB       GLU  49  84.027   3.753   8.018
  408   2HB   GLU  49          1HB       GLU  49  82.808   4.251   6.845
  409   1HG   GLU  49          2HG       GLU  49  81.543   5.369   8.675
  410   2HG   GLU  49          1HG       GLU  49  82.822   4.929   9.802
  411    H    GLY  50           H        GLY  50  81.341   2.312   5.877
  412   1HA   GLY  50          2HA       GLY  50  83.312   0.248   5.246
  413   2HA   GLY  50          1HA       GLY  50  81.660  -0.359   5.377
  414    H    THR  51           H        THR  51  83.670   0.261   3.046
  415    HA   THR  51           HA       THR  51  81.608   1.578   1.301
  416    HB   THR  51           HB       THR  51  84.587   1.654   0.811
  417    HG1  THR  51           HG1      THR  51  84.541   2.615   2.732
  418   1HG2  THR  51          1HG2      THR  51  82.383   2.528  -0.644
  419   2HG2  THR  51          2HG2      THR  51  84.044   3.083  -0.855
  420   3HG2  THR  51          3HG2      THR  51  82.939   3.989   0.178
  421    H    PHE  52           H        PHE  52  81.088   0.405  -0.541
  422    HA   PHE  52           HA       PHE  52  82.952  -1.618  -1.594
  423   1HB   PHE  52          2HB       PHE  52  81.571  -3.522  -1.119
  424   2HB   PHE  52          1HB       PHE  52  81.695  -2.620   0.385
  425    HD1  PHE  52           HD1      PHE  52  79.465  -4.150  -1.965
  426    HD2  PHE  52           HD2      PHE  52  79.745  -0.853   0.867
  427    HE1  PHE  52           HE1      PHE  52  76.958  -4.003  -1.893
  428    HE2  PHE  52           HE2      PHE  52  77.234  -0.707   0.941
  429    HZ   PHE  52           HZ       PHE  52  75.842  -2.283  -0.446
  430    H    THR  53           H        THR  53  81.843  -2.801  -3.519
  431    HA   THR  53           HA       THR  53  80.082  -0.881  -5.008
  432    HB   THR  53           HB       THR  53  81.894  -3.109  -5.999
  433    HG1  THR  53           HG1      THR  53  83.214  -1.539  -5.302
  434   1HG2  THR  53          1HG2      THR  53  81.564  -1.754  -8.176
  435   2HG2  THR  53          2HG2      THR  53  80.177  -1.037  -7.359
  436   3HG2  THR  53          3HG2      THR  53  80.230  -2.777  -7.644
  437    H    ALA  54           H        ALA  54  78.103  -1.671  -5.760
  438    HA   ALA  54           HA       ALA  54  77.453  -4.550  -5.290
  439   1HB   ALA  54          1HB       ALA  54  75.975  -4.014  -3.634
  440   2HB   ALA  54          2HB       ALA  54  75.389  -2.596  -4.503
  441   3HB   ALA  54          3HB       ALA  54  76.864  -2.494  -3.544
  442    H    ARG  55           H        ARG  55  75.853  -5.369  -6.671
  443    HA   ARG  55           HA       ARG  55  75.049  -3.639  -8.960
  444   1HB   ARG  55          2HB       ARG  55  76.075  -6.006  -9.112
  445   2HB   ARG  55          1HB       ARG  55  74.504  -6.586  -8.552
  446   1HG   ARG  55          2HG       ARG  55  73.413  -5.398 -10.441
  447   2HG   ARG  55          1HG       ARG  55  75.000  -4.892 -11.020
  448   1HD   ARG  55          2HD       ARG  55  74.522  -6.843 -12.293
  449   2HD   ARG  55          1HD       ARG  55  75.571  -7.439 -10.993
  450    HE   ARG  55           HE       ARG  55  72.713  -7.433 -10.325
  451   1HH1  ARG  55          1HH1      ARG  55  75.368  -9.297 -11.671
  452   2HH1  ARG  55          2HH1      ARG  55  74.602 -10.806 -11.324
  453   1HH2  ARG  55          1HH2      ARG  55  71.776  -9.412  -9.907
  454   2HH2  ARG  55          2HH2      ARG  55  72.597 -10.874 -10.341
  455    H    VAL  56           H        VAL  56  72.856  -3.239  -9.400
  456    HA   VAL  56           HA       VAL  56  71.050  -3.251  -7.109
  457    HB   VAL  56           HB       VAL  56  70.749  -2.471 -10.029
  458   1HG1  VAL  56          1HG1      VAL  56  68.592  -1.921  -9.650
  459   2HG1  VAL  56          2HG1      VAL  56  68.988  -1.109  -8.134
  460   3HG1  VAL  56          3HG1      VAL  56  68.693  -2.848  -8.152
  461   1HG2  VAL  56          1HG2      VAL  56  70.937  -0.549  -7.745
  462   2HG2  VAL  56          2HG2      VAL  56  71.475  -0.359  -9.413
  463   3HG2  VAL  56          3HG2      VAL  56  72.414  -1.341  -8.289
  464    H    GLY  57           H        GLY  57  69.637  -4.829  -6.617
  465   1HA   GLY  57          2HA       GLY  57  69.075  -6.947  -8.637
  466   2HA   GLY  57          1HA       GLY  57  68.902  -7.144  -6.893
  467    H    GLU  58           H        GLU  58  66.741  -7.964  -7.674
  468    HA   GLU  58           HA       GLU  58  64.734  -6.273  -8.803
  469   1HB   GLU  58          2HB       GLU  58  64.695  -8.771  -8.548
  470   2HB   GLU  58          1HB       GLU  58  64.433  -8.553  -6.818
  471   1HG   GLU  58          2HG       GLU  58  62.369  -7.261  -7.318
  472   2HG   GLU  58          1HG       GLU  58  62.611  -7.568  -9.034
  473    H    GLN  59           H        GLN  59  63.015  -5.128  -7.752
  474    HA   GLN  59           HA       GLN  59  62.139  -3.607  -6.185
  475   1HB   GLN  59          2HB       GLN  59  63.161  -5.914  -4.529
  476   2HB   GLN  59          1HB       GLN  59  62.312  -4.556  -3.789
  477   1HG   GLN  59          2HG       GLN  59  60.375  -4.937  -5.232
  478   2HG   GLN  59          1HG       GLN  59  61.221  -6.243  -6.060
  479   1HE2  GLN  59          1HE2      GLN  59  61.247  -8.309  -5.061
  480   2HE2  GLN  59          2HE2      GLN  59  60.510  -8.633  -3.567
  481    H    GLY  60           H        GLY  60  65.213  -3.480  -6.889
  482   1HA   GLY  60          2HA       GLY  60  66.776  -1.792  -6.428
  483   2HA   GLY  60          1HA       GLY  60  65.596  -1.111  -5.310
  484    H    SER  61           H        SER  61  66.540  -4.412  -4.772
  485    HA   SER  61           HA       SER  61  67.576  -3.721  -2.135
  486   1HB   SER  61          2HB       SER  61  67.591  -6.106  -1.841
  487   2HB   SER  61          1HB       SER  61  66.190  -5.749  -2.847
  488    HG   SER  61           HG       SER  61  68.619  -6.969  -3.488
  489    H    VAL  62           H        VAL  62  69.719  -3.947  -1.418
  490    HA   VAL  62           HA       VAL  62  71.807  -4.750  -3.382
  491    HB   VAL  62           HB       VAL  62  71.593  -2.292  -3.452
  492   1HG1  VAL  62          1HG1      VAL  62  72.077  -0.960  -1.424
  493   2HG1  VAL  62          2HG1      VAL  62  72.157  -2.445  -0.475
  494   3HG1  VAL  62          3HG1      VAL  62  70.633  -1.952  -1.214
  495   1HG2  VAL  62          1HG2      VAL  62  74.066  -2.756  -1.821
  496   2HG2  VAL  62          2HG2      VAL  62  73.872  -1.857  -3.327
  497   3HG2  VAL  62          3HG2      VAL  62  73.881  -3.621  -3.347
  498    H    ILE  63           H        ILE  63  73.597  -5.777  -2.364
  499    HA   ILE  63           HA       ILE  63  73.114  -6.503   0.499
  500    HB   ILE  63           HB       ILE  63  74.702  -7.884  -1.693
  501   1HG1  ILE  63          2HG1      ILE  63  72.305  -7.803  -2.259
  502   2HG1  ILE  63          1HG1      ILE  63  72.776  -9.443  -1.823
  503   1HG2  ILE  63          1HG2      ILE  63  74.116  -8.488   1.166
  504   2HG2  ILE  63          2HG2      ILE  63  75.552  -8.853   0.209
  505   3HG2  ILE  63          3HG2      ILE  63  74.100  -9.839   0.034
  506   1HD1  ILE  63          1HD1      ILE  63  71.882  -9.102   0.452
  507   2HD1  ILE  63          2HD1      ILE  63  70.633  -8.818  -0.761
  508   3HD1  ILE  63          3HD1      ILE  63  71.422  -7.453   0.028
  509    H    ILE  64           H        ILE  64  74.529  -5.715   1.983
  510    HA   ILE  64           HA       ILE  64  77.131  -4.536   1.237
  511    HB   ILE  64           HB       ILE  64  75.794  -5.155   3.900
  512   1HG1  ILE  64          2HG1      ILE  64  76.041  -2.506   2.444
  513   2HG1  ILE  64          1HG1      ILE  64  74.611  -3.532   2.352
  514   1HG2  ILE  64          1HG2      ILE  64  78.103  -3.284   3.291
  515   2HG2  ILE  64          2HG2      ILE  64  78.289  -4.889   3.997
  516   3HG2  ILE  64          3HG2      ILE  64  77.418  -3.634   4.879
  517   1HD1  ILE  64          1HD1      ILE  64  75.622  -1.895   4.619
  518   2HD1  ILE  64          2HD1      ILE  64  74.914  -3.456   5.030
  519   3HD1  ILE  64          3HD1      ILE  64  73.963  -2.261   4.148
  520    HA   PRO  65           HA       PRO  65  79.330  -8.393   1.522
  521   1HB   PRO  65          2HB       PRO  65  81.799  -7.506   2.300
  522   2HB   PRO  65          1HB       PRO  65  81.175  -7.281   0.650
  523   1HG   PRO  65          2HG       PRO  65  81.090  -5.374   2.961
  524   2HG   PRO  65          1HG       PRO  65  81.661  -5.085   1.306
  525   1HD   PRO  65          2HD       PRO  65  79.231  -4.313   2.000
  526   2HD   PRO  65          1HD       PRO  65  79.484  -5.108   0.425
  527    H    LYS  66           H        LYS  66  79.472  -9.905   3.147
  528    HA   LYS  66           HA       LYS  66  78.663  -9.441   5.816
  529   1HB   LYS  66          2HB       LYS  66  78.719 -11.617   4.601
  530   2HB   LYS  66          1HB       LYS  66  80.479 -11.619   4.727
  531   1HG   LYS  66          2HG       LYS  66  79.729 -12.956   6.547
  532   2HG   LYS  66          1HG       LYS  66  80.139 -11.395   7.262
  533   1HD   LYS  66          2HD       LYS  66  77.786 -10.721   7.215
  534   2HD   LYS  66          1HD       LYS  66  77.349 -12.235   6.420
  535   1HE   LYS  66          2HE       LYS  66  78.763 -12.202   9.099
  536   2HE   LYS  66          1HE       LYS  66  76.993 -12.171   8.964
  537   1HZ   LYS  66          1HZ       LYS  66  77.648 -14.443   9.032
  538   2HZ   LYS  66          2HZ       LYS  66  78.847 -14.206   7.852
  539   3HZ   LYS  66          3HZ       LYS  66  77.205 -14.107   7.430
  540    H    ALA  67           H        ALA  67  81.902  -9.422   4.404
  541    HA   ALA  67           HA       ALA  67  83.480  -9.468   6.770
  542   1HB   ALA  67          1HB       ALA  67  84.446  -9.723   4.573
  543   2HB   ALA  67          2HB       ALA  67  85.134  -8.254   5.265
  544   3HB   ALA  67          3HB       ALA  67  83.845  -8.144   4.066
  545    H    LEU  68           H        LEU  68  81.901  -6.752   5.109
  546    HA   LEU  68           HA       LEU  68  83.009  -4.730   6.900
  547   1HB   LEU  68          2HB       LEU  68  80.789  -4.759   4.836
  548   2HB   LEU  68          1HB       LEU  68  81.290  -3.302   5.693
  549    HG   LEU  68           HG       LEU  68  83.086  -5.030   3.955
  550   1HD1  LEU  68          1HD1      LEU  68  81.222  -3.359   3.015
  551   2HD1  LEU  68          2HD1      LEU  68  82.813  -3.481   2.264
  552   3HD1  LEU  68          3HD1      LEU  68  82.466  -2.163   3.384
  553   1HD2  LEU  68          1HD2      LEU  68  84.626  -2.992   4.260
  554   2HD2  LEU  68          2HD2      LEU  68  84.459  -4.058   5.654
  555   3HD2  LEU  68          3HD2      LEU  68  83.574  -2.534   5.599
  556    H    ARG  69           H        ARG  69  80.002  -6.632   6.772
  557    HA   ARG  69           HA       ARG  69  78.431  -5.169   8.657
  558   1HB   ARG  69          2HB       ARG  69  78.678  -8.182   8.328
  559   2HB   ARG  69          1HB       ARG  69  77.301  -7.327   9.007
  560   1HG   ARG  69          2HG       ARG  69  77.054  -6.169   6.756
  561   2HG   ARG  69          1HG       ARG  69  78.245  -7.316   6.135
  562   1HD   ARG  69          2HD       ARG  69  76.651  -9.085   7.346
  563   2HD   ARG  69          1HD       ARG  69  75.442  -7.823   7.049
  564    HE   ARG  69           HE       ARG  69  76.692  -7.957   4.627
  565   1HH1  ARG  69          1HH1      ARG  69  75.378 -10.465   6.709
  566   2HH1  ARG  69          2HH1      ARG  69  75.060 -11.525   5.383
  567   1HH2  ARG  69          1HH2      ARG  69  76.248  -9.371   2.963
  568   2HH2  ARG  69          2HH2      ARG  69  75.543 -10.918   3.291
  569    H    ASP  70           H        ASP  70  80.767  -7.807   9.150
  570    HA   ASP  70           HA       ASP  70  80.456  -7.949  12.009
  571   1HB   ASP  70          2HB       ASP  70  82.685  -8.814  10.136
  572   2HB   ASP  70          1HB       ASP  70  82.533  -9.338  11.813
  573    H    VAL  71           H        VAL  71  82.990  -6.451   9.967
  574    HA   VAL  71           HA       VAL  71  84.640  -5.480  12.084
  575    HB   VAL  71           HB       VAL  71  84.087  -4.449   9.275
  576   1HG1  VAL  71          1HG1      VAL  71  86.425  -3.867  11.121
  577   2HG1  VAL  71          2HG1      VAL  71  85.184  -2.713  10.631
  578   3HG1  VAL  71          3HG1      VAL  71  86.304  -3.365   9.433
  579   1HG2  VAL  71          1HG2      VAL  71  86.072  -5.752   8.681
  580   2HG2  VAL  71          2HG2      VAL  71  84.892  -6.800   9.467
  581   3HG2  VAL  71          3HG2      VAL  71  86.294  -6.223  10.366
  582    H    ILE  72           H        ILE  72  81.828  -4.035  10.482
  583    HA   ILE  72           HA       ILE  72  82.079  -1.493  11.895
  584    HB   ILE  72           HB       ILE  72  79.882  -2.701  10.172
  585   1HG1  ILE  72          2HG1      ILE  72  82.087  -0.741   9.452
  586   2HG1  ILE  72          1HG1      ILE  72  82.149  -2.468   9.102
  587   1HG2  ILE  72          1HG2      ILE  72  79.422  -0.622  11.744
  588   2HG2  ILE  72          2HG2      ILE  72  78.886  -0.589  10.066
  589   3HG2  ILE  72          3HG2      ILE  72  80.366   0.245  10.534
  590   1HD1  ILE  72          1HD1      ILE  72  80.369  -0.359   7.926
  591   2HD1  ILE  72          2HD1      ILE  72  79.798  -2.029   7.996
  592   3HD1  ILE  72          3HD1      ILE  72  81.273  -1.636   7.111
  593    H    GLY  73           H        GLY  73  80.549  -4.552  12.609
  594   1HA   GLY  73          2HA       GLY  73  79.500  -5.199  14.614
  595   2HA   GLY  73          1HA       GLY  73  79.749  -3.558  15.212
  596    H    ILE  74           H        ILE  74  78.033  -4.389  12.233
  597    HA   ILE  74           HA       ILE  74  75.766  -2.741  13.139
  598    HB   ILE  74           HB       ILE  74  76.319  -4.193  10.530
  599   1HG1  ILE  74          2HG1      ILE  74  78.107  -2.584  11.072
  600   2HG1  ILE  74          1HG1      ILE  74  77.130  -1.988   9.732
  601   1HG2  ILE  74          1HG2      ILE  74  74.798  -2.236   9.717
  602   2HG2  ILE  74          2HG2      ILE  74  74.281  -2.158  11.400
  603   3HG2  ILE  74          3HG2      ILE  74  74.043  -3.639  10.473
  604   1HD1  ILE  74          1HD1      ILE  74  77.001  -0.071  10.950
  605   2HD1  ILE  74          2HD1      ILE  74  77.477  -0.881  12.443
  606   3HD1  ILE  74          3HD1      ILE  74  75.799  -0.944  11.902
  607    H    LYS  75           H        LYS  75  73.672  -3.474  13.489
  608    HA   LYS  75           HA       LYS  75  73.216  -6.442  13.410
  609   1HB   LYS  75          2HB       LYS  75  72.640  -4.335  15.501
  610   2HB   LYS  75          1HB       LYS  75  71.835  -5.905  15.519
  611   1HG   LYS  75          2HG       LYS  75  73.650  -6.483  16.793
  612   2HG   LYS  75          1HG       LYS  75  74.389  -6.725  15.209
  613   1HD   LYS  75          2HD       LYS  75  75.972  -5.307  16.071
  614   2HD   LYS  75          1HD       LYS  75  74.839  -4.079  15.503
  615   1HE   LYS  75          2HE       LYS  75  74.023  -3.646  17.657
  616   2HE   LYS  75          1HE       LYS  75  74.519  -5.237  18.268
  617   1HZ   LYS  75          1HZ       LYS  75  76.317  -3.020  17.441
  618   2HZ   LYS  75          2HZ       LYS  75  76.843  -4.578  17.868
  619   3HZ   LYS  75          3HZ       LYS  75  76.083  -3.590  19.022
  620    HA   PRO  76           HA       PRO  76  69.462  -5.702  11.166
  621   1HB   PRO  76          2HB       PRO  76  68.009  -7.389  13.126
  622   2HB   PRO  76          1HB       PRO  76  68.171  -7.585  11.372
  623   1HG   PRO  76          2HG       PRO  76  69.468  -9.147  13.135
  624   2HG   PRO  76          1HG       PRO  76  70.123  -8.741  11.543
  625   1HD   PRO  76          2HD       PRO  76  70.934  -7.759  14.213
  626   2HD   PRO  76          1HD       PRO  76  71.886  -7.928  12.725
  627    H    GLY  77           H        GLY  77  67.947  -4.075  11.288
  628   1HA   GLY  77          2HA       GLY  77  66.174  -2.821  12.278
  629   2HA   GLY  77          1HA       GLY  77  66.623  -3.471  13.852
  630    H    GLU  78           H        GLU  78  69.496  -2.436  12.525
  631    HA   GLU  78           HA       GLU  78  69.361   0.124  14.032
  632   1HB   GLU  78          2HB       GLU  78  71.431  -1.844  13.196
  633   2HB   GLU  78          1HB       GLU  78  71.949  -0.161  13.325
  634   1HG   GLU  78          2HG       GLU  78  70.945  -0.082  15.617
  635   2HG   GLU  78          1HG       GLU  78  70.600  -1.806  15.486
  636    H    VAL  79           H        VAL  79  69.370   2.061  12.997
  637    HA   VAL  79           HA       VAL  79  69.223   2.043  10.055
  638    HB   VAL  79           HB       VAL  79  67.551   3.164  11.484
  639   1HG1  VAL  79          1HG1      VAL  79  69.166   5.481  12.216
  640   2HG1  VAL  79          2HG1      VAL  79  69.786   4.007  12.956
  641   3HG1  VAL  79          3HG1      VAL  79  68.112   4.489  13.222
  642   1HG2  VAL  79          1HG2      VAL  79  67.278   4.975  10.070
  643   2HG2  VAL  79          2HG2      VAL  79  68.480   4.064   9.157
  644   3HG2  VAL  79          3HG2      VAL  79  68.980   5.430  10.152
  645    H    ILE  80           H        ILE  80  70.809   2.735   8.739
  646    HA   ILE  80           HA       ILE  80  73.117   4.270   9.880
  647    HB   ILE  80           HB       ILE  80  74.472   3.059   8.178
  648   1HG1  ILE  80          2HG1      ILE  80  71.911   1.547   7.573
  649   2HG1  ILE  80          1HG1      ILE  80  72.600   2.799   6.537
  650   1HG2  ILE  80          1HG2      ILE  80  72.863   0.933   9.564
  651   2HG2  ILE  80          2HG2      ILE  80  73.780   2.091  10.527
  652   3HG2  ILE  80          3HG2      ILE  80  74.612   1.057   9.367
  653   1HD1  ILE  80          1HD1      ILE  80  74.446   1.493   5.961
  654   2HD1  ILE  80          2HD1      ILE  80  73.180   0.273   6.078
  655   3HD1  ILE  80          3HD1      ILE  80  74.318   0.492   7.407
  656    H    GLU  81           H        GLU  81  74.093   5.778   8.322
  657    HA   GLU  81           HA       GLU  81  72.147   6.922   6.375
  658   1HB   GLU  81          2HB       GLU  81  73.191   8.342   8.151
  659   2HB   GLU  81          1HB       GLU  81  74.781   7.957   7.491
  660   1HG   GLU  81          2HG       GLU  81  74.076   8.939   5.309
  661   2HG   GLU  81          1HG       GLU  81  72.540   9.395   6.037
  662    H    VAL  82           H        VAL  82  72.513   6.591   4.231
  663    HA   VAL  82           HA       VAL  82  75.044   5.214   3.452
  664    HB   VAL  82           HB       VAL  82  72.214   5.139   2.346
  665   1HG1  VAL  82          1HG1      VAL  82  73.121   3.108   1.118
  666   2HG1  VAL  82          2HG1      VAL  82  74.736   3.651   1.576
  667   3HG1  VAL  82          3HG1      VAL  82  73.724   4.662   0.542
  668   1HG2  VAL  82          1HG2      VAL  82  72.132   3.959   4.367
  669   2HG2  VAL  82          2HG2      VAL  82  73.803   3.415   4.227
  670   3HG2  VAL  82          3HG2      VAL  82  72.552   2.685   3.222
  671    H    LEU  83           H        LEU  83  76.331   6.227   2.029
  672    HA   LEU  83           HA       LEU  83  75.267   8.536   0.436
  673   1HB   LEU  83          2HB       LEU  83  78.129   7.913   1.261
  674   2HB   LEU  83          1HB       LEU  83  77.529   9.428   0.601
  675    HG   LEU  83           HG       LEU  83  76.748   8.249   3.286
  676   1HD1  LEU  83          1HD1      LEU  83  79.103   9.151   3.051
  677   2HD1  LEU  83          2HD1      LEU  83  78.111   9.975   4.258
  678   3HD1  LEU  83          3HD1      LEU  83  78.387  10.723   2.683
  679   1HD2  LEU  83          1HD2      LEU  83  76.121  10.968   2.100
  680   2HD2  LEU  83          2HD2      LEU  83  75.530  10.313   3.628
  681   3HD2  LEU  83          3HD2      LEU  83  74.996   9.610   2.102
  682    H    LEU  84           H        LEU  84  75.323   8.224  -1.791
  683    HA   LEU  84           HA       LEU  84  76.677   5.873  -2.957
  684   1HB   LEU  84          2HB       LEU  84  74.891   8.102  -3.868
  685   2HB   LEU  84          1HB       LEU  84  75.837   7.221  -5.073
  686    HG   LEU  84           HG       LEU  84  74.368   5.614  -3.033
  687   1HD1  LEU  84          1HD1      LEU  84  72.605   5.904  -5.237
  688   2HD1  LEU  84          2HD1      LEU  84  73.043   7.538  -4.740
  689   3HD1  LEU  84          3HD1      LEU  84  72.337   6.423  -3.575
  690   1HD2  LEU  84          1HD2      LEU  84  75.476   4.207  -4.480
  691   2HD2  LEU  84          2HD2      LEU  84  75.432   5.367  -5.808
  692   3HD2  LEU  84          3HD2      LEU  84  73.998   4.418  -5.418
  693    H    LEU  85           H        LEU  85  78.605   5.959  -4.094
  694    HA   LEU  85           HA       LEU  85  80.128   8.521  -3.903
  695   1HB   LEU  85          2HB       LEU  85  80.704   5.608  -3.612
  696   2HB   LEU  85          1HB       LEU  85  82.004   6.628  -4.233
  697    HG   LEU  85           HG       LEU  85  80.451   7.424  -1.776
  698   1HD1  LEU  85          1HD1      LEU  85  82.989   5.764  -1.816
  699   2HD1  LEU  85          2HD1      LEU  85  81.387   5.111  -1.475
  700   3HD1  LEU  85          3HD1      LEU  85  82.101   6.304  -0.391
  701   1HD2  LEU  85          1HD2      LEU  85  82.815   8.434  -1.344
  702   2HD2  LEU  85          2HD2      LEU  85  81.789   9.200  -2.557
  703   3HD2  LEU  85          3HD2      LEU  85  83.090   8.120  -3.057
  704    H    GLY  86           H        GLY  86  79.205   5.901  -6.114
  705   1HA   GLY  86          2HA       GLY  86  79.746   7.574  -8.450
  706   2HA   GLY  86          1HA       GLY  86  80.960   6.318  -8.249
  707    H    HIS  87           H        HIS  87  79.816   5.926 -10.505
  708    HA   HIS  87           HA       HIS  87  77.821   3.742 -10.097
  709   1HB   HIS  87          2HB       HIS  87  76.428   4.755 -11.899
  710   2HB   HIS  87          1HB       HIS  87  76.587   5.833 -10.518
  711    HD1  HIS  87           HD1      HIS  87  77.732   5.396 -14.077
  712    HD2  HIS  87           HD2      HIS  87  78.047   8.214 -11.020
  713    HE1  HIS  87           HE1      HIS  87  78.699   7.489 -15.127
  714    H    TYR  88           H        TYR  88  77.805   2.189 -11.849
  715    HA   TYR  88           HA       TYR  88  79.805   2.597 -14.028
  716   1HB   TYR  88          2HB       TYR  88  79.524   0.209 -12.176
  717   2HB   TYR  88          1HB       TYR  88  80.531   0.221 -13.624
  718    HD1  TYR  88           HD1      TYR  88  80.175   1.403 -10.144
  719    HD2  TYR  88           HD2      TYR  88  82.528   1.735 -13.795
  720    HE1  TYR  88           HE1      TYR  88  82.028   2.506  -8.849
  721    HE2  TYR  88           HE2      TYR  88  84.381   2.837 -12.500
  722    HH   TYR  88           HH       TYR  88  84.657   2.734  -9.207
  723    H    LYS  89           H        LYS  89  79.094   1.770 -16.001
  724    HA   LYS  89           HA       LYS  89  76.392   0.472 -16.019
  725   1HB   LYS  89          2HB       LYS  89  77.234   2.791 -17.155
  726   2HB   LYS  89          1HB       LYS  89  77.576   1.665 -18.469
  727   1HG   LYS  89          2HG       LYS  89  75.358   1.175 -18.815
  728   2HG   LYS  89          1HG       LYS  89  74.937   1.391 -17.115
  729   1HD   LYS  89          2HD       LYS  89  73.939   3.252 -18.162
  730   2HD   LYS  89          1HD       LYS  89  75.452   3.902 -17.530
  731   1HE   LYS  89          2HE       LYS  89  76.432   4.042 -19.644
  732   2HE   LYS  89          1HE       LYS  89  75.403   2.759 -20.314
  733   1HZ   LYS  89          1HZ       LYS  89  74.434   5.420 -19.410
  734   2HZ   LYS  89          2HZ       LYS  89  73.493   4.194 -20.115
  735   3HZ   LYS  89          3HZ       LYS  89  74.686   4.985 -21.029
  736    HA   PRO  90           HA       PRO  90  78.082  -3.299 -17.652
  737   1HB   PRO  90          2HB       PRO  90  75.844  -3.113 -19.645
  738   2HB   PRO  90          1HB       PRO  90  76.307  -4.473 -18.597
  739   1HG   PRO  90          2HG       PRO  90  74.215  -3.060 -17.950
  740   2HG   PRO  90          1HG       PRO  90  75.399  -3.466 -16.690
  741   1HD   PRO  90          2HD       PRO  90  75.048  -0.880 -18.174
  742   2HD   PRO  90          1HD       PRO  90  75.298  -1.154 -16.430
  743    H    ARG  91           H        ARG  91  79.526  -3.856 -19.313
  744    HA   ARG  91           HA       ARG  91  79.671  -2.015 -21.681
  745   1HB   ARG  91          2HB       ARG  91  81.865  -3.253 -19.987
  746   2HB   ARG  91          1HB       ARG  91  82.151  -2.327 -21.461
  747   1HG   ARG  91          2HG       ARG  91  80.960  -0.390 -20.432
  748   2HG   ARG  91          1HG       ARG  91  80.808  -1.316 -18.937
  749   1HD   ARG  91          2HD       ARG  91  83.325  -1.541 -18.905
  750   2HD   ARG  91          1HD       ARG  91  83.382  -0.407 -20.268
  751    HE   ARG  91           HE       ARG  91  81.770   0.921 -18.500
  752   1HH1  ARG  91          1HH1      ARG  91  84.902  -0.615 -18.106
  753   2HH1  ARG  91          2HH1      ARG  91  85.372   0.462 -16.837
  754   1HH2  ARG  91          1HH2      ARG  91  82.433   2.279 -16.860
  755   2HH2  ARG  91          2HH2      ARG  91  83.995   2.079 -16.140
  756    H    ASN  92           H        ASN  92  80.210  -3.021 -23.666
  757    HA   ASN  92           HA       ASN  92  80.808  -5.917 -23.738
  758   1HB   ASN  92          2HB       ASN  92  78.777  -6.371 -25.092
  759   2HB   ASN  92          1HB       ASN  92  78.360  -5.770 -23.490
  760   1HD2  ASN  92          1HD2      ASN  92  76.479  -5.496 -25.570
  761   2HD2  ASN  92          2HD2      ASN  92  76.343  -3.860 -26.000
  Start of MODEL   22
    1   1H    MET   1          1H        MET   1  82.367  13.728   1.265
    2   2H    MET   1          2H        MET   1  82.499  15.375   0.872
    3   3H    MET   1          3H        MET   1  83.872  14.504   1.366
    4    HA   MET   1           HA       MET   1  84.054  14.705  -0.975
    5   1HB   MET   1          2HB       MET   1  83.040  12.069   0.100
    6   2HB   MET   1          1HB       MET   1  83.675  12.216  -1.539
    7   1HG   MET   1          2HG       MET   1  85.773  13.177  -0.598
    8   2HG   MET   1          1HG       MET   1  85.145  12.884   1.024
    9   1HE   MET   1          1HE       MET   1  83.912  10.905   1.495
   10   2HE   MET   1          2HE       MET   1  84.918   9.478   1.723
   11   3HE   MET   1          3HE       MET   1  83.762   9.528   0.396
   12    H    ASP   2           H        ASP   2  82.937  13.536  -3.036
   13    HA   ASP   2           HA       ASP   2  80.372  14.908  -3.422
   14   1HB   ASP   2          2HB       ASP   2  82.071  13.072  -5.144
   15   2HB   ASP   2          1HB       ASP   2  80.662  13.957  -5.727
   16    H    VAL   3           H        VAL   3  78.350  13.933  -3.479
   17    HA   VAL   3           HA       VAL   3  78.228  10.963  -3.264
   18    HB   VAL   3           HB       VAL   3  77.919  12.396  -1.127
   19   1HG1  VAL   3          1HG1      VAL   3  76.372  14.068  -2.230
   20   2HG1  VAL   3          2HG1      VAL   3  75.767  13.390  -0.718
   21   3HG1  VAL   3          3HG1      VAL   3  75.142  12.798  -2.261
   22   1HG2  VAL   3          1HG2      VAL   3  77.308  10.005  -1.327
   23   2HG2  VAL   3          2HG2      VAL   3  75.720  10.474  -1.933
   24   3HG2  VAL   3          3HG2      VAL   3  76.189  10.879  -0.281
   25    H    LEU   4           H        LEU   4  76.774  10.049  -4.686
   26    HA   LEU   4           HA       LEU   4  75.434  11.793  -6.629
   27   1HB   LEU   4          2HB       LEU   4  75.364   8.774  -6.314
   28   2HB   LEU   4          1HB       LEU   4  74.992   9.686  -7.772
   29    HG   LEU   4           HG       LEU   4  77.702   9.412  -6.426
   30   1HD1  LEU   4          1HD1      LEU   4  78.206   8.613  -8.857
   31   2HD1  LEU   4          2HD1      LEU   4  76.458   8.407  -8.972
   32   3HD1  LEU   4          3HD1      LEU   4  77.373   7.516  -7.756
   33   1HD2  LEU   4          1HD2      LEU   4  77.798  11.632  -7.190
   34   2HD2  LEU   4          2HD2      LEU   4  76.733  11.307  -8.561
   35   3HD2  LEU   4          3HD2      LEU   4  78.401  10.735  -8.587
   36    H    ALA   5           H        ALA   5  74.552  10.126  -3.699
   37    HA   ALA   5           HA       ALA   5  71.969  11.394  -3.618
   38   1HB   ALA   5          1HB       ALA   5  71.610   8.446  -3.697
   39   2HB   ALA   5          2HB       ALA   5  71.990   9.207  -5.241
   40   3HB   ALA   5          3HB       ALA   5  70.567   9.718  -4.333
   41    H    LYS   6           H        LYS   6  70.955  11.020  -1.529
   42    HA   LYS   6           HA       LYS   6  72.641   9.492   0.434
   43   1HB   LYS   6          2HB       LYS   6  73.122  11.948   0.324
   44   2HB   LYS   6          1HB       LYS   6  71.435  12.266   0.728
   45   1HG   LYS   6          2HG       LYS   6  71.699  11.072   2.855
   46   2HG   LYS   6          1HG       LYS   6  73.374  10.702   2.453
   47   1HD   LYS   6          2HD       LYS   6  73.590  13.301   2.148
   48   2HD   LYS   6          1HD       LYS   6  72.145  13.347   3.162
   49   1HE   LYS   6          2HE       LYS   6  73.447  11.765   4.753
   50   2HE   LYS   6          1HE       LYS   6  74.887  12.285   3.853
   51   1HZ   LYS   6          1HZ       LYS   6  74.389  13.756   5.750
   52   2HZ   LYS   6          2HZ       LYS   6  72.881  14.123   5.056
   53   3HZ   LYS   6          3HZ       LYS   6  74.316  14.573   4.266
   54    H    PHE   7           H        PHE   7  71.362   8.084   1.598
   55    HA   PHE   7           HA       PHE   7  68.615   8.901   2.369
   56   1HB   PHE   7          2HB       PHE   7  67.648   6.889   1.329
   57   2HB   PHE   7          1HB       PHE   7  68.465   7.879   0.125
   58    HD1  PHE   7           HD1      PHE   7  68.187   4.587   1.561
   59    HD2  PHE   7           HD2      PHE   7  70.975   7.276  -0.432
   60    HE1  PHE   7           HE1      PHE   7  69.622   2.625   0.917
   61    HE2  PHE   7           HE2      PHE   7  72.412   5.311  -1.068
   62    HZ   PHE   7           HZ       PHE   7  71.734   2.983  -0.388
   63    H    HIS   8           H        HIS   8  67.672   7.368   3.974
   64    HA   HIS   8           HA       HIS   8  69.831   6.067   5.610
   65   1HB   HIS   8          2HB       HIS   8  67.162   7.334   6.321
   66   2HB   HIS   8          1HB       HIS   8  68.262   6.599   7.488
   67    HD1  HIS   8           HD1      HIS   8  67.876   9.591   5.255
   68    HD2  HIS   8           HD2      HIS   8  70.614   8.114   8.030
   69    HE1  HIS   8           HE1      HIS   8  69.489  11.481   5.743
   70    H    THR   9           H        THR   9  69.550   3.937   6.216
   71    HA   THR   9           HA       THR   9  66.909   2.629   5.980
   72    HB   THR   9           HB       THR   9  68.014   2.565   3.716
   73    HG1  THR   9           HG1      THR   9  66.754   0.887   3.818
   74   1HG2  THR   9          1HG2      THR   9  70.357   2.451   4.440
   75   2HG2  THR   9          2HG2      THR   9  69.967   1.066   3.421
   76   3HG2  THR   9          3HG2      THR   9  70.065   0.872   5.172
   77    H    THR  10           H        THR  10  66.992   0.402   6.982
   78    HA   THR  10           HA       THR  10  69.221   0.214   8.970
   79    HB   THR  10           HB       THR  10  66.804   0.614   9.733
   80    HG1  THR  10           HG1      THR  10  67.482  -0.252  11.487
   81   1HG2  THR  10          1HG2      THR  10  66.190  -1.488   8.050
   82   2HG2  THR  10          2HG2      THR  10  65.147  -0.879   9.336
   83   3HG2  THR  10          3HG2      THR  10  66.212  -2.256   9.640
   84    H    VAL  11           H        VAL  11  69.992  -1.966   9.464
   85    HA   VAL  11           HA       VAL  11  70.356  -3.542   7.036
   86    HB   VAL  11           HB       VAL  11  71.201  -4.016   9.919
   87   1HG1  VAL  11          1HG1      VAL  11  72.245  -5.153   7.303
   88   2HG1  VAL  11          2HG1      VAL  11  71.364  -6.046   8.542
   89   3HG1  VAL  11          3HG1      VAL  11  72.976  -5.416   8.886
   90   1HG2  VAL  11          1HG2      VAL  11  73.425  -3.176   8.527
   91   2HG2  VAL  11          2HG2      VAL  11  72.421  -2.132   9.531
   92   3HG2  VAL  11          3HG2      VAL  11  72.153  -2.203   7.788
   93    H    HIS  12           H        HIS  12  69.359  -5.428   6.490
   94    HA   HIS  12           HA       HIS  12  67.514  -6.702   8.481
   95   1HB   HIS  12          2HB       HIS  12  67.377  -6.244   5.520
   96   2HB   HIS  12          1HB       HIS  12  66.558  -7.650   6.208
   97    HD1  HIS  12           HD1      HIS  12  66.833  -3.933   7.089
   98    HD2  HIS  12           HD2      HIS  12  64.004  -6.991   6.985
   99    HE1  HIS  12           HE1      HIS  12  64.645  -2.908   7.844
  100    H    ARG  13           H        ARG  13  67.266  -9.114   7.958
  101    HA   ARG  13           HA       ARG  13  69.552 -10.544   8.543
  102   1HB   ARG  13          2HB       ARG  13  67.115 -11.271   6.907
  103   2HB   ARG  13          1HB       ARG  13  68.266 -12.480   7.490
  104   1HG   ARG  13          2HG       ARG  13  67.888 -11.637   9.819
  105   2HG   ARG  13          1HG       ARG  13  66.644 -10.560   9.188
  106   1HD   ARG  13          2HD       ARG  13  66.614 -13.591   8.940
  107   2HD   ARG  13          1HD       ARG  13  65.623 -12.639  10.062
  108    HE   ARG  13           HE       ARG  13  65.215 -12.851   7.171
  109   1HH1  ARG  13          1HH1      ARG  13  64.673 -10.882  10.024
  110   2HH1  ARG  13          2HH1      ARG  13  63.324 -10.064   9.317
  111   1HH2  ARG  13          1HH2      ARG  13  63.466 -11.763   6.311
  112   2HH2  ARG  13          2HH2      ARG  13  62.647 -10.555   7.243
  113    H    ILE  14           H        ILE  14  71.067 -11.806   7.355
  114    HA   ILE  14           HA       ILE  14  72.606 -12.272   5.642
  115    HB   ILE  14           HB       ILE  14  70.367 -11.347   3.810
  116   1HG1  ILE  14          2HG1      ILE  14  70.997 -14.179   4.678
  117   2HG1  ILE  14          1HG1      ILE  14  69.776 -13.193   5.484
  118   1HG2  ILE  14          1HG2      ILE  14  72.173 -11.573   2.395
  119   2HG2  ILE  14          2HG2      ILE  14  71.628 -13.250   2.437
  120   3HG2  ILE  14          3HG2      ILE  14  72.983 -12.736   3.444
  121   1HD1  ILE  14          1HD1      ILE  14  69.746 -14.388   2.753
  122   2HD1  ILE  14          2HD1      ILE  14  68.994 -12.803   2.947
  123   3HD1  ILE  14          3HD1      ILE  14  68.423 -14.174   3.901
  124    H    GLY  15           H        GLY  15  71.796  -9.197   6.513
  125   1HA   GLY  15          2HA       GLY  15  73.037  -7.213   6.232
  126   2HA   GLY  15          1HA       GLY  15  74.052  -8.063   5.070
  127    H    ARG  16           H        ARG  16  70.663  -8.301   4.436
  128    HA   ARG  16           HA       ARG  16  71.020  -6.840   1.925
  129   1HB   ARG  16          2HB       ARG  16  69.820  -8.989   2.130
  130   2HB   ARG  16          1HB       ARG  16  68.656  -8.241   3.220
  131   1HG   ARG  16          2HG       ARG  16  68.034  -6.648   1.393
  132   2HG   ARG  16          1HG       ARG  16  69.114  -7.527   0.308
  133   1HD   ARG  16          2HD       ARG  16  67.813  -9.611   0.726
  134   2HD   ARG  16          1HD       ARG  16  66.693  -8.682   1.742
  135    HE   ARG  16           HE       ARG  16  66.730  -7.200  -0.555
  136   1HH1  ARG  16          1HH1      ARG  16  66.263 -10.635   0.002
  137   2HH1  ARG  16          2HH1      ARG  16  65.260 -10.819  -1.392
  138   1HH2  ARG  16          1HH2      ARG  16  65.421  -7.501  -2.339
  139   2HH2  ARG  16          2HH2      ARG  16  64.788  -9.072  -2.701
  140    H    ILE  17           H        ILE  17  70.085  -4.864   1.395
  141    HA   ILE  17           HA       ILE  17  68.203  -3.614   3.341
  142    HB   ILE  17           HB       ILE  17  69.403  -1.462   3.060
  143   1HG1  ILE  17          2HG1      ILE  17  71.559  -3.031   1.621
  144   2HG1  ILE  17          1HG1      ILE  17  70.321  -2.117   0.761
  145   1HG2  ILE  17          1HG2      ILE  17  71.601  -3.337   3.786
  146   2HG2  ILE  17          2HG2      ILE  17  70.099  -3.468   4.701
  147   3HG2  ILE  17          3HG2      ILE  17  70.979  -1.939   4.663
  148   1HD1  ILE  17          1HD1      ILE  17  71.241  -0.100   1.308
  149   2HD1  ILE  17          2HD1      ILE  17  72.704  -1.054   1.554
  150   3HD1  ILE  17          3HD1      ILE  17  71.684  -0.635   2.931
  151    H    ILE  18           H        ILE  18  66.710  -2.118   2.292
  152    HA   ILE  18           HA       ILE  18  66.670  -2.338  -0.705
  153    HB   ILE  18           HB       ILE  18  64.347  -1.995   1.223
  154   1HG1  ILE  18          2HG1      ILE  18  65.343  -4.227   1.491
  155   2HG1  ILE  18          1HG1      ILE  18  63.796  -4.353   0.658
  156   1HG2  ILE  18          1HG2      ILE  18  64.617  -2.206  -1.762
  157   2HG2  ILE  18          2HG2      ILE  18  63.601  -1.123  -0.804
  158   3HG2  ILE  18          3HG2      ILE  18  63.161  -2.825  -0.978
  159   1HD1  ILE  18          1HD1      ILE  18  65.125  -5.712  -0.683
  160   2HD1  ILE  18          2HD1      ILE  18  66.568  -4.732  -0.420
  161   3HD1  ILE  18          3HD1      ILE  18  65.303  -4.164  -1.510
  162    H    ILE  19           H        ILE  19  66.859  -0.403  -1.743
  163    HA   ILE  19           HA       ILE  19  66.840   2.126  -0.227
  164    HB   ILE  19           HB       ILE  19  67.096   1.505  -3.205
  165   1HG1  ILE  19          2HG1      ILE  19  69.158   1.897  -0.993
  166   2HG1  ILE  19          1HG1      ILE  19  68.860   0.416  -1.892
  167   1HG2  ILE  19          1HG2      ILE  19  66.421   3.871  -2.523
  168   2HG2  ILE  19          2HG2      ILE  19  67.932   3.757  -3.426
  169   3HG2  ILE  19          3HG2      ILE  19  67.965   3.986  -1.678
  170   1HD1  ILE  19          1HD1      ILE  19  70.408   1.068  -3.387
  171   2HD1  ILE  19          2HD1      ILE  19  70.594   2.614  -2.559
  172   3HD1  ILE  19          3HD1      ILE  19  69.373   2.430  -3.820
  173    HA   PRO  20           HA       PRO  20  62.508   2.984  -1.019
  174   1HB   PRO  20          2HB       PRO  20  62.619   5.723  -1.037
  175   2HB   PRO  20          1HB       PRO  20  62.653   4.774   0.460
  176   1HG   PRO  20          2HG       PRO  20  64.957   5.869  -1.117
  177   2HG   PRO  20          1HG       PRO  20  64.638   6.013   0.623
  178   1HD   PRO  20          2HD       PRO  20  66.350   4.194  -0.229
  179   2HD   PRO  20          1HD       PRO  20  65.160   3.752   1.025
  180    H    ALA  21           H        ALA  21  61.349   3.387  -2.913
  181    HA   ALA  21           HA       ALA  21  62.656   3.339  -5.420
  182   1HB   ALA  21          1HB       ALA  21  60.475   3.398  -6.278
  183   2HB   ALA  21          2HB       ALA  21  59.923   4.548  -5.060
  184   3HB   ALA  21          3HB       ALA  21  60.191   2.860  -4.624
  185    H    GLY  22           H        GLY  22  61.758   6.067  -3.386
  186   1HA   GLY  22          2HA       GLY  22  61.836   8.125  -5.398
  187   2HA   GLY  22          1HA       GLY  22  62.076   8.385  -3.668
  188    H    THR  23           H        THR  23  64.362   6.825  -3.232
  189    HA   THR  23           HA       THR  23  66.440   8.606  -4.167
  190    HB   THR  23           HB       THR  23  66.601   5.863  -2.873
  191    HG1  THR  23           HG1      THR  23  66.537   8.472  -1.760
  192   1HG2  THR  23          1HG2      THR  23  68.832   6.228  -2.547
  193   2HG2  THR  23          2HG2      THR  23  68.622   7.969  -2.355
  194   3HG2  THR  23          3HG2      THR  23  68.660   7.258  -3.969
  195    H    ARG  24           H        ARG  24  65.406   5.330  -5.123
  196    HA   ARG  24           HA       ARG  24  67.490   4.690  -6.986
  197   1HB   ARG  24          2HB       ARG  24  64.553   4.115  -7.456
  198   2HB   ARG  24          1HB       ARG  24  65.933   3.136  -7.931
  199   1HG   ARG  24          2HG       ARG  24  66.346   3.013  -5.322
  200   2HG   ARG  24          1HG       ARG  24  64.631   3.402  -5.254
  201   1HD   ARG  24          2HD       ARG  24  64.489   1.477  -7.101
  202   2HD   ARG  24          1HD       ARG  24  65.963   0.940  -6.265
  203    HE   ARG  24           HE       ARG  24  64.352   1.501  -4.159
  204   1HH1  ARG  24          1HH1      ARG  24  63.724  -0.347  -7.075
  205   2HH1  ARG  24          2HH1      ARG  24  62.538  -1.333  -6.298
  206   1HH2  ARG  24          1HH2      ARG  24  62.835   0.199  -3.215
  207   2HH2  ARG  24          2HH2      ARG  24  62.035  -1.030  -4.136
  208    H    LYS  25           H        LYS  25  64.520   6.577  -7.349
  209    HA   LYS  25           HA       LYS  25  64.654   7.036 -10.168
  210   1HB   LYS  25          2HB       LYS  25  62.674   7.349  -8.695
  211   2HB   LYS  25          1HB       LYS  25  63.474   8.721  -7.929
  212   1HG   LYS  25          2HG       LYS  25  63.562   9.877 -10.112
  213   2HG   LYS  25          1HG       LYS  25  62.725   8.516 -10.857
  214   1HD   LYS  25          2HD       LYS  25  60.833   8.876  -9.250
  215   2HD   LYS  25          1HD       LYS  25  61.653  10.329  -8.679
  216   1HE   LYS  25          2HE       LYS  25  60.387  11.340 -10.315
  217   2HE   LYS  25          1HE       LYS  25  61.686  10.765 -11.378
  218   1HZ   LYS  25          1HZ       LYS  25  59.542   9.996 -12.180
  219   2HZ   LYS  25          2HZ       LYS  25  59.213   9.269 -10.679
  220   3HZ   LYS  25          3HZ       LYS  25  60.475   8.681 -11.653
  221    H    PHE  26           H        PHE  26  65.674   9.094  -7.436
  222    HA   PHE  26           HA       PHE  26  66.719  11.287  -8.910
  223   1HB   PHE  26          2HB       PHE  26  66.306  11.168  -6.457
  224   2HB   PHE  26          1HB       PHE  26  67.687  10.085  -6.294
  225    HD1  PHE  26           HD1      PHE  26  69.883  10.947  -6.001
  226    HD2  PHE  26           HD2      PHE  26  66.723  13.510  -7.561
  227    HE1  PHE  26           HE1      PHE  26  71.428  12.930  -5.880
  228    HE2  PHE  26           HE2      PHE  26  68.268  15.491  -7.438
  229    HZ   PHE  26           HZ       PHE  26  70.621  15.201  -6.597
  230    H    TYR  27           H        TYR  27  68.264   8.238  -7.961
  231    HA   TYR  27           HA       TYR  27  70.877   9.039  -9.067
  232   1HB   TYR  27          2HB       TYR  27  70.522   7.733  -6.979
  233   2HB   TYR  27          1HB       TYR  27  69.830   6.430  -7.927
  234    HD1  TYR  27           HD1      TYR  27  72.863   7.866  -6.600
  235    HD2  TYR  27           HD2      TYR  27  71.331   5.379  -9.828
  236    HE1  TYR  27           HE1      TYR  27  75.157   6.902  -6.957
  237    HE2  TYR  27           HE2      TYR  27  73.622   4.414 -10.176
  238    HH   TYR  27           HH       TYR  27  76.042   4.571  -7.977
  239    H    GLY  28           H        GLY  28  68.027   7.477 -10.315
  240   1HA   GLY  28          2HA       GLY  28  67.624   6.693 -12.494
  241   2HA   GLY  28          1HA       GLY  28  69.292   7.102 -12.899
  242    H    ILE  29           H        ILE  29  68.093   4.898 -10.359
  243    HA   ILE  29           HA       ILE  29  70.032   2.859 -11.225
  244    HB   ILE  29           HB       ILE  29  67.977   2.932  -8.982
  245   1HG1  ILE  29          2HG1      ILE  29  70.959   3.495  -8.954
  246   2HG1  ILE  29          1HG1      ILE  29  69.700   4.724  -8.902
  247   1HG2  ILE  29          1HG2      ILE  29  70.013   0.943  -9.848
  248   2HG2  ILE  29          2HG2      ILE  29  68.501   0.698  -8.977
  249   3HG2  ILE  29          3HG2      ILE  29  69.931   1.267  -8.117
  250   1HD1  ILE  29          1HD1      ILE  29  69.823   4.522  -6.651
  251   2HD1  ILE  29          2HD1      ILE  29  70.711   2.999  -6.755
  252   3HD1  ILE  29          3HD1      ILE  29  68.949   3.004  -6.866
  253    H    GLU  30           H        GLU  30  69.553   1.155 -12.484
  254    HA   GLU  30           HA       GLU  30  66.743   0.132 -12.560
  255   1HB   GLU  30          2HB       GLU  30  68.703   0.406 -14.869
  256   2HB   GLU  30          1HB       GLU  30  67.117  -0.360 -14.973
  257   1HG   GLU  30          2HG       GLU  30  66.064   1.781 -14.266
  258   2HG   GLU  30          1HG       GLU  30  67.654   2.538 -14.256
  259    H    GLN  31           H        GLN  31  66.698  -2.233 -12.966
  260    HA   GLN  31           HA       GLN  31  68.578  -3.731 -11.458
  261   1HB   GLN  31          2HB       GLN  31  66.681  -4.495 -13.697
  262   2HB   GLN  31          1HB       GLN  31  67.503  -5.675 -12.676
  263   1HG   GLN  31          2HG       GLN  31  66.455  -4.740 -10.680
  264   2HG   GLN  31          1HG       GLN  31  65.704  -3.465 -11.639
  265   1HE2  GLN  31          1HE2      GLN  31  63.817  -4.802 -10.348
  266   2HE2  GLN  31          2HE2      GLN  31  63.049  -5.979 -11.299
  267    H    GLY  32           H        GLY  32  70.498  -4.754 -11.976
  268   1HA   GLY  32          2HA       GLY  32  72.095  -5.773 -13.452
  269   2HA   GLY  32          1HA       GLY  32  71.316  -4.973 -14.813
  270    H    ASP  33           H        ASP  33  71.428  -2.397 -12.940
  271    HA   ASP  33           HA       ASP  33  73.947  -1.390 -14.049
  272   1HB   ASP  33          2HB       ASP  33  71.875  -0.297 -12.122
  273   2HB   ASP  33          1HB       ASP  33  73.230   0.647 -12.738
  274    H    PHE  34           H        PHE  34  75.751  -0.620 -12.729
  275    HA   PHE  34           HA       PHE  34  75.949  -1.954 -10.048
  276   1HB   PHE  34          2HB       PHE  34  77.983  -1.154 -12.147
  277   2HB   PHE  34          1HB       PHE  34  78.442  -1.637 -10.512
  278    HD1  PHE  34           HD1      PHE  34  76.881  -2.776 -13.708
  279    HD2  PHE  34           HD2      PHE  34  78.271  -3.953  -9.750
  280    HE1  PHE  34           HE1      PHE  34  76.704  -5.197 -14.366
  281    HE2  PHE  34           HE2      PHE  34  78.092  -6.375 -10.409
  282    HZ   PHE  34           HZ       PHE  34  77.309  -6.997 -12.716
  283    H    VAL  35           H        VAL  35  76.341  -0.616  -8.298
  284    HA   VAL  35           HA       VAL  35  77.060   2.234  -8.854
  285    HB   VAL  35           HB       VAL  35  75.461   2.880  -7.059
  286   1HG1  VAL  35          1HG1      VAL  35  73.436   2.551  -8.357
  287   2HG1  VAL  35          2HG1      VAL  35  74.137   1.158  -9.179
  288   3HG1  VAL  35          3HG1      VAL  35  74.779   2.773  -9.479
  289   1HG2  VAL  35          1HG2      VAL  35  74.846  -0.091  -7.083
  290   2HG2  VAL  35          2HG2      VAL  35  73.781   1.118  -6.359
  291   3HG2  VAL  35          3HG2      VAL  35  75.408   0.872  -5.715
  292    H    GLU  36           H        GLU  36  78.308   3.206  -7.114
  293    HA   GLU  36           HA       GLU  36  79.598   1.190  -5.301
  294   1HB   GLU  36          2HB       GLU  36  80.985   2.216  -7.137
  295   2HB   GLU  36          1HB       GLU  36  80.676   3.801  -6.427
  296   1HG   GLU  36          2HG       GLU  36  81.690   3.000  -4.290
  297   2HG   GLU  36          1HG       GLU  36  82.080   1.475  -5.079
  298    H    ILE  37           H        ILE  37  79.106   1.531  -3.198
  299    HA   ILE  37           HA       ILE  37  78.196   4.261  -2.379
  300    HB   ILE  37           HB       ILE  37  76.362   2.792  -3.131
  301   1HG1  ILE  37          2HG1      ILE  37  76.163   2.844  -0.130
  302   2HG1  ILE  37          1HG1      ILE  37  76.238   4.353  -1.038
  303   1HG2  ILE  37          1HG2      ILE  37  75.847   0.725  -1.848
  304   2HG2  ILE  37          2HG2      ILE  37  77.356   0.926  -0.955
  305   3HG2  ILE  37          3HG2      ILE  37  77.393   0.619  -2.693
  306   1HD1  ILE  37          1HD1      ILE  37  74.015   4.153  -1.368
  307   2HD1  ILE  37          2HD1      ILE  37  74.008   2.513  -0.725
  308   3HD1  ILE  37          3HD1      ILE  37  74.363   2.791  -2.430
  309    H    LYS  38           H        LYS  38  78.167   4.571  -0.034
  310    HA   LYS  38           HA       LYS  38  79.844   2.645   1.525
  311   1HB   LYS  38          2HB       LYS  38  81.073   4.676   0.638
  312   2HB   LYS  38          1HB       LYS  38  80.007   5.670   1.638
  313   1HG   LYS  38          2HG       LYS  38  80.763   4.550   3.653
  314   2HG   LYS  38          1HG       LYS  38  81.714   3.408   2.703
  315   1HD   LYS  38          2HD       LYS  38  83.173   5.152   3.616
  316   2HD   LYS  38          1HD       LYS  38  83.098   5.294   1.860
  317   1HE   LYS  38          2HE       LYS  38  81.931   7.284   1.939
  318   2HE   LYS  38          1HE       LYS  38  81.095   6.853   3.444
  319   1HZ   LYS  38          1HZ       LYS  38  83.953   7.608   3.142
  320   2HZ   LYS  38          2HZ       LYS  38  83.281   6.990   4.575
  321   3HZ   LYS  38          3HZ       LYS  38  82.753   8.482   3.959
  322    H    ILE  39           H        ILE  39  79.249   2.451   3.719
  323    HA   ILE  39           HA       ILE  39  76.781   3.943   4.555
  324    HB   ILE  39           HB       ILE  39  76.408   1.943   6.025
  325   1HG1  ILE  39          2HG1      ILE  39  78.581   0.592   4.417
  326   2HG1  ILE  39          1HG1      ILE  39  78.919   1.345   5.976
  327   1HG2  ILE  39          1HG2      ILE  39  76.238   0.334   3.863
  328   2HG2  ILE  39          2HG2      ILE  39  76.455   1.890   3.061
  329   3HG2  ILE  39          3HG2      ILE  39  75.109   1.652   4.179
  330   1HD1  ILE  39          1HD1      ILE  39  77.357  -1.110   5.355
  331   2HD1  ILE  39          2HD1      ILE  39  76.745  -0.090   6.658
  332   3HD1  ILE  39          3HD1      ILE  39  78.380  -0.747   6.745
  333    H    VAL  40           H        VAL  40  76.748   4.775   6.670
  334    HA   VAL  40           HA       VAL  40  79.233   4.541   8.306
  335    HB   VAL  40           HB       VAL  40  77.813   7.106   7.498
  336   1HG1  VAL  40          1HG1      VAL  40  78.736   7.270   9.755
  337   2HG1  VAL  40          2HG1      VAL  40  79.748   8.197   8.648
  338   3HG1  VAL  40          3HG1      VAL  40  80.275   6.609   9.205
  339   1HG2  VAL  40          1HG2      VAL  40  80.301   7.439   6.577
  340   2HG2  VAL  40          2HG2      VAL  40  79.074   6.621   5.609
  341   3HG2  VAL  40          3HG2      VAL  40  80.259   5.677   6.512
  342    H    LYS  41           H        LYS  41  78.625   3.992  10.330
  343    HA   LYS  41           HA       LYS  41  76.084   5.098  11.460
  344   1HB   LYS  41          2HB       LYS  41  75.841   2.716  10.733
  345   2HB   LYS  41          1HB       LYS  41  77.175   2.285  11.804
  346   1HG   LYS  41          2HG       LYS  41  75.856   3.301  13.706
  347   2HG   LYS  41          1HG       LYS  41  74.492   3.446  12.596
  348   1HD   LYS  41          2HD       LYS  41  74.523   1.016  12.217
  349   2HD   LYS  41          1HD       LYS  41  75.913   0.858  13.293
  350   1HE   LYS  41          2HE       LYS  41  74.170   2.234  14.902
  351   2HE   LYS  41          1HE       LYS  41  73.058   1.215  13.969
  352   1HZ   LYS  41          1HZ       LYS  41  74.055   0.122  15.976
  353   2HZ   LYS  41          2HZ       LYS  41  75.560   0.194  15.192
  354   3HZ   LYS  41          3HZ       LYS  41  74.290  -0.712  14.519
  355    H    TYR  42           H        TYR  42  76.250   5.589  13.706
  356    HA   TYR  42           HA       TYR  42  79.052   5.657  14.748
  357   1HB   TYR  42          2HB       TYR  42  77.540   7.712  14.467
  358   2HB   TYR  42          1HB       TYR  42  76.606   7.076  15.823
  359    HD1  TYR  42           HD1      TYR  42  80.125   7.976  14.798
  360    HD2  TYR  42           HD2      TYR  42  77.291   7.496  18.071
  361    HE1  TYR  42           HE1      TYR  42  81.818   8.921  16.398
  362    HE2  TYR  42           HE2      TYR  42  78.983   8.443  19.674
  363    HH   TYR  42           HH       TYR  42  82.299   8.871  18.831
  364    H    GLU  43           H        GLU  43  79.612   4.316  16.419
  365    HA   GLU  43           HA       GLU  43  77.443   3.215  18.169
  366   1HB   GLU  43          2HB       GLU  43  79.777   1.755  16.884
  367   2HB   GLU  43          1HB       GLU  43  78.646   1.034  18.028
  368   1HG   GLU  43          2HG       GLU  43  76.776   1.557  16.474
  369   2HG   GLU  43          1HG       GLU  43  77.939   2.201  15.319
  370    H    GLY  44           H        GLY  44  77.959   3.381  20.323
  371   1HA   GLY  44          2HA       GLY  44  79.179   3.872  22.265
  372   2HA   GLY  44          1HA       GLY  44  80.565   3.140  21.457
  373    H    GLU  45           H        GLU  45  82.227   4.561  21.526
  374    HA   GLU  45           HA       GLU  45  81.669   7.466  21.114
  375   1HB   GLU  45          2HB       GLU  45  83.810   7.806  22.243
  376   2HB   GLU  45          1HB       GLU  45  82.808   6.722  23.201
  377   1HG   GLU  45          2HG       GLU  45  84.030   4.776  22.290
  378   2HG   GLU  45          1HG       GLU  45  85.023   5.855  21.311
  379    H    GLU  46           H        GLU  46  82.371   4.964  19.126
  380    HA   GLU  46           HA       GLU  46  84.214   6.621  17.448
  381   1HB   GLU  46          2HB       GLU  46  85.316   4.481  16.820
  382   2HB   GLU  46          1HB       GLU  46  85.421   4.795  18.551
  383   1HG   GLU  46          2HG       GLU  46  83.450   3.313  18.911
  384   2HG   GLU  46          1HG       GLU  46  83.432   2.954  17.185
  385    HA   PRO  47           HA       PRO  47  81.062   5.715  14.380
  386   1HB   PRO  47          2HB       PRO  47  82.733   6.674  12.242
  387   2HB   PRO  47          1HB       PRO  47  81.378   7.505  13.021
  388   1HG   PRO  47          2HG       PRO  47  84.061   8.209  13.203
  389   2HG   PRO  47          1HG       PRO  47  82.749   8.796  14.231
  390   1HD   PRO  47          2HD       PRO  47  84.844   6.806  14.815
  391   2HD   PRO  47          1HD       PRO  47  83.912   7.839  15.918
  392    H    LYS  48           H        LYS  48  80.724   3.971  12.997
  393    HA   LYS  48           HA       LYS  48  83.098   2.322  12.197
  394   1HB   LYS  48          2HB       LYS  48  80.188   1.573  12.640
  395   2HB   LYS  48          1HB       LYS  48  81.465   0.459  12.157
  396   1HG   LYS  48          2HG       LYS  48  81.527   2.093  14.706
  397   2HG   LYS  48          1HG       LYS  48  80.983   0.417  14.621
  398   1HD   LYS  48          2HD       LYS  48  83.223  -0.146  13.573
  399   2HD   LYS  48          1HD       LYS  48  83.740   1.489  13.984
  400   1HE   LYS  48          2HE       LYS  48  84.460   0.153  15.827
  401   2HE   LYS  48          1HE       LYS  48  82.959   0.909  16.398
  402   1HZ   LYS  48          1HZ       LYS  48  81.721  -1.007  15.822
  403   2HZ   LYS  48          2HZ       LYS  48  83.070  -1.567  16.690
  404   3HZ   LYS  48          3HZ       LYS  48  83.028  -1.706  14.997
  405    H    GLU  49           H        GLU  49  83.370   2.029   9.994
  406    HA   GLU  49           HA       GLU  49  81.296   3.132   8.166
  407   1HB   GLU  49          2HB       GLU  49  83.079   4.716   8.710
  408   2HB   GLU  49          1HB       GLU  49  84.306   3.508   8.328
  409   1HG   GLU  49          2HG       GLU  49  83.481   3.432   6.016
  410   2HG   GLU  49          1HG       GLU  49  82.314   4.692   6.393
  411    H    GLY  50           H        GLY  50  81.408   2.293   5.975
  412   1HA   GLY  50          2HA       GLY  50  83.285   0.148   5.318
  413   2HA   GLY  50          1HA       GLY  50  81.614  -0.391   5.484
  414    H    THR  51           H        THR  51  83.604   0.130   3.114
  415    HA   THR  51           HA       THR  51  81.552   1.482   1.383
  416    HB   THR  51           HB       THR  51  84.531   1.543   0.879
  417    HG1  THR  51           HG1      THR  51  84.742   3.238   2.182
  418   1HG2  THR  51          1HG2      THR  51  83.998   2.998  -0.772
  419   2HG2  THR  51          2HG2      THR  51  82.853   3.868   0.247
  420   3HG2  THR  51          3HG2      THR  51  82.349   2.397  -0.591
  421    H    PHE  52           H        PHE  52  81.043   0.330  -0.488
  422    HA   PHE  52           HA       PHE  52  82.883  -1.723  -1.517
  423   1HB   PHE  52          2HB       PHE  52  81.463  -3.607  -1.059
  424   2HB   PHE  52          1HB       PHE  52  81.599  -2.710   0.448
  425    HD1  PHE  52           HD1      PHE  52  79.346  -4.203  -1.900
  426    HD2  PHE  52           HD2      PHE  52  79.684  -0.895   0.914
  427    HE1  PHE  52           HE1      PHE  52  76.843  -4.006  -1.835
  428    HE2  PHE  52           HE2      PHE  52  77.175  -0.699   0.981
  429    HZ   PHE  52           HZ       PHE  52  75.756  -2.255  -0.401
  430    H    THR  53           H        THR  53  81.768  -2.897  -3.448
  431    HA   THR  53           HA       THR  53  80.058  -0.951  -4.962
  432    HB   THR  53           HB       THR  53  81.820  -3.234  -5.919
  433    HG1  THR  53           HG1      THR  53  82.226  -0.433  -6.054
  434   1HG2  THR  53          1HG2      THR  53  81.524  -1.906  -8.118
  435   2HG2  THR  53          2HG2      THR  53  80.151  -1.146  -7.315
  436   3HG2  THR  53          3HG2      THR  53  80.166  -2.891  -7.573
  437    H    ALA  54           H        ALA  54  78.066  -1.697  -5.717
  438    HA   ALA  54           HA       ALA  54  77.341  -4.553  -5.235
  439   1HB   ALA  54          1HB       ALA  54  75.868  -3.978  -3.587
  440   2HB   ALA  54          2HB       ALA  54  75.326  -2.545  -4.459
  441   3HB   ALA  54          3HB       ALA  54  76.798  -2.484  -3.493
  442    H    ARG  55           H        ARG  55  75.730  -5.337  -6.622
  443    HA   ARG  55           HA       ARG  55  74.999  -3.603  -8.929
  444   1HB   ARG  55          2HB       ARG  55  75.963  -5.971  -9.090
  445   2HB   ARG  55          1HB       ARG  55  74.412  -6.536  -8.469
  446   1HG   ARG  55          2HG       ARG  55  73.281  -5.315 -10.347
  447   2HG   ARG  55          1HG       ARG  55  74.874  -4.945 -11.007
  448   1HD   ARG  55          2HD       ARG  55  75.336  -7.454 -11.008
  449   2HD   ARG  55          1HD       ARG  55  73.610  -7.678 -10.658
  450    HE   ARG  55           HE       ARG  55  74.081  -5.855 -12.888
  451   1HH1  ARG  55          1HH1      ARG  55  73.720  -9.228 -11.983
  452   2HH1  ARG  55          2HH1      ARG  55  73.227  -9.696 -13.572
  453   1HH2  ARG  55          1HH2      ARG  55  73.441  -6.519 -14.917
  454   2HH2  ARG  55          2HH2      ARG  55  73.070  -8.185 -15.213
  455    H    VAL  56           H        VAL  56  72.833  -3.125  -9.390
  456    HA   VAL  56           HA       VAL  56  70.952  -3.178  -7.148
  457    HB   VAL  56           HB       VAL  56  70.781  -2.245 -10.034
  458   1HG1  VAL  56          1HG1      VAL  56  68.642  -1.575  -9.697
  459   2HG1  VAL  56          2HG1      VAL  56  68.981  -1.001  -8.063
  460   3HG1  VAL  56          3HG1      VAL  56  68.629  -2.703  -8.341
  461   1HG2  VAL  56          1HG2      VAL  56  70.895  -0.423  -7.672
  462   2HG2  VAL  56          2HG2      VAL  56  71.552  -0.197  -9.293
  463   3HG2  VAL  56          3HG2      VAL  56  72.383  -1.241  -8.141
  464    H    GLY  57           H        GLY  57  69.545  -4.784  -6.777
  465   1HA   GLY  57          2HA       GLY  57  68.966  -6.748  -8.946
  466   2HA   GLY  57          1HA       GLY  57  68.798  -7.074  -7.221
  467    H    GLU  58           H        GLU  58  66.631  -7.808  -7.980
  468    HA   GLU  58           HA       GLU  58  64.633  -6.062  -9.030
  469   1HB   GLU  58          2HB       GLU  58  64.569  -8.564  -8.860
  470   2HB   GLU  58          1HB       GLU  58  64.325  -8.404  -7.121
  471   1HG   GLU  58          2HG       GLU  58  62.267  -7.078  -7.556
  472   2HG   GLU  58          1HG       GLU  58  62.494  -7.322  -9.284
  473    H    GLN  59           H        GLN  59  62.942  -4.921  -7.933
  474    HA   GLN  59           HA       GLN  59  62.100  -3.439  -6.312
  475   1HB   GLN  59          2HB       GLN  59  63.089  -5.817  -4.736
  476   2HB   GLN  59          1HB       GLN  59  62.263  -4.470  -3.951
  477   1HG   GLN  59          2HG       GLN  59  60.318  -4.775  -5.406
  478   2HG   GLN  59          1HG       GLN  59  61.142  -6.072  -6.268
  479   1HE2  GLN  59          1HE2      GLN  59  61.140  -8.164  -5.321
  480   2HE2  GLN  59          2HE2      GLN  59  60.395  -8.516  -3.838
  481    H    GLY  60           H        GLY  60  65.167  -3.338  -7.034
  482   1HA   GLY  60          2HA       GLY  60  66.771  -1.702  -6.517
  483   2HA   GLY  60          1HA       GLY  60  65.614  -1.040  -5.365
  484    H    SER  61           H        SER  61  66.487  -4.377  -4.969
  485    HA   SER  61           HA       SER  61  67.489  -3.822  -2.294
  486   1HB   SER  61          2HB       SER  61  67.485  -6.223  -2.117
  487   2HB   SER  61          1HB       SER  61  66.093  -5.789  -3.105
  488    HG   SER  61           HG       SER  61  67.055  -7.291  -4.311
  489    H    VAL  62           H        VAL  62  69.602  -4.094  -1.533
  490    HA   VAL  62           HA       VAL  62  71.731  -4.887  -3.450
  491    HB   VAL  62           HB       VAL  62  71.561  -2.425  -3.487
  492   1HG1  VAL  62          1HG1      VAL  62  70.551  -2.173  -1.226
  493   2HG1  VAL  62          2HG1      VAL  62  71.938  -1.110  -1.462
  494   3HG1  VAL  62          3HG1      VAL  62  72.110  -2.584  -0.509
  495   1HG2  VAL  62          1HG2      VAL  62  73.869  -1.938  -3.041
  496   2HG2  VAL  62          2HG2      VAL  62  73.802  -3.625  -3.551
  497   3HG2  VAL  62          3HG2      VAL  62  73.972  -3.228  -1.842
  498    H    ILE  63           H        ILE  63  73.459  -5.979  -2.401
  499    HA   ILE  63           HA       ILE  63  72.937  -6.656   0.472
  500    HB   ILE  63           HB       ILE  63  74.438  -8.147  -1.709
  501   1HG1  ILE  63          2HG1      ILE  63  72.033  -7.981  -2.228
  502   2HG1  ILE  63          1HG1      ILE  63  72.449  -9.629  -1.765
  503   1HG2  ILE  63          1HG2      ILE  63  73.859  -8.682   1.172
  504   2HG2  ILE  63          2HG2      ILE  63  75.290  -9.080   0.221
  505   3HG2  ILE  63          3HG2      ILE  63  73.823 -10.047   0.055
  506   1HD1  ILE  63          1HD1      ILE  63  71.644  -9.163   0.542
  507   2HD1  ILE  63          2HD1      ILE  63  70.368  -8.949  -0.656
  508   3HD1  ILE  63          3HD1      ILE  63  71.175  -7.541   0.032
  509    H    ILE  64           H        ILE  64  74.384  -5.865   1.922
  510    HA   ILE  64           HA       ILE  64  76.988  -4.746   1.118
  511    HB   ILE  64           HB       ILE  64  75.688  -5.282   3.816
  512   1HG1  ILE  64          2HG1      ILE  64  75.926  -2.649   2.342
  513   2HG1  ILE  64          1HG1      ILE  64  74.519  -3.698   2.170
  514   1HG2  ILE  64          1HG2      ILE  64  78.188  -5.003   3.857
  515   2HG2  ILE  64          2HG2      ILE  64  77.323  -3.735   4.726
  516   3HG2  ILE  64          3HG2      ILE  64  77.975  -3.416   3.119
  517   1HD1  ILE  64          1HD1      ILE  64  75.556  -2.461   4.736
  518   2HD1  ILE  64          2HD1      ILE  64  74.255  -3.649   4.666
  519   3HD1  ILE  64          3HD1      ILE  64  74.049  -2.069   3.908
  520    HA   PRO  65           HA       PRO  65  79.211  -8.584   1.520
  521   1HB   PRO  65          2HB       PRO  65  81.679  -7.650   2.244
  522   2HB   PRO  65          1HB       PRO  65  81.043  -7.495   0.591
  523   1HG   PRO  65          2HG       PRO  65  80.958  -5.498   2.825
  524   2HG   PRO  65          1HG       PRO  65  81.518  -5.271   1.155
  525   1HD   PRO  65          2HD       PRO  65  79.086  -4.489   1.834
  526   2HD   PRO  65          1HD       PRO  65  79.335  -5.345   0.290
  527    H    LYS  66           H        LYS  66  79.342 -10.028   3.202
  528    HA   LYS  66           HA       LYS  66  78.573  -9.453   5.860
  529   1HB   LYS  66          2HB       LYS  66  78.593 -11.674   4.731
  530   2HB   LYS  66          1HB       LYS  66  80.354 -11.688   4.834
  531   1HG   LYS  66          2HG       LYS  66  79.623 -12.946   6.714
  532   2HG   LYS  66          1HG       LYS  66  80.047 -11.361   7.364
  533   1HD   LYS  66          2HD       LYS  66  77.697 -10.679   7.319
  534   2HD   LYS  66          1HD       LYS  66  77.243 -12.219   6.585
  535   1HE   LYS  66          2HE       LYS  66  78.151 -13.398   8.609
  536   2HE   LYS  66          1HE       LYS  66  78.422 -11.811   9.357
  537   1HZ   LYS  66          1HZ       LYS  66  76.227 -12.737   9.916
  538   2HZ   LYS  66          2HZ       LYS  66  75.822 -12.753   8.266
  539   3HZ   LYS  66          3HZ       LYS  66  76.106 -11.278   9.059
  540    H    ALA  67           H        ALA  67  81.795  -9.519   4.411
  541    HA   ALA  67           HA       ALA  67  83.398  -9.503   6.757
  542   1HB   ALA  67          1HB       ALA  67  84.218  -9.825   4.453
  543   2HB   ALA  67          2HB       ALA  67  85.095  -8.511   5.237
  544   3HB   ALA  67          3HB       ALA  67  83.822  -8.149   4.072
  545    H    LEU  68           H        LEU  68  81.839  -6.825   5.023
  546    HA   LEU  68           HA       LEU  68  82.996  -4.757   6.729
  547   1HB   LEU  68          2HB       LEU  68  80.749  -4.827   4.695
  548   2HB   LEU  68          1HB       LEU  68  81.288  -3.347   5.488
  549    HG   LEU  68           HG       LEU  68  83.031  -5.177   3.801
  550   1HD1  LEU  68          1HD1      LEU  68  82.755  -3.704   2.046
  551   2HD1  LEU  68          2HD1      LEU  68  82.456  -2.330   3.109
  552   3HD1  LEU  68          3HD1      LEU  68  81.180  -3.511   2.816
  553   1HD2  LEU  68          1HD2      LEU  68  84.460  -4.165   5.413
  554   2HD2  LEU  68          2HD2      LEU  68  83.576  -2.641   5.357
  555   3HD2  LEU  68          3HD2      LEU  68  84.589  -3.123   3.996
  556    H    ARG  69           H        ARG  69  79.963  -6.620   6.703
  557    HA   ARG  69           HA       ARG  69  78.436  -5.074   8.563
  558   1HB   ARG  69          2HB       ARG  69  78.633  -8.102   8.351
  559   2HB   ARG  69          1HB       ARG  69  77.273  -7.193   8.990
  560   1HG   ARG  69          2HG       ARG  69  77.037  -6.143   6.687
  561   2HG   ARG  69          1HG       ARG  69  78.209  -7.336   6.120
  562   1HD   ARG  69          2HD       ARG  69  76.593  -9.020   7.419
  563   2HD   ARG  69          1HD       ARG  69  75.402  -7.758   7.062
  564    HE   ARG  69           HE       ARG  69  76.638  -8.022   4.648
  565   1HH1  ARG  69          1HH1      ARG  69  75.310 -10.417   6.850
  566   2HH1  ARG  69          2HH1      ARG  69  74.999 -11.543   5.578
  567   1HH2  ARG  69          1HH2      ARG  69  76.204  -9.520   3.057
  568   2HH2  ARG  69          2HH2      ARG  69  75.495 -11.046   3.461
  569    H    ASP  70           H        ASP  70  80.737  -7.737   9.097
  570    HA   ASP  70           HA       ASP  70  80.454  -7.813  11.956
  571   1HB   ASP  70          2HB       ASP  70  82.662  -8.740  10.088
  572   2HB   ASP  70          1HB       ASP  70  82.512  -9.230  11.775
  573    H    VAL  71           H        VAL  71  82.965  -6.354   9.861
  574    HA   VAL  71           HA       VAL  71  84.660  -5.364  11.935
  575    HB   VAL  71           HB       VAL  71  84.038  -4.340   9.139
  576   1HG1  VAL  71          1HG1      VAL  71  86.422  -3.773  10.928
  577   2HG1  VAL  71          2HG1      VAL  71  85.179  -2.612  10.462
  578   3HG1  VAL  71          3HG1      VAL  71  86.269  -3.274   9.243
  579   1HG2  VAL  71          1HG2      VAL  71  85.595  -5.857   8.357
  580   2HG2  VAL  71          2HG2      VAL  71  84.990  -6.763   9.743
  581   3HG2  VAL  71          3HG2      VAL  71  86.502  -5.865   9.868
  582    H    ILE  72           H        ILE  72  81.816  -3.932  10.376
  583    HA   ILE  72           HA       ILE  72  82.074  -1.391  11.786
  584    HB   ILE  72           HB       ILE  72  79.855  -2.609  10.101
  585   1HG1  ILE  72          2HG1      ILE  72  82.052  -0.648   9.351
  586   2HG1  ILE  72          1HG1      ILE  72  82.087  -2.372   8.979
  587   1HG2  ILE  72          1HG2      ILE  72  80.341   0.337  10.524
  588   2HG2  ILE  72          2HG2      ILE  72  79.355  -0.570  11.668
  589   3HG2  ILE  72          3HG2      ILE  72  78.876  -0.471   9.976
  590   1HD1  ILE  72          1HD1      ILE  72  79.682  -1.834   7.962
  591   2HD1  ILE  72          2HD1      ILE  72  81.153  -1.580   7.020
  592   3HD1  ILE  72          3HD1      ILE  72  80.374  -0.214   7.821
  593    H    GLY  73           H        GLY  73  80.568  -4.459  12.510
  594   1HA   GLY  73          2HA       GLY  73  79.537  -5.122  14.519
  595   2HA   GLY  73          1HA       GLY  73  79.784  -3.485  15.126
  596    H    ILE  74           H        ILE  74  78.056  -4.300  12.149
  597    HA   ILE  74           HA       ILE  74  75.761  -2.710  13.111
  598    HB   ILE  74           HB       ILE  74  76.345  -4.039  10.443
  599   1HG1  ILE  74          2HG1      ILE  74  78.109  -2.427  11.047
  600   2HG1  ILE  74          1HG1      ILE  74  77.118  -1.788   9.739
  601   1HG2  ILE  74          1HG2      ILE  74  74.060  -3.517  10.415
  602   2HG2  ILE  74          2HG2      ILE  74  74.792  -2.073   9.716
  603   3HG2  ILE  74          3HG2      ILE  74  74.279  -2.072  11.403
  604   1HD1  ILE  74          1HD1      ILE  74  77.480  -0.776  12.475
  605   2HD1  ILE  74          2HD1      ILE  74  75.790  -0.877  11.985
  606   3HD1  ILE  74          3HD1      ILE  74  76.930   0.070  11.029
  607    H    LYS  75           H        LYS  75  73.707  -3.518  13.486
  608    HA   LYS  75           HA       LYS  75  73.358  -6.496  13.343
  609   1HB   LYS  75          2HB       LYS  75  72.311  -4.531  15.411
  610   2HB   LYS  75          1HB       LYS  75  72.181  -6.285  15.482
  611   1HG   LYS  75          2HG       LYS  75  74.776  -4.709  15.528
  612   2HG   LYS  75          1HG       LYS  75  74.016  -5.471  16.924
  613   1HD   LYS  75          2HD       LYS  75  74.946  -6.946  14.445
  614   2HD   LYS  75          1HD       LYS  75  75.842  -6.864  15.960
  615   1HE   LYS  75          2HE       LYS  75  73.568  -7.747  16.999
  616   2HE   LYS  75          1HE       LYS  75  73.303  -8.341  15.348
  617   1HZ   LYS  75          1HZ       LYS  75  75.835  -8.745  16.842
  618   2HZ   LYS  75          2HZ       LYS  75  75.375  -9.465  15.373
  619   3HZ   LYS  75          3HZ       LYS  75  74.584  -9.891  16.817
  620    HA   PRO  76           HA       PRO  76  69.552  -5.907  11.184
  621   1HB   PRO  76          2HB       PRO  76  67.803  -7.521  12.639
  622   2HB   PRO  76          1HB       PRO  76  68.881  -8.087  11.350
  623   1HG   PRO  76          2HG       PRO  76  69.204  -8.245  14.293
  624   2HG   PRO  76          1HG       PRO  76  69.720  -9.377  13.033
  625   1HD   PRO  76          2HD       PRO  76  71.437  -7.724  14.310
  626   2HD   PRO  76          1HD       PRO  76  71.671  -8.238  12.624
  627    H    GLY  77           H        GLY  77  68.017  -4.304  11.290
  628   1HA   GLY  77          2HA       GLY  77  66.216  -3.073  12.250
  629   2HA   GLY  77          1HA       GLY  77  66.634  -3.736  13.827
  630    H    GLU  78           H        GLU  78  69.511  -2.636  12.505
  631    HA   GLU  78           HA       GLU  78  69.320  -0.119  14.083
  632   1HB   GLU  78          2HB       GLU  78  71.450  -2.048  13.265
  633   2HB   GLU  78          1HB       GLU  78  71.924  -0.378  13.588
  634   1HG   GLU  78          2HG       GLU  78  70.764  -0.499  15.782
  635   2HG   GLU  78          1HG       GLU  78  70.391  -2.194  15.471
  636    H    VAL  79           H        VAL  79  69.511   1.849  13.131
  637    HA   VAL  79           HA       VAL  79  69.338   1.913  10.194
  638    HB   VAL  79           HB       VAL  79  67.729   3.049  11.681
  639   1HG1  VAL  79          1HG1      VAL  79  69.456   5.291  12.422
  640   2HG1  VAL  79          2HG1      VAL  79  70.000   3.777  13.141
  641   3HG1  VAL  79          3HG1      VAL  79  68.356   4.345  13.422
  642   1HG2  VAL  79          1HG2      VAL  79  67.549   5.016  10.396
  643   2HG2  VAL  79          2HG2      VAL  79  68.487   3.943   9.358
  644   3HG2  VAL  79          3HG2      VAL  79  69.297   5.209  10.279
  645    H    ILE  80           H        ILE  80  70.866   2.676   8.848
  646    HA   ILE  80           HA       ILE  80  73.192   4.204   9.951
  647    HB   ILE  80           HB       ILE  80  74.565   3.000   8.256
  648   1HG1  ILE  80          2HG1      ILE  80  72.038   1.397   7.745
  649   2HG1  ILE  80          1HG1      ILE  80  72.690   2.623   6.654
  650   1HG2  ILE  80          1HG2      ILE  80  73.942   2.099  10.649
  651   2HG2  ILE  80          2HG2      ILE  80  74.796   1.051   9.517
  652   3HG2  ILE  80          3HG2      ILE  80  73.056   0.870   9.745
  653   1HD1  ILE  80          1HD1      ILE  80  74.513   0.434   7.578
  654   2HD1  ILE  80          2HD1      ILE  80  74.510   1.321   6.053
  655   3HD1  ILE  80          3HD1      ILE  80  73.313   0.057   6.341
  656    H    GLU  81           H        GLU  81  74.112   5.705   8.350
  657    HA   GLU  81           HA       GLU  81  72.099   6.746   6.407
  658   1HB   GLU  81          2HB       GLU  81  73.088   8.227   8.164
  659   2HB   GLU  81          1HB       GLU  81  74.688   7.911   7.494
  660   1HG   GLU  81          2HG       GLU  81  73.916   8.835   5.310
  661   2HG   GLU  81          1HG       GLU  81  72.372   9.240   6.060
  662    H    VAL  82           H        VAL  82  72.476   6.477   4.259
  663    HA   VAL  82           HA       VAL  82  75.025   5.141   3.467
  664    HB   VAL  82           HB       VAL  82  72.195   5.044   2.362
  665   1HG1  VAL  82          1HG1      VAL  82  73.134   3.029   1.121
  666   2HG1  VAL  82          2HG1      VAL  82  74.739   3.607   1.571
  667   3HG1  VAL  82          3HG1      VAL  82  73.697   4.600   0.552
  668   1HG2  VAL  82          1HG2      VAL  82  72.540   2.592   3.217
  669   2HG2  VAL  82          2HG2      VAL  82  72.144   3.853   4.385
  670   3HG2  VAL  82          3HG2      VAL  82  73.811   3.304   4.212
  671    H    LEU  83           H        LEU  83  76.289   6.143   2.010
  672    HA   LEU  83           HA       LEU  83  75.194   8.448   0.425
  673   1HB   LEU  83          2HB       LEU  83  78.075   7.863   1.218
  674   2HB   LEU  83          1HB       LEU  83  77.443   9.369   0.568
  675    HG   LEU  83           HG       LEU  83  76.736   8.181   3.269
  676   1HD1  LEU  83          1HD1      LEU  83  78.066   9.968   4.200
  677   2HD1  LEU  83          2HD1      LEU  83  78.326  10.672   2.604
  678   3HD1  LEU  83          3HD1      LEU  83  79.059   9.120   3.013
  679   1HD2  LEU  83          1HD2      LEU  83  75.998  10.851   2.032
  680   2HD2  LEU  83          2HD2      LEU  83  75.526  10.275   3.631
  681   3HD2  LEU  83          3HD2      LEU  83  74.908   9.473   2.185
  682    H    LEU  84           H        LEU  84  75.243   8.112  -1.800
  683    HA   LEU  84           HA       LEU  84  76.638   5.774  -2.950
  684   1HB   LEU  84          2HB       LEU  84  74.787   7.941  -3.877
  685   2HB   LEU  84          1HB       LEU  84  75.756   7.081  -5.078
  686    HG   LEU  84           HG       LEU  84  74.320   5.462  -3.017
  687   1HD1  LEU  84          1HD1      LEU  84  72.638   5.719  -5.336
  688   2HD1  LEU  84          2HD1      LEU  84  72.940   7.328  -4.686
  689   3HD1  LEU  84          3HD1      LEU  84  72.251   6.080  -3.655
  690   1HD2  LEU  84          1HD2      LEU  84  75.416   5.186  -5.781
  691   2HD2  LEU  84          2HD2      LEU  84  74.037   4.174  -5.351
  692   3HD2  LEU  84          3HD2      LEU  84  75.527   4.078  -4.413
  693    H    LEU  85           H        LEU  85  78.580   5.895  -4.056
  694    HA   LEU  85           HA       LEU  85  80.027   8.499  -3.876
  695   1HB   LEU  85          2HB       LEU  85  80.674   5.608  -3.534
  696   2HB   LEU  85          1HB       LEU  85  81.961   6.655  -4.141
  697    HG   LEU  85           HG       LEU  85  80.326   7.415  -1.719
  698   1HD1  LEU  85          1HD1      LEU  85  81.843   6.307  -0.281
  699   2HD1  LEU  85          2HD1      LEU  85  83.003   6.027  -1.579
  700   3HD1  LEU  85          3HD1      LEU  85  81.494   5.114  -1.534
  701   1HD2  LEU  85          1HD2      LEU  85  81.950   8.953  -3.126
  702   2HD2  LEU  85          2HD2      LEU  85  83.207   8.085  -2.245
  703   3HD2  LEU  85          3HD2      LEU  85  81.991   9.010  -1.364
  704    H    GLY  86           H        GLY  86  79.206   5.847  -6.086
  705   1HA   GLY  86          2HA       GLY  86  79.811   7.507  -8.420
  706   2HA   GLY  86          1HA       GLY  86  81.020   6.253  -8.167
  707    H    HIS  87           H        HIS  87  79.976   5.820 -10.449
  708    HA   HIS  87           HA       HIS  87  77.920   3.678 -10.097
  709   1HB   HIS  87          2HB       HIS  87  76.650   4.681 -11.990
  710   2HB   HIS  87          1HB       HIS  87  76.769   5.792 -10.632
  711    HD1  HIS  87           HD1      HIS  87  77.235   5.695 -14.187
  712    HD2  HIS  87           HD2      HIS  87  79.158   7.652 -11.047
  713    HE1  HIS  87           HE1      HIS  87  78.530   7.611 -15.222
  714    H    TYR  88           H        TYR  88  77.933   2.109 -11.843
  715    HA   TYR  88           HA       TYR  88  80.046   2.408 -13.923
  716   1HB   TYR  88          2HB       TYR  88  79.695   0.111 -11.971
  717   2HB   TYR  88          1HB       TYR  88  80.733   0.034 -13.395
  718    HD1  TYR  88           HD1      TYR  88  80.363   1.314  -9.970
  719    HD2  TYR  88           HD2      TYR  88  82.706   1.607 -13.630
  720    HE1  TYR  88           HE1      TYR  88  82.204   2.466  -8.700
  721    HE2  TYR  88           HE2      TYR  88  84.547   2.758 -12.360
  722    HH   TYR  88           HH       TYR  88  84.839   4.049 -10.283
  723    H    LYS  89           H        LYS  89  79.508   1.323 -15.865
  724    HA   LYS  89           HA       LYS  89  76.822  -0.020 -15.921
  725   1HB   LYS  89          2HB       LYS  89  76.621   0.983 -18.196
  726   2HB   LYS  89          1HB       LYS  89  76.813   2.211 -16.946
  727   1HG   LYS  89          2HG       LYS  89  78.886   2.838 -17.689
  728   2HG   LYS  89          1HG       LYS  89  79.331   1.198 -18.157
  729   1HD   LYS  89          2HD       LYS  89  78.417   1.398 -20.258
  730   2HD   LYS  89          1HD       LYS  89  77.158   2.509 -19.718
  731   1HE   LYS  89          2HE       LYS  89  78.686   3.803 -21.071
  732   2HE   LYS  89          1HE       LYS  89  79.023   4.240 -19.384
  733   1HZ   LYS  89          1HZ       LYS  89  80.805   2.691 -19.300
  734   2HZ   LYS  89          2HZ       LYS  89  81.034   3.624 -20.702
  735   3HZ   LYS  89          3HZ       LYS  89  80.414   2.045 -20.820
  736    HA   PRO  90           HA       PRO  90  78.689  -3.636 -17.689
  737   1HB   PRO  90          2HB       PRO  90  76.564  -3.419 -19.802
  738   2HB   PRO  90          1HB       PRO  90  77.011  -4.816 -18.795
  739   1HG   PRO  90          2HG       PRO  90  74.839  -3.501 -18.205
  740   2HG   PRO  90          1HG       PRO  90  75.961  -3.934 -16.898
  741   1HD   PRO  90          2HD       PRO  90  75.609  -1.288 -18.272
  742   2HD   PRO  90          1HD       PRO  90  75.768  -1.642 -16.534
  743    H    ARG  91           H        ARG  91  80.118  -4.182 -19.416
  744    HA   ARG  91           HA       ARG  91  80.505  -2.063 -21.509
  745   1HB   ARG  91          2HB       ARG  91  82.241  -2.213 -19.715
  746   2HB   ARG  91          1HB       ARG  91  82.536  -3.888 -20.181
  747   1HG   ARG  91          2HG       ARG  91  83.114  -3.124 -22.475
  748   2HG   ARG  91          1HG       ARG  91  82.893  -1.454 -21.953
  749   1HD   ARG  91          2HD       ARG  91  84.664  -1.804 -20.212
  750   2HD   ARG  91          1HD       ARG  91  84.943  -3.424 -20.881
  751    HE   ARG  91           HE       ARG  91  84.989  -1.289 -22.890
  752   1HH1  ARG  91          1HH1      ARG  91  86.904  -3.163 -20.620
  753   2HH1  ARG  91          2HH1      ARG  91  88.375  -2.867 -21.478
  754   1HH2  ARG  91          1HH2      ARG  91  86.920  -0.942 -23.951
  755   2HH2  ARG  91          2HH2      ARG  91  88.387  -1.628 -23.337
  756    H    ASN  92           H        ASN  92  80.758  -2.786 -23.632
  757    HA   ASN  92           HA       ASN  92  80.317  -5.709 -24.109
  758   1HB   ASN  92          2HB       ASN  92  78.647  -4.034 -24.918
  759   2HB   ASN  92          1HB       ASN  92  79.909  -3.294 -25.903
  760   1HD2  ASN  92          1HD2      ASN  92  78.248  -6.448 -25.397
  761   2HD2  ASN  92          2HD2      ASN  92  78.435  -6.973 -27.001