*HEADER    LIGASE                                  19-DEC-08   2KCC              
*TITLE     SOLUTION STRUCTURE OF BIOTINOYL DOMAIN FROM HUMAN ACETYL-             
*TITLE    2 COA CARBOXYLASE 2                                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ACETYL-COA CARBOXYLASE 2;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: BIOTINOYL DOMAIN, RESIDUES 891-964;                        
*COMPND   5 SYNONYM: ACC-BETA, BIOTIN CARBOXYLASE;                               
*COMPND   6 EC: 6.4.1.2, 6.3.4.14;                                               
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: ACACB, ACC2, ACCB;                                             
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET-21B (+)                                
*KEYWDS    ACETYL-COA CARBOXYLASE, BIOTINOYL DOMAIN, BCCP, BIRA,                 
*KEYWDS   2 BIOTINYLATION, ALTERNATIVE SPLICING, ATP-BINDING, BIOTIN,            
*KEYWDS   3 FATTY ACID BIOSYNTHESIS, LIGASE, LIPID SYNTHESIS, MANGANESE,         
*KEYWDS   4 MEMBRANE, METAL-BINDING, MULTIFUNCTIONAL ENZYME, NUCLEOTIDE-         
*KEYWDS   5 BINDING, PHOSPHOPROTEIN, POLYMORPHISM                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.LEE, H.CHEONG, K.RYU, J.LEE, W.LEE, Y.JEON, C.CHEONG                
*REVDAT   1   17-FEB-09 2KCC    0                                                


assign (resid    6 and name HB   ) (resid   72 and name HB2  )   5.20   5.20   0.00
assign (resid    6 and name HB   ) (resid   72 and name HB1  )   3.66   3.66   0.00
assign (resid   32 and name HA   ) (resid   44 and name HB   )   4.85   4.85   0.00
assign (resid    6 and name HB   ) (resid   72 and name HN   )   4.20   4.20   0.00
assign (resid    6 and name HB   ) (resid   74 and name HN   )   4.36   4.36   0.00
assign (resid   33 and name HN   ) (resid   44 and name HB   )   5.50   5.50   0.00
assign (resid   17 and name HA   ) (resid   17 and name HB   )   2.74   2.74   0.00
assign (resid   17 and name HB   ) (resid   42 and name HD1* )   3.83   3.83   0.00
assign (resid   17 and name HB   ) (resid   37 and name HA   )   5.34   5.34   0.00
assign (resid   12 and name HB*  ) (resid   38 and name HG*  )   4.34   4.34   0.00
assign (resid   11 and name HB2  ) (resid   12 and name HB*  )   4.21   4.21   0.00
assign (resid   12 and name HB*  ) (resid   65 and name HB*  )   4.38   4.38   0.00
assign (resid   16 and name HG   ) (resid   59 and name HA   )   3.51   3.51   0.00
assign (resid   32 and name HA   ) (resid   32 and name HB*  )   2.59   2.59   0.00
assign (resid   32 and name HB*  ) (resid   46 and name HA   )   3.95   3.95   0.00
assign (resid   68 and name HA   ) (resid   68 and name HG2* )   2.55   2.55   0.00
assign (resid   32 and name HB*  ) (resid   44 and name HG2* )   2.56   2.56   0.00
assign (resid    9 and name HG1  ) (resid   68 and name HA   )   4.52   4.52   0.00
assign (resid   57 and name HB1  ) (resid   69 and name HA   )   4.40   4.40   0.00
assign (resid   57 and name HB2  ) (resid   69 and name HA   )   2.91   2.91   0.00
assign (resid   31 and name HA   ) (resid   32 and name HB*  )   5.03   5.03   0.00
assign (resid   32 and name HB*  ) (resid   44 and name HA   )   5.31   5.31   0.00
assign (resid   68 and name HA   ) (resid   69 and name HN   )   2.89   2.89   0.00
assign (resid   32 and name HB*  ) (resid   46 and name HB*  )   4.63   4.63   0.00
assign (resid    9 and name HD1  ) (resid   68 and name HA   )   4.74   4.74   0.00
assign (resid   32 and name HB*  ) (resid   34 and name HN   )   3.48   3.48   0.00
assign (resid   32 and name HB*  ) (resid   33 and name HN   )   3.16   3.16   0.00
assign (resid   10 and name HN   ) (resid   10 and name HB1  )   3.51   3.51   0.00
assign (resid   56 and name HA   ) (resid   56 and name HG2* )   2.94   2.94   0.00
assign (resid   56 and name HA   ) (resid   56 and name HG1* )   3.05   3.05   0.00
assign (resid   17 and name HA   ) (resid   17 and name HG2* )   3.22   3.22   0.00
assign (resid   56 and name HA   ) (resid   57 and name HB2  )   5.50   5.50   0.00
assign (resid   15 and name HB*  ) (resid   62 and name HA   )   3.38   3.38   0.00
assign (resid   11 and name HA   ) (resid   65 and name HB*  )   4.98   4.98   0.00
assign (resid   27 and name HB   ) (resid   31 and name HB*  )   2.76   2.76   0.00
assign (resid   31 and name HB*  ) (resid   33 and name HB1  )   5.50   5.50   0.00
assign (resid   16 and name HB1  ) (resid   59 and name HA   )   3.80   3.80   0.00
assign (resid   15 and name HA   ) (resid   62 and name HA   )   2.73   2.73   0.00
assign (resid   44 and name HA   ) (resid   44 and name HG2* )   2.79   2.79   0.00
assign (resid    6 and name HA   ) (resid   72 and name HB2  )   3.27   3.27   0.00
assign (resid    6 and name HA   ) (resid    6 and name HG2* )   2.70   2.70   0.00
assign (resid    6 and name HA   ) (resid   72 and name HB1  )   2.88   2.88   0.00
assign (resid   35 and name HA   ) (resid   44 and name HA   )   2.90   2.90   0.00
assign (resid   44 and name HA   ) (resid   45 and name HN   )   2.78   2.78   0.00
assign (resid   36 and name HN   ) (resid   44 and name HA   )   3.80   3.80   0.00
assign (resid   53 and name HA   ) (resid   54 and name HN   )   2.84   2.84   0.00
assign (resid   15 and name HD*  ) (resid   62 and name HA   )   5.06   5.06   0.00
assign (resid   61 and name HB*  ) (resid   62 and name HA   )   5.50   5.50   0.00
assign (resid   62 and name HA   ) (resid   63 and name HB2  )   5.50   5.50   0.00
assign (resid    7 and name HA   ) (resid   71 and name HA   )   3.02   3.02   0.00
assign (resid    7 and name HA   ) (resid   71 and name HD*  )   3.28   3.28   0.00
assign (resid   53 and name HA   ) (resid   53 and name HG*  )   2.64   2.64   0.00
assign (resid   38 and name HA   ) (resid   38 and name HG*  )   2.44   2.44   0.00
assign (resid    7 and name HA   ) (resid    7 and name HG1* )   2.88   2.88   0.00
assign (resid    6 and name HA   ) (resid   74 and name HB*  )   4.92   4.92   0.00
assign (resid    6 and name HA   ) (resid   74 and name HN   )   5.04   5.04   0.00
assign (resid    7 and name HA   ) (resid    8 and name HN   )   2.83   2.83   0.00
assign (resid    7 and name HA   ) (resid   72 and name HN   )   3.77   3.77   0.00
assign (resid    8 and name HB2  ) (resid   53 and name HA   )   5.50   5.50   0.00
assign (resid   52 and name HB2  ) (resid   53 and name HA   )   5.50   5.50   0.00
assign (resid   53 and name HA   ) (resid   72 and name HA   )   3.01   3.01   0.00
assign (resid   20 and name HA   ) (resid   20 and name HG2* )   2.70   2.70   0.00
assign (resid   38 and name HA   ) (resid   38 and name HB   )   3.02   3.02   0.00
assign (resid    8 and name HD*  ) (resid   47 and name HA   )   2.74   2.74   0.00
assign (resid   19 and name HA   ) (resid   20 and name HG2* )   3.47   3.47   0.00
assign (resid   21 and name HA   ) (resid   21 and name HG*  )   2.49   2.49   0.00
assign (resid    8 and name HB2  ) (resid   47 and name HA   )   5.50   5.50   0.00
assign (resid   19 and name HA   ) (resid   20 and name HN   )   3.12   3.12   0.00
assign (resid   42 and name HA   ) (resid   42 and name HD1* )   2.58   2.58   0.00
assign (resid   33 and name HB1  ) (resid   47 and name HA   )   5.50   5.50   0.00
assign (resid   29 and name HA   ) (resid   47 and name HA   )   5.19   5.19   0.00
assign (resid   31 and name HA   ) (resid   31 and name HB*  )   2.56   2.56   0.00
assign (resid   42 and name HA   ) (resid   43 and name HN   )   2.72   2.72   0.00
assign (resid   37 and name HA   ) (resid   42 and name HA   )   2.93   2.93   0.00
assign (resid   31 and name HA   ) (resid   46 and name HA   )   5.50   5.50   0.00
assign (resid   27 and name HG2* ) (resid   31 and name HA   )   5.50   5.50   0.00
assign (resid   27 and name HB   ) (resid   31 and name HA   )   4.81   4.81   0.00
assign (resid   28 and name HG2  ) (resid   31 and name HA   )   4.59   4.59   0.00
assign (resid   32 and name HA   ) (resid   46 and name HA   )   2.67   2.67   0.00
assign (resid   32 and name HA   ) (resid   46 and name HB*  )   3.31   3.31   0.00
assign (resid   32 and name HA   ) (resid   34 and name HN   )   3.79   3.79   0.00
assign (resid   32 and name HA   ) (resid   33 and name HN   )   3.09   3.09   0.00
assign (resid   40 and name HA   ) (resid   40 and name HG*  )   2.73   2.73   0.00
assign (resid   33 and name HA   ) (resid   33 and name HB2  )   2.87   2.87   0.00
assign (resid   33 and name HA   ) (resid   33 and name HB1  )   2.87   2.87   0.00
assign (resid   21 and name HG*  ) (resid   33 and name HA   )   2.90   2.90   0.00
assign (resid   32 and name HA   ) (resid   33 and name HD*  )   4.02   4.02   0.00
assign (resid   26 and name HA   ) (resid   52 and name HA   )   2.93   2.93   0.00
assign (resid   26 and name HA   ) (resid   26 and name HB*  )   2.70   2.70   0.00
assign (resid   21 and name HB   ) (resid   33 and name HA   )   5.27   5.27   0.00
assign (resid   26 and name HA   ) (resid   27 and name HG2* )   3.87   3.87   0.00
assign (resid   64 and name HG*  ) (resid   67 and name HA   )   5.50   5.50   0.00
assign (resid   12 and name HA   ) (resid   12 and name HB*  )   2.51   2.51   0.00
assign (resid   33 and name HA   ) (resid   33 and name HD*  )   3.79   3.79   0.00
assign (resid   26 and name HA   ) (resid   27 and name HN   )   2.85   2.85   0.00
assign (resid   77 and name HD*  ) (resid   78 and name HA   )   5.39   5.39   0.00
assign (resid   78 and name HA   ) (resid   78 and name HB*  )   2.59   2.59   0.00
assign (resid   39 and name HA   ) (resid   39 and name HB*  )   2.50   2.50   0.00
assign (resid   26 and name HA   ) (resid   53 and name HN   )   3.79   3.79   0.00
assign (resid   12 and name HA   ) (resid   13 and name HB*  )   4.68   4.68   0.00
assign (resid   22 and name HA   ) (resid   22 and name HB2  )   2.96   2.96   0.00
assign (resid   23 and name HA   ) (resid   25 and name HN   )   3.78   3.78   0.00
assign (resid   23 and name HA   ) (resid   54 and name HA   )   3.88   3.88   0.00
assign (resid   38 and name HG*  ) (resid   39 and name HA   )   4.20   4.20   0.00
assign (resid   77 and name HA   ) (resid   77 and name HG   )   3.00   3.00   0.00
assign (resid   53 and name HG*  ) (resid   55 and name HA   )   4.04   4.04   0.00
assign (resid   74 and name HA   ) (resid   74 and name HB*  )   2.66   2.66   0.00
assign (resid   55 and name HA   ) (resid   55 and name HD*  )   2.88   2.88   0.00
assign (resid   83 and name HA   ) (resid   83 and name HB*  )   2.40   2.40   0.00
assign (resid   29 and name HB*  ) (resid   48 and name HA   )   3.62   3.62   0.00
assign (resid   16 and name HA   ) (resid   16 and name HB1  )   3.00   3.00   0.00
assign (resid   16 and name HA   ) (resid   17 and name HN   )   2.95   2.95   0.00
assign (resid   15 and name HA   ) (resid   15 and name HB*  )   2.48   2.48   0.00
assign (resid   37 and name HA   ) (resid   38 and name HN   )   2.73   2.73   0.00
assign (resid   10 and name HA   ) (resid   11 and name HD*  )   2.57   2.57   0.00
assign (resid    9 and name HA   ) (resid   10 and name HA   )   4.33   4.33   0.00
assign (resid    9 and name HA   ) (resid   68 and name HA   )   2.84   2.84   0.00
assign (resid   15 and name HA   ) (resid   16 and name HN   )   2.79   2.79   0.00
assign (resid   15 and name HA   ) (resid   62 and name HN   )   5.01   5.01   0.00
assign (resid   37 and name HA   ) (resid   37 and name HG2  )   3.40   3.40   0.00
assign (resid   37 and name HA   ) (resid   42 and name HD1* )   2.88   2.88   0.00
assign (resid   15 and name HA   ) (resid   15 and name HG2  )   3.54   3.54   0.00
assign (resid   15 and name HA   ) (resid   15 and name HG1  )   3.54   3.54   0.00
assign (resid   16 and name HA   ) (resid   16 and name HB2  )   2.90   2.90   0.00
assign (resid   16 and name HA   ) (resid   36 and name HB2  )   3.87   3.87   0.00
assign (resid   12 and name HA   ) (resid   65 and name HA   )   3.13   3.13   0.00
assign (resid   28 and name HG2  ) (resid   29 and name HA   )   4.96   4.96   0.00
assign (resid   29 and name HA   ) (resid   47 and name HG*  )   2.75   2.75   0.00
assign (resid   16 and name HA   ) (resid   63 and name HD*  )   3.01   3.01   0.00
assign (resid   57 and name HA   ) (resid   57 and name HD*  )   2.40   2.40   0.00
assign (resid   18 and name HA   ) (resid   18 and name HB1  )   3.00   3.00   0.00
assign (resid   18 and name HA   ) (resid   18 and name HB2  )   3.00   3.00   0.00
assign (resid   15 and name HA   ) (resid   15 and name HE*  )   5.01   5.01   0.00
assign (resid   52 and name HA   ) (resid   52 and name HB1  )   2.76   2.76   0.00
assign (resid   52 and name HA   ) (resid   73 and name HB*  )   4.18   4.18   0.00
assign (resid   52 and name HA   ) (resid   53 and name HG*  )   3.70   3.70   0.00
assign (resid   52 and name HA   ) (resid   53 and name HN   )   2.84   2.84   0.00
assign (resid   35 and name HA   ) (resid   36 and name HN   )   2.84   2.84   0.00
assign (resid    9 and name HA   ) (resid   69 and name HN   )   3.40   3.40   0.00
assign (resid   35 and name HA   ) (resid   45 and name HN   )   3.27   3.27   0.00
assign (resid   50 and name HA   ) (resid   51 and name HN   )   2.82   2.82   0.00
assign (resid   16 and name HA   ) (resid   36 and name HA   )   3.06   3.06   0.00
assign (resid   36 and name HA   ) (resid   36 and name HG*  )   3.45   3.45   0.00
assign (resid   36 and name HA   ) (resid   36 and name HB2  )   2.92   2.92   0.00
assign (resid   36 and name HA   ) (resid   36 and name HB1  )   2.92   2.92   0.00
assign (resid   17 and name HG2* ) (resid   36 and name HA   )   3.12   3.12   0.00
assign (resid   36 and name HA   ) (resid   63 and name HD*  )   4.31   4.31   0.00
assign (resid   42 and name HD1* ) (resid   43 and name HA   )   4.13   4.13   0.00
assign (resid   17 and name HN   ) (resid   36 and name HA   )   3.01   3.01   0.00
assign (resid   36 and name HA   ) (resid   37 and name HN   )   3.14   3.14   0.00
assign (resid    9 and name HA   ) (resid   10 and name HN   )   2.92   2.92   0.00
assign (resid   29 and name HA   ) (resid   49 and name HA   )   3.81   3.81   0.00
assign (resid    3 and name HA   ) (resid    3 and name HB*  )   2.50   2.50   0.00
assign (resid   48 and name HG*  ) (resid   49 and name HA   )   5.41   5.41   0.00
assign (resid   45 and name HA   ) (resid   45 and name HB1  )   2.62   2.62   0.00
assign (resid   29 and name HB*  ) (resid   49 and name HA   )   2.53   2.53   0.00
assign (resid    8 and name HA   ) (resid    8 and name HB2  )   2.86   2.86   0.00
assign (resid   63 and name HA   ) (resid   63 and name HB1  )   2.92   2.92   0.00
assign (resid   63 and name HA   ) (resid   63 and name HD*  )   2.57   2.57   0.00
assign (resid    8 and name HA   ) (resid    8 and name HD*  )   2.40   2.40   0.00
assign (resid   45 and name HA   ) (resid   45 and name HD*  )   3.95   3.95   0.00
assign (resid   28 and name HA   ) (resid   50 and name HG*  )   2.57   2.57   0.00
assign (resid   28 and name HA   ) (resid   28 and name HB2  )   2.90   2.90   0.00
assign (resid   17 and name HB   ) (resid   36 and name HA   )   4.01   4.01   0.00
assign (resid   71 and name HA   ) (resid   71 and name HD*  )   3.09   3.09   0.00
assign (resid   76 and name HA   ) (resid   77 and name HA   )   5.50   5.50   0.00
assign (resid   58 and name HA   ) (resid   58 and name HD*  )   3.49   3.49   0.00
assign (resid    8 and name HB2  ) (resid   71 and name HA   )   3.87   3.87   0.00
assign (resid   71 and name HA   ) (resid   72 and name HB2  )   5.05   5.05   0.00
assign (resid   56 and name HD1* ) (resid   71 and name HA   )   3.95   3.95   0.00
assign (resid   72 and name HA   ) (resid   72 and name HD*  )   2.46   2.46   0.00
assign (resid   72 and name HA   ) (resid   72 and name HB2  )   2.94   2.94   0.00
assign (resid   49 and name HA   ) (resid   49 and name HB1  )   2.68   2.68   0.00
assign (resid   49 and name HA   ) (resid   49 and name HG*  )   2.91   2.91   0.00
assign (resid   71 and name HA   ) (resid   72 and name HN   )   2.96   2.96   0.00
assign (resid    8 and name HN   ) (resid   71 and name HA   )   3.54   3.54   0.00
assign (resid   46 and name HA   ) (resid   46 and name HB*  )   2.90   2.90   0.00
assign (resid   46 and name HA   ) (resid   47 and name HG*  )   3.45   3.45   0.00
assign (resid   46 and name HA   ) (resid   47 and name HN   )   2.95   2.95   0.00
assign (resid   54 and name HA   ) (resid   55 and name HN   )   2.88   2.88   0.00
assign (resid   33 and name HD*  ) (resid   46 and name HA   )   3.44   3.44   0.00
assign (resid   33 and name HN   ) (resid   46 and name HA   )   3.53   3.53   0.00
assign (resid   45 and name HB1  ) (resid   46 and name HA   )   4.75   4.75   0.00
assign (resid    4 and name HA   ) (resid    4 and name HB1  )   2.89   2.89   0.00
assign (resid   20 and name HG2* ) (resid   34 and name HA   )   2.83   2.83   0.00
assign (resid   53 and name HG*  ) (resid   54 and name HA   )   4.05   4.05   0.00
assign (resid   19 and name HA   ) (resid   34 and name HA   )   2.70   2.70   0.00
assign (resid   70 and name HA   ) (resid   71 and name HN   )   3.18   3.18   0.00
assign (resid   34 and name HA   ) (resid   35 and name HN   )   3.21   3.21   0.00
assign (resid   13 and name HA   ) (resid   14 and name HN   )   2.92   2.92   0.00
assign (resid   19 and name HB2  ) (resid   34 and name HA   )   3.92   3.92   0.00
assign (resid   55 and name HA   ) (resid   70 and name HA   )   3.59   3.59   0.00
assign (resid   19 and name HN   ) (resid   34 and name HA   )   4.95   4.95   0.00
assign (resid    4 and name HA   ) (resid    5 and name HD2  )   2.64   2.64   0.00
assign (resid    4 and name HA   ) (resid    5 and name HD1  )   2.67   2.67   0.00
assign (resid   58 and name HB1  ) (resid   59 and name HD*  )   2.40   2.40   0.00
assign (resid    5 and name HD2  ) (resid    6 and name HG2* )   3.91   3.91   0.00
assign (resid    4 and name HB1  ) (resid    5 and name HD1  )   3.89   3.89   0.00
assign (resid    4 and name HB1  ) (resid    5 and name HD2  )   4.22   4.22   0.00
assign (resid   58 and name HA   ) (resid   59 and name HD*  )   2.59   2.59   0.00
assign (resid   58 and name HD*  ) (resid   59 and name HD*  )   3.91   3.91   0.00
assign (resid   72 and name HB2  ) (resid   72 and name HG   )   2.75   2.75   0.00
assign (resid   72 and name HB2  ) (resid   72 and name HD*  )   3.29   3.29   0.00
assign (resid    6 and name HG2* ) (resid   72 and name HB1  )   3.88   3.88   0.00
assign (resid   14 and name HA1  ) (resid   63 and name HB2  )   3.45   3.45   0.00
assign (resid   14 and name HA1  ) (resid   36 and name HG*  )   3.87   3.87   0.00
assign (resid   14 and name HA2  ) (resid   38 and name HG*  )   3.20   3.20   0.00
assign (resid   14 and name HA1  ) (resid   38 and name HG*  )   3.38   3.38   0.00
assign (resid   24 and name HA1  ) (resid   52 and name HB1  )   3.81   3.81   0.00
assign (resid   25 and name HA1  ) (resid   33 and name HB2  )   5.50   5.50   0.00
assign (resid   22 and name HG*  ) (resid   25 and name HA1  )   3.66   3.66   0.00
assign (resid   21 and name HB   ) (resid   25 and name HA1  )   4.26   4.26   0.00
assign (resid   22 and name HG*  ) (resid   25 and name HA2  )   3.33   3.33   0.00
assign (resid   21 and name HG*  ) (resid   25 and name HA1  )   3.03   3.03   0.00
assign (resid   65 and name HB*  ) (resid   66 and name HA2  )   4.69   4.69   0.00
assign (resid   21 and name HG*  ) (resid   25 and name HA2  )   4.11   4.11   0.00
assign (resid   24 and name HA2  ) (resid   52 and name HB1  )   3.41   3.41   0.00
assign (resid   24 and name HA2  ) (resid   54 and name HA   )   4.42   4.42   0.00
assign (resid   50 and name HG*  ) (resid   50 and name HD2  )   2.63   2.63   0.00
assign (resid   50 and name HA   ) (resid   50 and name HD2  )   4.30   4.30   0.00
assign (resid   50 and name HA   ) (resid   50 and name HD1  )   4.30   4.30   0.00
assign (resid   71 and name HB1  ) (resid   71 and name HD*  )   2.66   2.66   0.00
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assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0  -66.9   45.0 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  -22.8   45.0 2
assign (resid   63 and name C    ) (resid   64 and name N    )
       (resid   64 and name CA   ) (resid   64 and name C    )    1.0  -89.0   45.0 2
assign (resid   64 and name N    ) (resid   64 and name CA   )
       (resid   64 and name C    ) (resid   65 and name N    )    1.0  154.4   45.0 2
assign (resid   64 and name C    ) (resid   65 and name N    )
       (resid   65 and name CA   ) (resid   65 and name C    )    1.0  -59.6   45.0 2
assign (resid   65 and name N    ) (resid   65 and name CA   )
       (resid   65 and name C    ) (resid   66 and name N    )    1.0  132.5   45.0 2
assign (resid   67 and name C    ) (resid   68 and name N    )
       (resid   68 and name CA   ) (resid   68 and name C    )    1.0  -74.9   45.0 2
assign (resid   68 and name N    ) (resid   68 and name CA   )
       (resid   68 and name C    ) (resid   69 and name N    )    1.0  131.7   45.0 2
assign (resid   69 and name C    ) (resid   70 and name N    )
       (resid   70 and name CA   ) (resid   70 and name C    )    1.0 -158.9   45.0 2
assign (resid   70 and name N    ) (resid   70 and name CA   )
       (resid   70 and name C    ) (resid   71 and name N    )    1.0  156.5   45.0 2
assign (resid   70 and name C    ) (resid   71 and name N    )
       (resid   71 and name CA   ) (resid   71 and name C    )    1.0 -139.9   45.0 2
assign (resid   71 and name N    ) (resid   71 and name CA   )
       (resid   71 and name C    ) (resid   72 and name N    )    1.0  144.0   45.0 2
assign (resid   71 and name C    ) (resid   72 and name N    )
       (resid   72 and name CA   ) (resid   72 and name C    )    1.0 -116.6   45.0 2
assign (resid   72 and name N    ) (resid   72 and name CA   )
       (resid   72 and name C    ) (resid   73 and name N    )    1.0  131.2   45.0 2
assign (resid   72 and name C    ) (resid   73 and name N    )
       (resid   73 and name CA   ) (resid   73 and name C    )    1.0  -96.9   45.0 2
assign (resid   73 and name N    ) (resid   73 and name CA   )
       (resid   73 and name C    ) (resid   74 and name N    )    1.0  122.8   45.0 2


!! input file is "coupling_cnt_bccp.txt"

assign ( resid   3 and name c  ) ( resid   4 and name n  )
       ( resid   4 and name ca ) ( resid   4 and name c  )   7.05   0.50    ! D   4

assign ( resid   5 and name c  ) ( resid   6 and name n  )
       ( resid   6 and name ca ) ( resid   6 and name c  )   7.94   0.75    ! T   6

assign ( resid   6 and name c  ) ( resid   7 and name n  )
       ( resid   7 and name ca ) ( resid   7 and name c  )   8.41   0.50    ! V   7

assign ( resid   7 and name c  ) ( resid   8 and name n  )
       ( resid   8 and name ca ) ( resid   8 and name c  )   7.87   0.75    ! L   8

assign ( resid   8 and name c  ) ( resid   9 and name n  )
       ( resid   9 and name ca ) ( resid   9 and name c  )   7.94   0.50    ! R   9

assign ( resid   9 and name c  ) ( resid  10 and name n  )
       ( resid  10 and name ca ) ( resid  10 and name c  )   5.25   0.50    ! S  10

assign ( resid  11 and name c  ) ( resid  12 and name n  )
       ( resid  12 and name ca ) ( resid  12 and name c  )   7.77   0.50    ! S  12

assign ( resid  12 and name c  ) ( resid  13 and name n  )
       ( resid  13 and name ca ) ( resid  13 and name c  )   6.30   0.50    ! A  13

assign ( resid  14 and name c  ) ( resid  15 and name n  )
       ( resid  15 and name ca ) ( resid  15 and name c  )   6.23   0.50    ! K  15

assign ( resid  15 and name c  ) ( resid  16 and name n  )
       ( resid  16 and name ca ) ( resid  16 and name c  )   5.31   0.50    ! L  16

assign ( resid  16 and name c  ) ( resid  17 and name n  )
       ( resid  17 and name ca ) ( resid  17 and name c  )   6.21   0.50    ! T  17

assign ( resid  17 and name c  ) ( resid  18 and name n  )
       ( resid  18 and name ca ) ( resid  18 and name c  )   5.99   0.50    ! Q  18

assign ( resid  18 and name c  ) ( resid  19 and name n  )
       ( resid  19 and name ca ) ( resid  19 and name c  )   7.91   0.75    ! Y  19

assign ( resid  19 and name c  ) ( resid  20 and name n  )
       ( resid  20 and name ca ) ( resid  20 and name c  )   8.62   0.50    ! T  20

assign ( resid  20 and name c  ) ( resid  21 and name n  )
       ( resid  21 and name ca ) ( resid  21 and name c  )   8.03   0.50    ! V  21

assign ( resid  21 and name c  ) ( resid  22 and name n  )
       ( resid  22 and name ca ) ( resid  22 and name c  )   5.20   0.50    ! E  22

assign ( resid  22 and name c  ) ( resid  23 and name n  )
       ( resid  23 and name ca ) ( resid  23 and name c  )   4.07   0.50    ! D  23

assign ( resid  25 and name c  ) ( resid  26 and name n  )
       ( resid  26 and name ca ) ( resid  26 and name c  )   4.40   0.50    ! H  26

assign ( resid  26 and name c  ) ( resid  27 and name n  )
       ( resid  27 and name ca ) ( resid  27 and name c  )   8.67   0.50    ! V  27

assign ( resid  27 and name c  ) ( resid  28 and name n  )
       ( resid  28 and name ca ) ( resid  28 and name c  )   7.38   0.50    ! E  28

assign ( resid  28 and name c  ) ( resid  29 and name n  )
       ( resid  29 and name ca ) ( resid  29 and name c  )   2.38   0.50    ! A  29

assign ( resid  30 and name c  ) ( resid  31 and name n  )
       ( resid  31 and name ca ) ( resid  31 and name c  )   5.77   0.50    ! S  31

assign ( resid  31 and name c  ) ( resid  32 and name n  )
       ( resid  32 and name ca ) ( resid  32 and name c  )   5.08   0.50    ! S  32

assign ( resid  32 and name c  ) ( resid  33 and name n  )
       ( resid  33 and name ca ) ( resid  33 and name c  )   9.72   0.50    ! Y  33

assign ( resid  33 and name c  ) ( resid  34 and name n  )
       ( resid  34 and name ca ) ( resid  34 and name c  )   5.02   0.50    ! A  34

assign ( resid  34 and name c  ) ( resid  35 and name n  )
       ( resid  35 and name ca ) ( resid  35 and name c  )   8.43   0.50    ! E  35

assign ( resid  35 and name c  ) ( resid  36 and name n  )
       ( resid  36 and name ca ) ( resid  36 and name c  )   7.92   0.50    ! M  36

assign ( resid  36 and name c  ) ( resid  37 and name n  )
       ( resid  37 and name ca ) ( resid  37 and name c  )   8.17   0.50    ! E  37

assign ( resid  37 and name c  ) ( resid  38 and name n  )
       ( resid  38 and name ca ) ( resid  38 and name c  )   8.44   0.50    ! V  38

assign ( resid  38 and name c  ) ( resid  39 and name n  )
       ( resid  39 and name ca ) ( resid  39 and name c  )   4.18   0.50    ! M  39

assign ( resid  39 and name c  ) ( resid  40 and name n  )
       ( resid  40 and name ca ) ( resid  40 and name c  )   6.48   0.50    ! K  40

assign ( resid  40 and name c  ) ( resid  41 and name n  )
       ( resid  41 and name ca ) ( resid  41 and name c  )   8.14   0.50    ! M  41

assign ( resid  41 and name c  ) ( resid  42 and name n  )
       ( resid  42 and name ca ) ( resid  42 and name c  )   7.18   0.50    ! I  42

assign ( resid  42 and name c  ) ( resid  43 and name n  )
       ( resid  43 and name ca ) ( resid  43 and name c  )   8.62   0.50    ! M  43

assign ( resid  43 and name c  ) ( resid  44 and name n  )
       ( resid  44 and name ca ) ( resid  44 and name c  )  11.86   0.75    ! T  44

assign ( resid  44 and name c  ) ( resid  45 and name n  )
       ( resid  45 and name ca ) ( resid  45 and name c  )   8.43   0.50    ! L  45

assign ( resid  45 and name c  ) ( resid  46 and name n  )
       ( resid  46 and name ca ) ( resid  46 and name c  )   9.68   0.50    ! N  46

assign ( resid  46 and name c  ) ( resid  47 and name n  )
       ( resid  47 and name ca ) ( resid  47 and name c  )   8.58   0.50    ! V  47

assign ( resid  47 and name c  ) ( resid  48 and name n  )
       ( resid  48 and name ca ) ( resid  48 and name c  )   7.57   0.50    ! Q  48

assign ( resid  48 and name c  ) ( resid  49 and name n  )
       ( resid  49 and name ca ) ( resid  49 and name c  )   7.54   0.50    ! E  49

assign ( resid  49 and name c  ) ( resid  50 and name n  )
       ( resid  50 and name ca ) ( resid  50 and name c  )   5.26   0.50    ! R  50

assign ( resid  51 and name c  ) ( resid  52 and name n  )
       ( resid  52 and name ca ) ( resid  52 and name c  )   8.70   0.50    ! R  52

assign ( resid  52 and name c  ) ( resid  53 and name n  )
       ( resid  53 and name ca ) ( resid  53 and name c  )   7.14   0.50    ! V  53

assign ( resid  53 and name c  ) ( resid  54 and name n  )
       ( resid  54 and name ca ) ( resid  54 and name c  )  10.72   0.50    ! K  54

assign ( resid  54 and name c  ) ( resid  55 and name n  )
       ( resid  55 and name ca ) ( resid  55 and name c  )   3.68   0.50    ! Y  55

assign ( resid  55 and name c  ) ( resid  56 and name n  )
       ( resid  56 and name ca ) ( resid  56 and name c  )   9.64   0.50    ! I  56

assign ( resid  56 and name c  ) ( resid  57 and name n  )
       ( resid  57 and name ca ) ( resid  57 and name c  )   5.67   0.50    ! K  57

assign ( resid  57 and name c  ) ( resid  58 and name n  )
       ( resid  58 and name ca ) ( resid  58 and name c  )   8.44   0.50    ! R  58

assign ( resid  60 and name c  ) ( resid  61 and name n  )
       ( resid  61 and name ca ) ( resid  61 and name c  )   3.48   0.50    ! A  61

assign ( resid  61 and name c  ) ( resid  62 and name n  )
       ( resid  62 and name ca ) ( resid  62 and name c  )   6.61   0.50    ! V  62

assign ( resid  62 and name c  ) ( resid  63 and name n  )
       ( resid  63 and name ca ) ( resid  63 and name c  )   7.33   0.50    ! L  63

assign ( resid  64 and name c  ) ( resid  65 and name n  )
       ( resid  65 and name ca ) ( resid  65 and name c  )   4.36   0.50    ! A  65

assign ( resid  66 and name c  ) ( resid  67 and name n  )
       ( resid  67 and name ca ) ( resid  67 and name c  )   4.81   0.50    ! C  67

assign ( resid  67 and name c  ) ( resid  68 and name n  )
       ( resid  68 and name ca ) ( resid  68 and name c  )   7.08   0.50    ! V  68

assign ( resid  68 and name c  ) ( resid  69 and name n  )
       ( resid  69 and name ca ) ( resid  69 and name c  )   7.13   0.75    ! V  69

assign ( resid  69 and name c  ) ( resid  70 and name n  )
       ( resid  70 and name ca ) ( resid  70 and name c  )   5.95   0.75    ! A  70

assign ( resid  70 and name c  ) ( resid  71 and name n  )
       ( resid  71 and name ca ) ( resid  71 and name c  )   8.88   0.50    ! R  71

assign ( resid  71 and name c  ) ( resid  72 and name n  )
       ( resid  72 and name ca ) ( resid  72 and name c  )   8.76   0.50    ! L  72

assign ( resid  72 and name c  ) ( resid  73 and name n  )
       ( resid  73 and name ca ) ( resid  73 and name c  )   7.85   0.50    ! E  73

assign ( resid  73 and name c  ) ( resid  74 and name n  )
       ( resid  74 and name ca ) ( resid  74 and name c  )   4.54   0.50    ! L  74

assign ( resid  74 and name c  ) ( resid  75 and name n  )
       ( resid  75 and name ca ) ( resid  75 and name c  )   5.87   0.50    ! D  75

assign ( resid  75 and name c  ) ( resid  76 and name n  )
       ( resid  76 and name ca ) ( resid  76 and name c  )   6.53   0.50    ! D  76

assign ( resid  76 and name c  ) ( resid  77 and name n  )
       ( resid  77 and name ca ) ( resid  77 and name c  )   7.65   0.50    ! L  77

assign ( resid  77 and name c  ) ( resid  78 and name n  )
       ( resid  78 and name ca ) ( resid  78 and name c  )   6.04   0.50    ! E  78



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  -0.760   8.980 -13.116
    2    H2   MET   1           H2       MET   1   0.403  10.086 -12.514
    3    H3   MET   1           H3       MET   1  -0.932  10.659 -13.429
    4    HA   MET   1           HA       MET   1  -0.152   9.709 -15.373
    5    HB2  MET   1           HB2      MET   1   1.074  11.741 -14.075
    6    HB3  MET   1           HB3      MET   1   2.440  10.655 -14.295
    7    HG2  MET   1           HG2      MET   1   2.152  10.666 -16.667
    8    HG3  MET   1           HG3      MET   1   0.642  11.565 -16.527
    9    HE1  MET   1           HE1      MET   1   0.978  13.371 -17.956
   10    HE2  MET   1           HE2      MET   1   1.931  14.808 -17.586
   11    HE3  MET   1           HE3      MET   1   0.611  14.327 -16.520
   12    H    GLU   2           H        GLU   2   2.477   9.116 -13.035
   13    HA   GLU   2           HA       GLU   2   3.205   6.704 -14.492
   14    HB2  GLU   2           HB2      GLU   2   4.565   7.807 -12.039
   15    HB3  GLU   2           HB3      GLU   2   5.235   6.727 -13.253
   16    HG2  GLU   2           HG2      GLU   2   5.040   8.573 -14.908
   17    HG3  GLU   2           HG3      GLU   2   4.550   9.636 -13.590
   18    H    ASN   3           H        ASN   3   1.060   5.779 -13.772
   19    HA   ASN   3           HA       ASN   3   0.908   4.923 -11.014
   20    HB2  ASN   3           HB2      ASN   3  -0.840   4.341 -13.412
   21    HB3  ASN   3           HB3      ASN   3  -1.168   3.749 -11.787
   22   HD21  ASN   3          HD21      ASN   3  -1.157   5.524 -10.086
   23   HD22  ASN   3          HD22      ASN   3  -1.991   6.979 -10.502
   24    H    ASP   4           H        ASP   4   2.843   3.679 -10.890
   25    HA   ASP   4           HA       ASP   4   3.146   1.340 -12.552
   26    HB2  ASP   4           HB2      ASP   4   4.701   2.585 -10.319
   27    HB3  ASP   4           HB3      ASP   4   5.007   0.903 -10.739
   28    HA   PRO   5           HA       PRO   5   0.932  -1.547 -10.065
   29    HB2  PRO   5           HB2      PRO   5   2.396  -3.807 -10.423
   30    HB3  PRO   5           HB3      PRO   5   1.355  -3.127 -11.679
   31    HG2  PRO   5           HG2      PRO   5   4.318  -2.873 -11.332
   32    HG3  PRO   5           HG3      PRO   5   3.386  -3.169 -12.812
   33    HD2  PRO   5           HD2      PRO   5   4.351  -0.725 -12.171
   34    HD3  PRO   5           HD3      PRO   5   2.827  -0.944 -13.055
   35    H    THR   6           H        THR   6   4.321  -1.005  -9.483
   36    HA   THR   6           HA       THR   6   4.264  -2.396  -6.928
   37    HB   THR   6           HB       THR   6   6.638  -1.852  -6.802
   38    HG1  THR   6           HG1      THR   6   7.584  -0.482  -8.153
   39   HG21  THR   6          HG21      THR   6   5.490  -3.346  -8.954
   40   HG22  THR   6          HG22      THR   6   6.972  -3.642  -8.044
   41   HG23  THR   6          HG23      THR   6   7.002  -2.596  -9.465
   42    H    VAL   7           H        VAL   7   2.491  -0.199  -7.097
   43    HA   VAL   7           HA       VAL   7   3.543   1.409  -4.915
   44    HB   VAL   7           HB       VAL   7   2.125   3.023  -6.945
   45   HG11  VAL   7          HG11      VAL   7   4.169   3.358  -4.834
   46   HG12  VAL   7          HG12      VAL   7   2.775   4.362  -5.237
   47   HG13  VAL   7          HG13      VAL   7   4.246   4.467  -6.203
   48   HG21  VAL   7          HG21      VAL   7   4.304   3.454  -8.150
   49   HG22  VAL   7          HG22      VAL   7   3.531   1.907  -8.492
   50   HG23  VAL   7          HG23      VAL   7   4.913   1.979  -7.400
   51    H    LEU   8           H        LEU   8   1.704   3.047  -4.246
   52    HA   LEU   8           HA       LEU   8  -0.957   1.946  -4.627
   53    HB2  LEU   8           HB2      LEU   8   0.526   1.065  -2.488
   54    HB3  LEU   8           HB3      LEU   8  -0.375   2.398  -1.790
   55    HG   LEU   8           HG       LEU   8  -1.616   0.397  -1.405
   56   HD11  LEU   8          HD11      LEU   8  -3.666   1.116  -2.094
   57   HD12  LEU   8          HD12      LEU   8  -3.119   1.463  -3.734
   58   HD13  LEU   8          HD13      LEU   8  -2.723   2.570  -2.419
   59   HD21  LEU   8          HD21      LEU   8  -1.966  -0.213  -4.287
   60   HD22  LEU   8          HD22      LEU   8  -1.960  -1.292  -2.892
   61   HD23  LEU   8          HD23      LEU   8  -0.439  -0.667  -3.531
   62    H    ARG   9           H        ARG   9  -2.577   3.431  -4.319
   63    HA   ARG   9           HA       ARG   9  -1.976   5.991  -3.082
   64    HB2  ARG   9           HB2      ARG   9  -3.053   5.982  -5.892
   65    HB3  ARG   9           HB3      ARG   9  -2.425   7.340  -4.969
   66    HG2  ARG   9           HG2      ARG   9  -0.181   6.163  -5.033
   67    HG3  ARG   9           HG3      ARG   9  -0.896   5.092  -6.240
   68    HD2  ARG   9           HD2      ARG   9  -1.550   7.255  -7.466
   69    HD3  ARG   9           HD3      ARG   9  -0.380   8.042  -6.408
   70    HE   ARG   9           HE       ARG   9   0.663   5.742  -7.782
   71   HH11  ARG   9          HH11      ARG   9   0.087   9.178  -7.983
   72   HH12  ARG   9          HH12      ARG   9   1.331   9.445  -9.157
   73   HH21  ARG   9          HH21      ARG   9   2.301   6.091  -9.326
   74   HH22  ARG   9          HH22      ARG   9   2.588   7.692  -9.920
   75    H    SER  10           H        SER  10  -3.786   7.104  -2.391
   76    HA   SER  10           HA       SER  10  -6.115   5.551  -1.934
   77    HB2  SER  10           HB2      SER  10  -5.189   8.284  -1.252
   78    HB3  SER  10           HB3      SER  10  -6.935   8.037  -1.270
   79    HG   SER  10           HG       SER  10  -5.175   6.301   0.102
   80    HA   PRO  11           HA       PRO  11  -8.433   6.484  -5.586
   81    HB2  PRO  11           HB2      PRO  11 -10.938   5.990  -4.689
   82    HB3  PRO  11           HB3      PRO  11  -9.770   4.702  -5.007
   83    HG2  PRO  11           HG2      PRO  11 -10.534   5.964  -2.402
   84    HG3  PRO  11           HG3      PRO  11 -10.280   4.251  -2.783
   85    HD2  PRO  11           HD2      PRO  11  -8.405   5.775  -1.548
   86    HD3  PRO  11           HD3      PRO  11  -7.990   4.426  -2.625
   87    H    SER  12           H        SER  12  -9.127   8.070  -2.549
   88    HA   SER  12           HA       SER  12  -9.786  10.513  -3.957
   89    HB2  SER  12           HB2      SER  12 -11.760   9.328  -1.990
   90    HB3  SER  12           HB3      SER  12 -11.918  10.868  -2.833
   91    HG   SER  12           HG       SER  12 -13.104   9.326  -3.933
   92    H    ALA  13           H        ALA  13 -10.297  12.289  -2.245
   93    HA   ALA  13           HA       ALA  13  -8.072  12.333  -0.439
   94    HB1  ALA  13           HB1      ALA  13  -8.734  14.347  -1.624
   95    HB2  ALA  13           HB2      ALA  13  -8.851  14.594   0.118
   96    HB3  ALA  13           HB3      ALA  13 -10.310  14.316  -0.833
   97    H    GLY  14           H        GLY  14  -8.041  11.648   1.597
   98    HA2  GLY  14           HA2      GLY  14 -10.455  11.839   3.230
   99    HA3  GLY  14           HA3      GLY  14  -9.790  10.231   2.987
  100    H    LYS  15           H        LYS  15  -8.874   9.646   4.844
  101    HA   LYS  15           HA       LYS  15  -6.591  11.079   5.817
  102    HB2  LYS  15           HB2      LYS  15  -8.388  12.369   6.887
  103    HB3  LYS  15           HB3      LYS  15  -9.033  10.892   7.590
  104    HG2  LYS  15           HG2      LYS  15  -6.204  11.444   8.177
  105    HG3  LYS  15           HG3      LYS  15  -7.368  12.575   8.869
  106    HD2  LYS  15           HD2      LYS  15  -8.552  10.188   9.414
  107    HD3  LYS  15           HD3      LYS  15  -6.844   9.759   9.524
  108    HE2  LYS  15           HE2      LYS  15  -7.821  12.230  10.881
  109    HE3  LYS  15           HE3      LYS  15  -8.138  10.660  11.619
  110    HZ1  LYS  15           HZ1      LYS  15  -5.805  10.207  11.689
  111    HZ2  LYS  15           HZ2      LYS  15  -6.066  11.721  12.396
  112    HZ3  LYS  15           HZ3      LYS  15  -5.442  11.617  10.828
  113    H    LEU  16           H        LEU  16  -5.233   9.780   6.981
  114    HA   LEU  16           HA       LEU  16  -5.652   6.978   6.844
  115    HB2  LEU  16           HB2      LEU  16  -3.441   8.315   6.839
  116    HB3  LEU  16           HB3      LEU  16  -3.592   8.299   8.583
  117    HG   LEU  16           HG       LEU  16  -3.459   5.894   8.641
  118   HD11  LEU  16          HD11      LEU  16  -2.989   4.669   6.478
  119   HD12  LEU  16          HD12      LEU  16  -3.573   6.110   5.645
  120   HD13  LEU  16          HD13      LEU  16  -4.648   5.216   6.721
  121   HD21  LEU  16          HD21      LEU  16  -1.222   5.779   8.351
  122   HD22  LEU  16          HD22      LEU  16  -1.392   7.517   8.104
  123   HD23  LEU  16          HD23      LEU  16  -1.289   6.435   6.715
  124    H    THR  17           H        THR  17  -7.298   6.174   8.042
  125    HA   THR  17           HA       THR  17  -7.850   7.070  10.705
  126    HB   THR  17           HB       THR  17  -9.606   6.229   9.162
  127    HG1  THR  17           HG1      THR  17 -10.604   5.873  10.952
  128   HG21  THR  17          HG21      THR  17  -8.771   3.439   9.802
  129   HG22  THR  17          HG22      THR  17  -8.137   4.258   8.376
  130   HG23  THR  17          HG23      THR  17  -9.875   4.024   8.558
  131    H    GLN  18           H        GLN  18  -6.409   4.143   9.300
  132    HA   GLN  18           HA       GLN  18  -4.759   3.731  11.586
  133    HB2  GLN  18           HB2      GLN  18  -7.281   2.779  11.965
  134    HB3  GLN  18           HB3      GLN  18  -6.499   1.370  11.262
  135    HG2  GLN  18           HG2      GLN  18  -4.657   1.841  13.032
  136    HG3  GLN  18           HG3      GLN  18  -5.925   2.768  13.833
  137   HE21  GLN  18          HE21      GLN  18  -7.444   1.722  14.970
  138   HE22  GLN  18          HE22      GLN  18  -7.572   0.003  15.097
  139    H    TYR  19           H        TYR  19  -4.375   0.928  11.276
  140    HA   TYR  19           HA       TYR  19  -3.762   0.484   8.472
  141    HB2  TYR  19           HB2      TYR  19  -1.371  -0.053   9.003
  142    HB3  TYR  19           HB3      TYR  19  -1.774   1.655   9.134
  143    HD1  TYR  19           HD2      TYR  19  -1.057  -1.410  11.061
  144    HD2  TYR  19           HD1      TYR  19  -1.598   2.807  11.215
  145    HE1  TYR  19           HE2      TYR  19  -0.175  -1.387  13.356
  146    HE2  TYR  19           HE1      TYR  19  -0.717   2.842  13.510
  147    HH   TYR  19           HH       TYR  19  -0.586   0.474  15.468
  148    H    THR  20           H        THR  20  -3.690  -1.647   7.929
  149    HA   THR  20           HA       THR  20  -4.397  -3.534  10.045
  150    HB   THR  20           HB       THR  20  -5.295  -4.927   8.361
  151    HG1  THR  20           HG1      THR  20  -4.363  -5.078   6.507
  152   HG21  THR  20          HG21      THR  20  -6.599  -3.361   6.845
  153   HG22  THR  20          HG22      THR  20  -5.794  -2.048   7.705
  154   HG23  THR  20          HG23      THR  20  -6.824  -3.178   8.585
  155    H    VAL  21           H        VAL  21  -1.680  -2.613   8.240
  156    HA   VAL  21           HA       VAL  21  -0.211  -4.916   9.238
  157    HB   VAL  21           HB       VAL  21   0.877  -5.354   7.074
  158   HG11  VAL  21          HG11      VAL  21  -0.921  -6.615   6.083
  159   HG12  VAL  21          HG12      VAL  21  -2.121  -5.621   6.907
  160   HG13  VAL  21          HG13      VAL  21  -1.066  -6.683   7.839
  161   HG21  VAL  21          HG21      VAL  21   0.298  -3.033   6.175
  162   HG22  VAL  21          HG22      VAL  21  -1.276  -3.716   5.769
  163   HG23  VAL  21          HG23      VAL  21   0.188  -4.387   5.050
  164    H    GLU  22           H        GLU  22   1.929  -4.512   9.632
  165    HA   GLU  22           HA       GLU  22   2.715  -1.803   9.915
  166    HB2  GLU  22           HB2      GLU  22   4.889  -2.746  10.635
  167    HB3  GLU  22           HB3      GLU  22   3.522  -3.483  11.459
  168    HG2  GLU  22           HG2      GLU  22   3.963  -5.510  10.637
  169    HG3  GLU  22           HG3      GLU  22   4.322  -4.886   9.027
  170    H    ASP  23           H        ASP  23   5.177  -1.367   9.173
  171    HA   ASP  23           HA       ASP  23   5.056  -0.831   6.428
  172    HB2  ASP  23           HB2      ASP  23   7.421  -0.190   6.629
  173    HB3  ASP  23           HB3      ASP  23   6.471   0.449   7.967
  174    H    GLY  24           H        GLY  24   5.335  -2.106   4.723
  175    HA2  GLY  24           HA2      GLY  24   6.275  -3.735   3.369
  176    HA3  GLY  24           HA3      GLY  24   7.368  -4.147   4.681
  177    H    GLY  25           H        GLY  25   3.937  -4.044   5.232
  178    HA2  GLY  25           HA2      GLY  25   3.883  -6.722   6.168
  179    HA3  GLY  25           HA3      GLY  25   2.485  -5.688   5.916
  180    H    HIS  26           H        HIS  26   3.996  -8.473   4.933
  181    HA   HIS  26           HA       HIS  26   3.516  -8.531   2.168
  182    HB2  HIS  26           HB2      HIS  26   3.613 -11.000   2.413
  183    HB3  HIS  26           HB3      HIS  26   4.944 -10.181   3.223
  184    HD1  HIS  26           HD1      HIS  26   1.946 -12.286   3.868
  185    HD2  HIS  26           HD2      HIS  26   4.890 -10.320   6.043
  186    HE1  HIS  26           HE1      HIS  26   1.763 -13.183   6.210
  187    HE2  HIS  26           HE2      HIS  26   3.494 -11.913   7.528
  188    H    VAL  27           H        VAL  27   1.665  -8.459   1.094
  189    HA   VAL  27           HA       VAL  27  -0.678  -9.849   2.138
  190    HB   VAL  27           HB       VAL  27  -2.156  -7.925   1.691
  191   HG11  VAL  27          HG11      VAL  27  -1.212  -8.428   3.962
  192   HG12  VAL  27          HG12      VAL  27  -1.722  -6.757   3.718
  193   HG13  VAL  27          HG13      VAL  27  -0.009  -7.173   3.664
  194   HG21  VAL  27          HG21      VAL  27  -1.186  -6.477   0.223
  195   HG22  VAL  27          HG22      VAL  27   0.423  -6.678   0.916
  196   HG23  VAL  27          HG23      VAL  27  -0.767  -5.662   1.730
  197    H    GLU  28           H        GLU  28  -1.905 -10.759   0.574
  198    HA   GLU  28           HA       GLU  28  -0.932 -10.597  -2.146
  199    HB2  GLU  28           HB2      GLU  28  -2.362 -12.467  -2.602
  200    HB3  GLU  28           HB3      GLU  28  -1.561 -12.761  -1.066
  201    HG2  GLU  28           HG2      GLU  28  -3.994 -11.426  -0.519
  202    HG3  GLU  28           HG3      GLU  28  -4.337 -12.729  -1.656
  203    H    ALA  29           H        ALA  29  -2.474 -10.379  -3.968
  204    HA   ALA  29           HA       ALA  29  -3.723  -7.944  -4.050
  205    HB1  ALA  29           HB1      ALA  29  -4.392  -8.484  -6.158
  206    HB2  ALA  29           HB2      ALA  29  -4.930 -10.099  -5.695
  207    HB3  ALA  29           HB3      ALA  29  -3.210  -9.767  -5.902
  208    H    GLY  30           H        GLY  30  -5.586  -7.096  -3.350
  209    HA2  GLY  30           HA2      GLY  30  -7.904  -7.119  -2.877
  210    HA3  GLY  30           HA3      GLY  30  -7.831  -8.867  -2.723
  211    H    SER  31           H        SER  31  -5.377  -8.558  -0.987
  212    HA   SER  31           HA       SER  31  -6.753  -8.534   1.507
  213    HB2  SER  31           HB2      SER  31  -4.853  -9.988   1.262
  214    HB3  SER  31           HB3      SER  31  -3.808  -8.636   0.824
  215    HG   SER  31           HG       SER  31  -5.022  -9.133   3.339
  216    H    SER  32           H        SER  32  -7.098  -6.913   2.885
  217    HA   SER  32           HA       SER  32  -6.520  -4.237   2.167
  218    HB2  SER  32           HB2      SER  32  -7.208  -3.975   4.752
  219    HB3  SER  32           HB3      SER  32  -8.393  -4.261   3.477
  220    HG   SER  32           HG       SER  32  -8.812  -6.122   4.342
  221    H    TYR  33           H        TYR  33  -4.967  -2.840   2.831
  222    HA   TYR  33           HA       TYR  33  -2.852  -3.943   4.562
  223    HB2  TYR  33           HB2      TYR  33  -1.227  -2.667   3.321
  224    HB3  TYR  33           HB3      TYR  33  -2.188  -3.605   2.182
  225    HD1  TYR  33           HD1      TYR  33  -1.409  -0.243   3.410
  226    HD2  TYR  33           HD2      TYR  33  -3.710  -2.508   0.639
  227    HE1  TYR  33           HE1      TYR  33  -1.917   1.813   2.160
  228    HE2  TYR  33           HE2      TYR  33  -4.223  -0.458  -0.619
  229    HH   TYR  33           HH       TYR  33  -2.589   2.477  -0.098
  230    H    ALA  34           H        ALA  34  -5.193  -1.514   4.248
  231    HA   ALA  34           HA       ALA  34  -4.562  -0.355   6.745
  232    HB1  ALA  34           HB1      ALA  34  -4.190   1.636   4.550
  233    HB2  ALA  34           HB2      ALA  34  -2.831   0.643   5.078
  234    HB3  ALA  34           HB3      ALA  34  -3.650   1.701   6.228
  235    H    GLU  35           H        GLU  35  -5.767   2.069   6.620
  236    HA   GLU  35           HA       GLU  35  -8.303   1.757   5.216
  237    HB2  GLU  35           HB2      GLU  35  -8.063   1.973   8.220
  238    HB3  GLU  35           HB3      GLU  35  -9.559   2.247   7.338
  239    HG2  GLU  35           HG2      GLU  35  -9.707   0.005   6.672
  240    HG3  GLU  35           HG3      GLU  35  -8.029  -0.321   7.106
  241    H    MET  36           H        MET  36  -9.683   3.723   5.463
  242    HA   MET  36           HA       MET  36  -8.328   6.140   6.300
  243    HB2  MET  36           HB2      MET  36  -8.432   7.248   4.158
  244    HB3  MET  36           HB3      MET  36  -7.509   5.762   3.989
  245    HG2  MET  36           HG2      MET  36  -9.910   4.827   3.319
  246    HG3  MET  36           HG3      MET  36 -10.131   6.512   2.851
  247    HE1  MET  36           HE1      MET  36  -9.966   5.927  -0.309
  248    HE2  MET  36           HE2      MET  36 -10.765   4.961   0.931
  249    HE3  MET  36           HE3      MET  36  -9.639   4.198  -0.193
  250    H    GLU  37           H        GLU  37  -9.808   7.221   7.402
  251    HA   GLU  37           HA       GLU  37 -12.633   6.801   6.855
  252    HB2  GLU  37           HB2      GLU  37 -11.688   6.772   9.184
  253    HB3  GLU  37           HB3      GLU  37 -11.375   8.494   9.017
  254    HG2  GLU  37           HG2      GLU  37 -13.659   9.015   8.940
  255    HG3  GLU  37           HG3      GLU  37 -14.115   7.338   8.642
  256    H    VAL  38           H        VAL  38 -13.327   7.951   5.154
  257    HA   VAL  38           HA       VAL  38 -12.463  10.712   4.793
  258    HB   VAL  38           HB       VAL  38 -12.554   9.205   2.834
  259   HG11  VAL  38          HG11      VAL  38 -15.472   9.093   3.525
  260   HG12  VAL  38          HG12      VAL  38 -14.347   7.757   3.285
  261   HG13  VAL  38          HG13      VAL  38 -14.872   8.727   1.909
  262   HG21  VAL  38          HG21      VAL  38 -14.629  11.359   2.528
  263   HG22  VAL  38          HG22      VAL  38 -13.486  10.762   1.326
  264   HG23  VAL  38          HG23      VAL  38 -12.909  11.709   2.698
  265    H    MET  39           H        MET  39 -14.198  12.345   4.225
  266    HA   MET  39           HA       MET  39 -15.921  12.724   6.364
  267    HB2  MET  39           HB2      MET  39 -16.401  13.875   3.621
  268    HB3  MET  39           HB3      MET  39 -16.809  14.583   5.178
  269    HG2  MET  39           HG2      MET  39 -14.144  14.349   5.452
  270    HG3  MET  39           HG3      MET  39 -14.262  14.570   3.707
  271    HE1  MET  39           HE1      MET  39 -14.279  16.850   2.639
  272    HE2  MET  39           HE2      MET  39 -15.371  18.121   3.188
  273    HE3  MET  39           HE3      MET  39 -16.011  16.536   2.755
  274    H    LYS  40           H        LYS  40 -16.370  10.851   3.493
  275    HA   LYS  40           HA       LYS  40 -19.236  10.766   3.639
  276    HB2  LYS  40           HB2      LYS  40 -17.190   9.185   2.089
  277    HB3  LYS  40           HB3      LYS  40 -18.907   8.816   2.017
  278    HG2  LYS  40           HG2      LYS  40 -18.144  11.625   1.527
  279    HG3  LYS  40           HG3      LYS  40 -17.684  10.448   0.296
  280    HD2  LYS  40           HD2      LYS  40 -20.073   9.653   0.321
  281    HD3  LYS  40           HD3      LYS  40 -20.447  11.049   1.333
  282    HE2  LYS  40           HE2      LYS  40 -19.118  11.264  -1.360
  283    HE3  LYS  40           HE3      LYS  40 -20.865  11.342  -1.136
  284    HZ1  LYS  40           HZ1      LYS  40 -20.626  13.285   0.204
  285    HZ2  LYS  40           HZ2      LYS  40 -19.762  13.539  -1.228
  286    HZ3  LYS  40           HZ3      LYS  40 -18.938  13.162   0.200
  287    H    MET  41           H        MET  41 -17.021   7.992   3.753
  288    HA   MET  41           HA       MET  41 -18.108   7.121   6.294
  289    HB2  MET  41           HB2      MET  41 -18.581   5.625   3.720
  290    HB3  MET  41           HB3      MET  41 -18.648   4.839   5.291
  291    HG2  MET  41           HG2      MET  41 -20.295   6.908   5.745
  292    HG3  MET  41           HG3      MET  41 -20.543   6.695   4.013
  293    HE1  MET  41           HE1      MET  41 -23.469   4.952   6.300
  294    HE2  MET  41           HE2      MET  41 -23.181   6.326   5.232
  295    HE3  MET  41           HE3      MET  41 -22.408   6.263   6.816
  296    H    ILE  42           H        ILE  42 -17.138   4.798   6.753
  297    HA   ILE  42           HA       ILE  42 -14.275   5.112   6.514
  298    HB   ILE  42           HB       ILE  42 -15.237   4.390   8.644
  299   HG12  ILE  42          HG12      ILE  42 -13.751   2.487   9.079
  300   HG13  ILE  42          HG13      ILE  42 -13.591   2.204   7.348
  301   HG21  ILE  42          HG21      ILE  42 -17.161   3.181   7.995
  302   HG22  ILE  42          HG22      ILE  42 -16.102   2.024   8.800
  303   HG23  ILE  42          HG23      ILE  42 -16.212   2.042   7.039
  304   HD11  ILE  42          HD11      ILE  42 -12.898   4.911   7.932
  305   HD12  ILE  42          HD12      ILE  42 -11.906   3.625   7.243
  306   HD13  ILE  42          HD13      ILE  42 -12.001   3.824   8.992
  307    H    MET  43           H        MET  43 -12.850   3.704   5.498
  308    HA   MET  43           HA       MET  43 -13.941   1.490   3.945
  309    HB2  MET  43           HB2      MET  43 -12.484   3.841   2.738
  310    HB3  MET  43           HB3      MET  43 -12.677   2.301   1.912
  311    HG2  MET  43           HG2      MET  43 -15.053   3.790   2.950
  312    HG3  MET  43           HG3      MET  43 -14.322   4.210   1.402
  313    HE1  MET  43           HE1      MET  43 -17.013   3.772   0.927
  314    HE2  MET  43           HE2      MET  43 -17.291   2.347  -0.074
  315    HE3  MET  43           HE3      MET  43 -16.008   3.482  -0.493
  316    H    THR  44           H        THR  44 -12.181   0.199   2.901
  317    HA   THR  44           HA       THR  44  -9.723   0.296   4.526
  318    HB   THR  44           HB       THR  44 -10.427  -2.317   3.387
  319    HG1  THR  44           HG1      THR  44 -12.510  -1.599   3.950
  320   HG21  THR  44          HG21      THR  44  -9.231  -3.062   5.088
  321   HG22  THR  44          HG22      THR  44 -10.230  -2.196   6.255
  322   HG23  THR  44          HG23      THR  44  -8.871  -1.382   5.481
  323    H    LEU  45           H        LEU  45  -7.815   0.234   3.478
  324    HA   LEU  45           HA       LEU  45  -7.889   0.281   0.564
  325    HB2  LEU  45           HB2      LEU  45  -5.619   0.858   2.471
  326    HB3  LEU  45           HB3      LEU  45  -5.573   1.084   0.733
  327    HG   LEU  45           HG       LEU  45  -7.657   2.647   1.232
  328   HD11  LEU  45          HD11      LEU  45  -6.392   2.195   3.857
  329   HD12  LEU  45          HD12      LEU  45  -8.044   2.662   3.454
  330   HD13  LEU  45          HD13      LEU  45  -6.760   3.871   3.447
  331   HD21  LEU  45          HD21      LEU  45  -5.778   3.514   0.121
  332   HD22  LEU  45          HD22      LEU  45  -4.734   3.276   1.523
  333   HD23  LEU  45          HD23      LEU  45  -5.974   4.530   1.550
  334    H    ASN  46           H        ASN  46  -6.985  -1.237  -0.731
  335    HA   ASN  46           HA       ASN  46  -5.486  -3.420   0.548
  336    HB2  ASN  46           HB2      ASN  46  -6.674  -5.034  -0.922
  337    HB3  ASN  46           HB3      ASN  46  -7.744  -4.240   0.230
  338   HD21  ASN  46          HD21      ASN  46  -9.059  -2.484  -0.547
  339   HD22  ASN  46          HD22      ASN  46  -9.567  -2.463  -2.198
  340    H    VAL  47           H        VAL  47  -4.473  -4.866  -1.215
  341    HA   VAL  47           HA       VAL  47  -3.045  -3.086  -3.036
  342    HB   VAL  47           HB       VAL  47  -1.527  -5.024  -3.378
  343   HG11  VAL  47          HG11      VAL  47  -1.837  -4.566  -0.433
  344   HG12  VAL  47          HG12      VAL  47  -1.337  -3.264  -1.511
  345   HG13  VAL  47          HG13      VAL  47  -0.361  -4.727  -1.384
  346   HG21  VAL  47          HG21      VAL  47  -1.865  -7.083  -2.492
  347   HG22  VAL  47          HG22      VAL  47  -3.554  -6.588  -2.602
  348   HG23  VAL  47          HG23      VAL  47  -2.695  -6.455  -1.068
  349    H    GLN  48           H        GLN  48  -2.762  -3.562  -5.253
  350    HA   GLN  48           HA       GLN  48  -5.090  -4.805  -6.452
  351    HB2  GLN  48           HB2      GLN  48  -3.949  -3.995  -8.611
  352    HB3  GLN  48           HB3      GLN  48  -4.572  -2.784  -7.500
  353    HG2  GLN  48           HG2      GLN  48  -2.367  -2.216  -8.430
  354    HG3  GLN  48           HG3      GLN  48  -2.368  -2.327  -6.672
  355   HE21  GLN  48          HE21      GLN  48  -0.812  -3.476  -5.777
  356   HE22  GLN  48          HE22      GLN  48   0.161  -4.662  -6.572
  357    H    GLU  49           H        GLU  49  -1.916  -5.728  -5.663
  358    HA   GLU  49           HA       GLU  49  -2.288  -8.270  -6.986
  359    HB2  GLU  49           HB2      GLU  49  -0.133  -6.339  -7.792
  360    HB3  GLU  49           HB3      GLU  49   0.114  -8.073  -7.942
  361    HG2  GLU  49           HG2      GLU  49  -1.875  -8.215  -9.374
  362    HG3  GLU  49           HG3      GLU  49  -2.069  -6.467  -9.252
  363    H    ARG  50           H        ARG  50  -0.347  -9.740  -6.495
  364    HA   ARG  50           HA       ARG  50   0.025  -9.775  -3.684
  365    HB2  ARG  50           HB2      ARG  50   1.126 -11.410  -5.953
  366    HB3  ARG  50           HB3      ARG  50   1.696 -11.650  -4.307
  367    HG2  ARG  50           HG2      ARG  50   0.035 -13.237  -4.508
  368    HG3  ARG  50           HG3      ARG  50  -0.807 -11.899  -3.724
  369    HD2  ARG  50           HD2      ARG  50  -2.172 -12.812  -5.506
  370    HD3  ARG  50           HD3      ARG  50  -1.659 -11.174  -5.911
  371    HE   ARG  50           HE       ARG  50   0.216 -12.817  -7.053
  372   HH11  ARG  50          HH11      ARG  50  -3.247 -12.452  -7.280
  373   HH12  ARG  50          HH12      ARG  50  -3.322 -12.990  -8.924
  374   HH21  ARG  50          HH21      ARG  50   0.120 -13.525  -9.216
  375   HH22  ARG  50          HH22      ARG  50  -1.410 -13.600 -10.023
  376    H    GLY  51           H        GLY  51   1.699  -9.142  -2.431
  377    HA2  GLY  51           HA2      GLY  51   4.336  -8.828  -2.991
  378    HA3  GLY  51           HA3      GLY  51   3.626  -7.337  -3.592
  379    H    ARG  52           H        ARG  52   5.426  -6.962  -1.721
  380    HA   ARG  52           HA       ARG  52   4.114  -6.881   0.887
  381    HB2  ARG  52           HB2      ARG  52   6.908  -6.744  -0.081
  382    HB3  ARG  52           HB3      ARG  52   6.539  -5.771   1.336
  383    HG2  ARG  52           HG2      ARG  52   7.243  -7.769   2.252
  384    HG3  ARG  52           HG3      ARG  52   5.486  -7.936   2.265
  385    HD2  ARG  52           HD2      ARG  52   6.546  -9.979   1.470
  386    HD3  ARG  52           HD3      ARG  52   5.592  -9.228   0.192
  387    HE   ARG  52           HE       ARG  52   7.508  -8.969  -1.020
  388   HH11  ARG  52          HH11      ARG  52   8.376  -9.503   2.318
  389   HH12  ARG  52          HH12      ARG  52  10.074  -9.600   1.991
  390   HH21  ARG  52          HH21      ARG  52   9.740  -9.097  -1.452
  391   HH22  ARG  52          HH22      ARG  52  10.849  -9.370  -0.149
  392    H    VAL  53           H        VAL  53   3.071  -5.134   1.554
  393    HA   VAL  53           HA       VAL  53   3.211  -2.677   0.047
  394    HB   VAL  53           HB       VAL  53   1.665  -3.214   2.585
  395   HG11  VAL  53          HG11      VAL  53   1.822  -0.871   2.151
  396   HG12  VAL  53          HG12      VAL  53   0.206  -1.396   1.677
  397   HG13  VAL  53          HG13      VAL  53   1.435  -1.105   0.446
  398   HG21  VAL  53          HG21      VAL  53  -0.214  -3.813   1.219
  399   HG22  VAL  53          HG22      VAL  53   1.151  -4.832   0.763
  400   HG23  VAL  53          HG23      VAL  53   0.690  -3.469  -0.256
  401    H    LYS  54           H        LYS  54   4.369  -0.926   0.523
  402    HA   LYS  54           HA       LYS  54   5.662  -0.790   3.169
  403    HB2  LYS  54           HB2      LYS  54   6.720   0.479   0.646
  404    HB3  LYS  54           HB3      LYS  54   7.562   0.241   2.171
  405    HG2  LYS  54           HG2      LYS  54   7.225  -2.270   1.717
  406    HG3  LYS  54           HG3      LYS  54   6.888  -1.767   0.059
  407    HD2  LYS  54           HD2      LYS  54   9.386  -1.042   1.586
  408    HD3  LYS  54           HD3      LYS  54   9.264  -2.397   0.462
  409    HE2  LYS  54           HE2      LYS  54  10.113  -0.778  -0.922
  410    HE3  LYS  54           HE3      LYS  54   8.384  -0.547  -1.177
  411    HZ1  LYS  54           HZ1      LYS  54   8.394   1.424  -0.094
  412    HZ2  LYS  54           HZ2      LYS  54  10.009   1.441  -0.596
  413    HZ3  LYS  54           HZ3      LYS  54   9.620   0.975   0.983
  414    H    TYR  55           H        TYR  55   4.678   0.684   4.379
  415    HA   TYR  55           HA       TYR  55   2.999   2.713   3.466
  416    HB2  TYR  55           HB2      TYR  55   4.361   2.113   6.047
  417    HB3  TYR  55           HB3      TYR  55   3.655   3.713   5.842
  418    HD1  TYR  55           HD2      TYR  55   2.412   0.441   4.577
  419    HD2  TYR  55           HD1      TYR  55   1.792   3.691   7.252
  420    HE1  TYR  55           HE2      TYR  55   0.202  -0.466   5.158
  421    HE2  TYR  55           HE1      TYR  55  -0.419   2.792   7.841
  422    HH   TYR  55           HH       TYR  55  -1.408  -0.340   7.025
  423    H    ILE  56           H        ILE  56   3.297   4.735   2.761
  424    HA   ILE  56           HA       ILE  56   6.053   5.753   2.655
  425    HB   ILE  56           HB       ILE  56   3.726   5.988   0.817
  426   HG12  ILE  56          HG12      ILE  56   5.429   5.715  -0.882
  427   HG13  ILE  56          HG13      ILE  56   6.706   5.961   0.304
  428   HG21  ILE  56          HG21      ILE  56   4.849   7.993  -0.263
  429   HG22  ILE  56          HG22      ILE  56   5.713   8.200   1.260
  430   HG23  ILE  56          HG23      ILE  56   3.952   8.297   1.225
  431   HD11  ILE  56          HD11      ILE  56   4.800   3.638   0.182
  432   HD12  ILE  56          HD12      ILE  56   6.019   3.889   1.431
  433   HD13  ILE  56          HD13      ILE  56   6.511   3.626  -0.242
  434    H    LYS  57           H        LYS  57   2.717   6.941   2.982
  435    HA   LYS  57           HA       LYS  57   3.510   9.447   4.081
  436    HB2  LYS  57           HB2      LYS  57   1.178   8.347   3.031
  437    HB3  LYS  57           HB3      LYS  57   0.788   8.657   4.718
  438    HG2  LYS  57           HG2      LYS  57   0.207  10.531   3.236
  439    HG3  LYS  57           HG3      LYS  57   1.380  10.980   4.475
  440    HD2  LYS  57           HD2      LYS  57   3.151  11.034   2.935
  441    HD3  LYS  57           HD3      LYS  57   2.237  10.131   1.725
  442    HE2  LYS  57           HE2      LYS  57   0.884  11.979   1.210
  443    HE3  LYS  57           HE3      LYS  57   1.357  12.840   2.674
  444    HZ1  LYS  57           HZ1      LYS  57   3.124  12.264   0.356
  445    HZ2  LYS  57           HZ2      LYS  57   3.585  13.082   1.762
  446    HZ3  LYS  57           HZ3      LYS  57   2.436  13.765   0.727
  447    H    ARG  58           H        ARG  58   2.595  10.179   6.246
  448    HA   ARG  58           HA       ARG  58   3.467   8.265   8.266
  449    HB2  ARG  58           HB2      ARG  58   3.180  11.221   8.124
  450    HB3  ARG  58           HB3      ARG  58   2.983  10.472   9.703
  451    HG2  ARG  58           HG2      ARG  58   5.260  11.161   9.445
  452    HG3  ARG  58           HG3      ARG  58   5.195   9.397   9.421
  453    HD2  ARG  58           HD2      ARG  58   5.875   9.272   7.273
  454    HD3  ARG  58           HD3      ARG  58   4.972  10.709   6.796
  455    HE   ARG  58           HE       ARG  58   7.210  11.361   8.434
  456   HH11  ARG  58          HH11      ARG  58   6.289  10.508   5.178
  457   HH12  ARG  58          HH12      ARG  58   7.644  11.304   4.452
  458   HH21  ARG  58          HH21      ARG  58   8.993  12.409   7.481
  459   HH22  ARG  58          HH22      ARG  58   9.180  12.383   5.760
  460    HA   PRO  59           HA       PRO  59  -0.509   7.325   9.906
  461    HB2  PRO  59           HB2      PRO  59  -0.161   7.561  12.602
  462    HB3  PRO  59           HB3      PRO  59   0.475   6.211  11.654
  463    HG2  PRO  59           HG2      PRO  59   1.875   8.674  12.620
  464    HG3  PRO  59           HG3      PRO  59   2.444   6.994  12.609
  465    HD2  PRO  59           HD2      PRO  59   3.225   8.786  10.750
  466    HD3  PRO  59           HD3      PRO  59   3.006   7.066  10.370
  467    H    GLY  60           H        GLY  60  -2.356   8.428  10.032
  468    HA2  GLY  60           HA2      GLY  60  -3.859  10.012  10.901
  469    HA3  GLY  60           HA3      GLY  60  -2.504  10.878  11.606
  470    H    ALA  61           H        ALA  61  -1.188  10.584   8.820
  471    HA   ALA  61           HA       ALA  61  -1.679  13.160   7.902
  472    HB1  ALA  61           HB1      ALA  61   0.311  11.846   7.319
  473    HB2  ALA  61           HB2      ALA  61  -0.477  12.519   5.892
  474    HB3  ALA  61           HB3      ALA  61  -0.682  10.814   6.291
  475    H    VAL  62           H        VAL  62  -2.924  14.029   6.267
  476    HA   VAL  62           HA       VAL  62  -5.404  12.676   5.736
  477    HB   VAL  62           HB       VAL  62  -6.028  14.713   4.503
  478   HG11  VAL  62          HG11      VAL  62  -6.398  14.633   6.897
  479   HG12  VAL  62          HG12      VAL  62  -5.948  16.267   6.408
  480   HG13  VAL  62          HG13      VAL  62  -4.763  15.223   7.192
  481   HG21  VAL  62          HG21      VAL  62  -3.214  15.603   5.130
  482   HG22  VAL  62          HG22      VAL  62  -4.488  16.643   4.495
  483   HG23  VAL  62          HG23      VAL  62  -3.890  15.294   3.531
  484    H    LEU  63           H        LEU  63  -5.937  11.523   3.993
  485    HA   LEU  63           HA       LEU  63  -3.962  11.111   1.922
  486    HB2  LEU  63           HB2      LEU  63  -6.722   9.930   1.949
  487    HB3  LEU  63           HB3      LEU  63  -5.262   9.280   1.227
  488    HG   LEU  63           HG       LEU  63  -5.904   9.427   4.172
  489   HD11  LEU  63          HD11      LEU  63  -5.993   7.051   4.094
  490   HD12  LEU  63          HD12      LEU  63  -5.424   7.024   2.425
  491   HD13  LEU  63          HD13      LEU  63  -7.026   7.658   2.800
  492   HD21  LEU  63          HD21      LEU  63  -3.500   9.866   3.633
  493   HD22  LEU  63          HD22      LEU  63  -3.441   8.271   2.881
  494   HD23  LEU  63          HD23      LEU  63  -3.786   8.422   4.604
  495    H    GLU  64           H        GLU  64  -4.201  11.556  -0.257
  496    HA   GLU  64           HA       GLU  64  -6.430  13.348  -0.966
  497    HB2  GLU  64           HB2      GLU  64  -3.653  13.556  -2.120
  498    HB3  GLU  64           HB3      GLU  64  -4.971  14.711  -2.259
  499    HG2  GLU  64           HG2      GLU  64  -3.505  14.030   0.280
  500    HG3  GLU  64           HG3      GLU  64  -3.233  15.462  -0.712
  501    H    ALA  65           H        ALA  65  -7.274  13.175  -3.046
  502    HA   ALA  65           HA       ALA  65  -7.299  10.610  -4.184
  503    HB1  ALA  65           HB1      ALA  65  -8.086  13.132  -5.623
  504    HB2  ALA  65           HB2      ALA  65  -9.082  12.389  -4.371
  505    HB3  ALA  65           HB3      ALA  65  -8.720  11.502  -5.852
  506    H    GLY  66           H        GLY  66  -5.340   9.821  -4.822
  507    HA2  GLY  66           HA2      GLY  66  -4.131   9.553  -6.957
  508    HA3  GLY  66           HA3      GLY  66  -3.996  11.304  -6.998
  509    H    CYS  67           H        CYS  67  -3.469  11.276  -4.021
  510    HA   CYS  67           HA       CYS  67  -0.653  11.305  -4.162
  511    HB2  CYS  67           HB2      CYS  67  -1.914  12.671  -2.559
  512    HB3  CYS  67           HB3      CYS  67  -2.446  11.214  -1.727
  513    HG   CYS  67           HG       CYS  67  -0.003  10.846  -0.919
  514    H    VAL  68           H        VAL  68   0.895   9.913  -3.320
  515    HA   VAL  68           HA       VAL  68   0.149   7.126  -3.325
  516    HB   VAL  68           HB       VAL  68   2.870   8.319  -2.787
  517   HG11  VAL  68          HG11      VAL  68   3.731   6.160  -3.403
  518   HG12  VAL  68          HG12      VAL  68   2.113   5.583  -3.803
  519   HG13  VAL  68          HG13      VAL  68   2.530   5.949  -2.129
  520   HG21  VAL  68          HG21      VAL  68   3.004   7.420  -5.330
  521   HG22  VAL  68          HG22      VAL  68   2.657   9.094  -4.894
  522   HG23  VAL  68          HG23      VAL  68   1.336   7.991  -5.279
  523    H    VAL  69           H        VAL  69  -0.823   6.397  -1.534
  524    HA   VAL  69           HA       VAL  69  -0.100   7.356   1.090
  525    HB   VAL  69           HB       VAL  69  -1.950   5.068   0.422
  526   HG11  VAL  69          HG11      VAL  69  -1.338   5.102   2.738
  527   HG12  VAL  69          HG12      VAL  69  -2.986   5.714   2.595
  528   HG13  VAL  69          HG13      VAL  69  -1.648   6.835   2.845
  529   HG21  VAL  69          HG21      VAL  69  -2.260   7.899  -0.076
  530   HG22  VAL  69          HG22      VAL  69  -3.490   7.305   1.039
  531   HG23  VAL  69          HG23      VAL  69  -3.299   6.553  -0.544
  532    H    ALA  70           H        ALA  70   0.862   4.784  -0.971
  533    HA   ALA  70           HA       ALA  70   2.799   3.870   0.916
  534    HB1  ALA  70           HB1      ALA  70   0.522   2.753   1.528
  535    HB2  ALA  70           HB2      ALA  70   2.001   1.792   1.509
  536    HB3  ALA  70           HB3      ALA  70   0.881   1.715   0.148
  537    H    ARG  71           H        ARG  71   3.303   1.335  -0.140
  538    HA   ARG  71           HA       ARG  71   3.660   1.752  -3.018
  539    HB2  ARG  71           HB2      ARG  71   5.776   1.670  -0.977
  540    HB3  ARG  71           HB3      ARG  71   6.046   0.613  -2.353
  541    HG2  ARG  71           HG2      ARG  71   5.186   3.270  -3.138
  542    HG3  ARG  71           HG3      ARG  71   6.684   3.275  -2.203
  543    HD2  ARG  71           HD2      ARG  71   7.851   2.328  -3.865
  544    HD3  ARG  71           HD3      ARG  71   6.572   1.163  -4.206
  545    HE   ARG  71           HE       ARG  71   5.725   2.570  -5.795
  546   HH11  ARG  71          HH11      ARG  71   8.224   4.217  -4.005
  547   HH12  ARG  71          HH12      ARG  71   8.344   5.526  -5.131
  548   HH21  ARG  71          HH21      ARG  71   5.884   4.293  -7.284
  549   HH22  ARG  71          HH22      ARG  71   7.016   5.571  -6.990
  550    H    LEU  72           H        LEU  72   5.003  -0.393  -3.779
  551    HA   LEU  72           HA       LEU  72   3.887  -2.751  -2.470
  552    HB2  LEU  72           HB2      LEU  72   2.832  -1.606  -4.869
  553    HB3  LEU  72           HB3      LEU  72   3.562  -3.152  -5.256
  554    HG   LEU  72           HG       LEU  72   1.132  -3.277  -4.739
  555   HD11  LEU  72          HD11      LEU  72   2.641  -5.211  -4.478
  556   HD12  LEU  72          HD12      LEU  72   1.285  -5.244  -3.351
  557   HD13  LEU  72          HD13      LEU  72   2.886  -4.762  -2.790
  558   HD21  LEU  72          HD21      LEU  72   1.855  -2.842  -1.865
  559   HD22  LEU  72          HD22      LEU  72   0.264  -2.840  -2.626
  560   HD23  LEU  72          HD23      LEU  72   1.373  -1.495  -2.896
  561    H    GLU  73           H        GLU  73   5.412  -4.250  -2.299
  562    HA   GLU  73           HA       GLU  73   7.825  -4.028  -3.918
  563    HB2  GLU  73           HB2      GLU  73   7.126  -5.194  -1.305
  564    HB3  GLU  73           HB3      GLU  73   8.271  -6.140  -2.246
  565    HG2  GLU  73           HG2      GLU  73   9.500  -3.867  -2.530
  566    HG3  GLU  73           HG3      GLU  73   8.558  -3.397  -1.116
  567    H    LEU  74           H        LEU  74   6.703  -4.727  -5.877
  568    HA   LEU  74           HA       LEU  74   5.542  -7.285  -6.133
  569    HB2  LEU  74           HB2      LEU  74   5.668  -5.115  -7.721
  570    HB3  LEU  74           HB3      LEU  74   6.887  -6.112  -8.492
  571    HG   LEU  74           HG       LEU  74   5.199  -7.926  -8.722
  572   HD11  LEU  74          HD11      LEU  74   3.798  -6.644  -6.814
  573   HD12  LEU  74          HD12      LEU  74   3.085  -7.784  -7.956
  574   HD13  LEU  74          HD13      LEU  74   2.976  -6.050  -8.258
  575   HD21  LEU  74          HD21      LEU  74   4.584  -5.250  -9.962
  576   HD22  LEU  74          HD22      LEU  74   3.873  -6.774 -10.495
  577   HD23  LEU  74          HD23      LEU  74   5.615  -6.524 -10.612
  578    H    ASP  75           H        ASP  75   6.354  -9.189  -7.074
  579    HA   ASP  75           HA       ASP  75   9.039  -9.811  -6.325
  580    HB2  ASP  75           HB2      ASP  75   7.028 -11.438  -7.898
  581    HB3  ASP  75           HB3      ASP  75   8.533 -12.054  -7.221
  582    H    ASP  76           H        ASP  76   9.760  -7.942  -7.818
  583    HA   ASP  76           HA       ASP  76   9.900  -8.520 -10.624
  584    HB2  ASP  76           HB2      ASP  76  11.204  -6.426  -8.885
  585    HB3  ASP  76           HB3      ASP  76  11.509  -6.549 -10.615
  586    H    LEU  77           H        LEU  77  12.452  -8.146  -8.158
  587    HA   LEU  77           HA       LEU  77  14.299  -9.650  -9.811
  588    HB2  LEU  77           HB2      LEU  77  14.559  -8.207  -7.185
  589    HB3  LEU  77           HB3      LEU  77  15.849  -9.209  -7.820
  590    HG   LEU  77           HG       LEU  77  16.061  -7.786  -9.771
  591   HD11  LEU  77          HD11      LEU  77  13.738  -6.276  -8.587
  592   HD12  LEU  77          HD12      LEU  77  13.780  -7.141 -10.123
  593   HD13  LEU  77          HD13      LEU  77  14.747  -5.682  -9.906
  594   HD21  LEU  77          HD21      LEU  77  17.278  -6.206  -8.716
  595   HD22  LEU  77          HD22      LEU  77  16.892  -7.165  -7.288
  596   HD23  LEU  77          HD23      LEU  77  15.946  -5.725  -7.665
  597    H    GLU  78           H        GLU  78  12.383 -11.377  -9.315
  598    HA   GLU  78           HA       GLU  78  12.709 -12.840  -6.879
  599    HB2  GLU  78           HB2      GLU  78  11.174 -14.447  -7.864
  600    HB3  GLU  78           HB3      GLU  78  10.585 -12.813  -8.132
  601    HG2  GLU  78           HG2      GLU  78  11.929 -13.115 -10.396
  602    HG3  GLU  78           HG3      GLU  78  11.590 -14.813 -10.065
  603    H    HIS  79           H        HIS  79  15.181 -12.778  -7.428
  604    HA   HIS  79           HA       HIS  79  16.178 -14.672  -9.295
  605    HB2  HIS  79           HB2      HIS  79  18.340 -14.317  -8.202
  606    HB3  HIS  79           HB3      HIS  79  17.530 -12.782  -8.497
  607    HD1  HIS  79           HD1      HIS  79  16.446 -11.617  -6.363
  608    HD2  HIS  79           HD2      HIS  79  18.963 -14.829  -5.579
  609    HE1  HIS  79           HE1      HIS  79  17.007 -11.450  -3.917
  610    HE2  HIS  79           HE2      HIS  79  18.462 -13.453  -3.447
  611    H    HIS  80           H        HIS  80  16.474 -16.804  -9.118
  612    HA   HIS  80           HA       HIS  80  15.833 -18.064  -6.546
  613    HB2  HIS  80           HB2      HIS  80  16.013 -19.424  -9.236
  614    HB3  HIS  80           HB3      HIS  80  15.262 -20.038  -7.767
  615    HD1  HIS  80           HD1      HIS  80  12.979 -18.894  -7.060
  616    HD2  HIS  80           HD2      HIS  80  14.387 -17.886 -10.836
  617    HE1  HIS  80           HE1      HIS  80  11.024 -17.854  -8.250
  618    HE2  HIS  80           HE2      HIS  80  11.923 -17.176 -10.504
  619    H    HIS  81           H        HIS  81  18.008 -17.501  -5.782
  620    HA   HIS  81           HA       HIS  81  19.933 -19.574  -6.566
  621    HB2  HIS  81           HB2      HIS  81  20.330 -16.627  -6.553
  622    HB3  HIS  81           HB3      HIS  81  21.655 -17.616  -5.948
  623    HD1  HIS  81           HD1      HIS  81  19.782 -19.277  -8.606
  624    HD2  HIS  81           HD2      HIS  81  22.983 -16.640  -8.349
  625    HE1  HIS  81           HE1      HIS  81  20.908 -19.366 -10.853
  626    HE2  HIS  81           HE2      HIS  81  22.893 -17.829 -10.645
  627    H    HIS  82           H        HIS  82  19.380 -20.747  -4.715
  628    HA   HIS  82           HA       HIS  82  20.234 -19.516  -2.176
  629    HB2  HIS  82           HB2      HIS  82  18.010 -21.481  -2.718
  630    HB3  HIS  82           HB3      HIS  82  18.659 -21.210  -1.104
  631    HD1  HIS  82           HD1      HIS  82  17.431 -19.512   0.199
  632    HD2  HIS  82           HD2      HIS  82  17.079 -18.866  -3.891
  633    HE1  HIS  82           HE1      HIS  82  15.892 -17.538  -0.039
  634    HE2  HIS  82           HE2      HIS  82  15.763 -17.112  -2.519
  635    H    HIS  83           H        HIS  83  22.004 -20.386  -1.348
  636    HA   HIS  83           HA       HIS  83  22.421 -23.223  -1.292
  637    HB2  HIS  83           HB2      HIS  83  23.217 -22.691  -3.569
  638    HB3  HIS  83           HB3      HIS  83  24.348 -21.524  -2.891
  639    HD1  HIS  83           HD1      HIS  83  23.715 -25.232  -3.080
  640    HD2  HIS  83           HD2      HIS  83  26.705 -22.588  -1.926
  641    HE1  HIS  83           HE1      HIS  83  25.753 -26.652  -2.687
  642    HE2  HIS  83           HE2      HIS  83  27.571 -25.020  -2.071
  643    H    HIS  84           H        HIS  84  23.097 -23.525   0.717
  644    HA   HIS  84           HA       HIS  84  25.234 -21.816   1.767
  645    HB2  HIS  84           HB2      HIS  84  22.864 -21.154   2.578
  646    HB3  HIS  84           HB3      HIS  84  22.942 -22.629   3.535
  647    HD1  HIS  84           HD1      HIS  84  22.806 -20.963   5.619
  648    HD2  HIS  84           HD2      HIS  84  26.294 -20.774   3.368
  649    HE1  HIS  84           HE1      HIS  84  24.471 -19.751   7.061
  650    HE2  HIS  84           HE2      HIS  84  26.547 -19.572   5.645
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1   3.681  10.753 -13.753
    2    H2   MET   1           H2       MET   1   2.452  11.493 -14.691
    3    H3   MET   1           H3       MET   1   2.131  11.030 -13.069
    4    HA   MET   1           HA       MET   1   1.135   9.429 -14.354
    5    HB2  MET   1           HB2      MET   1   3.652   9.684 -15.974
    6    HB3  MET   1           HB3      MET   1   2.660   8.237 -16.097
    7    HG2  MET   1           HG2      MET   1   1.669  11.036 -16.583
    8    HG3  MET   1           HG3      MET   1   2.193   9.920 -17.842
    9    HE1  MET   1           HE1      MET   1  -1.876  10.461 -16.275
   10    HE2  MET   1           HE2      MET   1  -0.449  11.496 -16.220
   11    HE3  MET   1           HE3      MET   1  -0.733  10.318 -14.939
   12    H    GLU   2           H        GLU   2   2.523   9.458 -11.894
   13    HA   GLU   2           HA       GLU   2   4.218   7.125 -11.775
   14    HB2  GLU   2           HB2      GLU   2   3.026   8.716  -9.499
   15    HB3  GLU   2           HB3      GLU   2   4.364   7.580  -9.398
   16    HG2  GLU   2           HG2      GLU   2   5.505   9.547  -9.433
   17    HG3  GLU   2           HG3      GLU   2   5.449   9.193 -11.159
   18    H    ASN   3           H        ASN   3   3.400   5.147 -11.852
   19    HA   ASN   3           HA       ASN   3   1.425   4.249 -10.030
   20    HB2  ASN   3           HB2      ASN   3   0.562   5.002 -12.768
   21    HB3  ASN   3           HB3      ASN   3  -0.049   3.472 -12.144
   22   HD21  ASN   3          HD21      ASN   3  -1.703   5.603 -12.738
   23   HD22  ASN   3          HD22      ASN   3  -2.393   6.207 -11.275
   24    H    ASP   4           H        ASP   4   1.717   2.135  -9.685
   25    HA   ASP   4           HA       ASP   4   2.558   0.344 -11.779
   26    HB2  ASP   4           HB2      ASP   4   4.468   1.385  -9.759
   27    HB3  ASP   4           HB3      ASP   4   4.531  -0.345 -10.084
   28    HA   PRO   5           HA       PRO   5   0.531  -2.651  -9.271
   29    HB2  PRO   5           HB2      PRO   5   2.025  -4.893  -9.607
   30    HB3  PRO   5           HB3      PRO   5   0.991  -4.229 -10.877
   31    HG2  PRO   5           HG2      PRO   5   3.946  -3.941 -10.498
   32    HG3  PRO   5           HG3      PRO   5   3.034  -4.252 -11.987
   33    HD2  PRO   5           HD2      PRO   5   3.965  -1.795 -11.338
   34    HD3  PRO   5           HD3      PRO   5   2.459  -2.034 -12.247
   35    H    THR   6           H        THR   6   3.969  -2.232  -8.712
   36    HA   THR   6           HA       THR   6   3.816  -3.498  -6.095
   37    HB   THR   6           HB       THR   6   6.188  -3.298  -6.007
   38    HG1  THR   6           HG1      THR   6   7.333  -1.936  -7.254
   39   HG21  THR   6          HG21      THR   6   5.484  -3.823  -8.884
   40   HG22  THR   6          HG22      THR   6   5.445  -5.010  -7.579
   41   HG23  THR   6          HG23      THR   6   6.977  -4.288  -8.070
   42    H    VAL   7           H        VAL   7   2.223  -1.163  -6.412
   43    HA   VAL   7           HA       VAL   7   3.355   0.446  -4.268
   44    HB   VAL   7           HB       VAL   7   2.297   1.809  -6.740
   45   HG11  VAL   7          HG11      VAL   7   3.757   2.818  -4.303
   46   HG12  VAL   7          HG12      VAL   7   2.068   3.107  -4.720
   47   HG13  VAL   7          HG13      VAL   7   3.352   3.795  -5.715
   48   HG21  VAL   7          HG21      VAL   7   4.330   0.712  -7.395
   49   HG22  VAL   7          HG22      VAL   7   5.157   1.278  -5.944
   50   HG23  VAL   7          HG23      VAL   7   4.667   2.430  -7.186
   51    H    LEU   8           H        LEU   8   1.840   0.726  -2.779
   52    HA   LEU   8           HA       LEU   8  -0.946   0.243  -3.455
   53    HB2  LEU   8           HB2      LEU   8   0.560  -0.437  -1.290
   54    HB3  LEU   8           HB3      LEU   8  -0.261   0.992  -0.691
   55    HG   LEU   8           HG       LEU   8  -1.560  -0.896  -0.049
   56   HD11  LEU   8          HD11      LEU   8  -3.626  -0.231  -0.788
   57   HD12  LEU   8          HD12      LEU   8  -3.081  -0.005  -2.450
   58   HD13  LEU   8          HD13      LEU   8  -2.654   1.178  -1.214
   59   HD21  LEU   8          HD21      LEU   8  -2.042  -1.822  -2.824
   60   HD22  LEU   8          HD22      LEU   8  -2.003  -2.733  -1.314
   61   HD23  LEU   8          HD23      LEU   8  -0.496  -2.233  -2.081
   62    H    ARG   9           H        ARG   9  -2.579   1.721  -3.321
   63    HA   ARG   9           HA       ARG   9  -2.050   4.393  -2.314
   64    HB2  ARG   9           HB2      ARG   9  -2.963   3.997  -5.167
   65    HB3  ARG   9           HB3      ARG   9  -2.658   5.529  -4.359
   66    HG2  ARG   9           HG2      ARG   9  -0.258   4.668  -4.067
   67    HG3  ARG   9           HG3      ARG   9  -0.691   3.475  -5.293
   68    HD2  ARG   9           HD2      ARG   9  -1.454   5.437  -6.714
   69    HD3  ARG   9           HD3      ARG   9  -0.634   6.470  -5.545
   70    HE   ARG   9           HE       ARG   9   1.016   4.363  -6.601
   71   HH11  ARG   9          HH11      ARG   9  -0.123   7.627  -7.082
   72   HH12  ARG   9          HH12      ARG   9   1.230   8.087  -8.059
   73   HH21  ARG   9          HH21      ARG   9   2.796   4.967  -7.885
   74   HH22  ARG   9          HH22      ARG   9   2.887   6.578  -8.516
   75    H    SER  10           H        SER  10  -3.850   5.392  -1.559
   76    HA   SER  10           HA       SER  10  -6.187   3.833  -1.164
   77    HB2  SER  10           HB2      SER  10  -5.257   6.541  -0.398
   78    HB3  SER  10           HB3      SER  10  -7.004   6.305  -0.443
   79    HG   SER  10           HG       SER  10  -5.270   4.519   0.899
   80    HA   PRO  11           HA       PRO  11  -8.527   4.909  -4.755
   81    HB2  PRO  11           HB2      PRO  11 -11.035   4.467  -3.863
   82    HB3  PRO  11           HB3      PRO  11  -9.896   3.149  -4.162
   83    HG2  PRO  11           HG2      PRO  11 -10.648   4.452  -1.574
   84    HG3  PRO  11           HG3      PRO  11 -10.429   2.730  -1.937
   85    HD2  PRO  11           HD2      PRO  11  -8.529   4.246  -0.711
   86    HD3  PRO  11           HD3      PRO  11  -8.143   2.852  -1.739
   87    H    SER  12           H        SER  12  -9.197   6.468  -1.693
   88    HA   SER  12           HA       SER  12  -9.773   8.952  -3.067
   89    HB2  SER  12           HB2      SER  12 -11.789   7.834  -1.106
   90    HB3  SER  12           HB3      SER  12 -11.907   9.350  -1.998
   91    HG   SER  12           HG       SER  12 -13.123   7.662  -2.969
   92    H    ALA  13           H        ALA  13 -10.276  10.703  -1.306
   93    HA   ALA  13           HA       ALA  13  -8.046  10.677   0.493
   94    HB1  ALA  13           HB1      ALA  13  -8.731  12.720  -0.666
   95    HB2  ALA  13           HB2      ALA  13  -8.753  12.933   1.084
   96    HB3  ALA  13           HB3      ALA  13 -10.264  12.701   0.205
   97    H    GLY  14           H        GLY  14  -8.000  10.106   2.570
   98    HA2  GLY  14           HA2      GLY  14 -10.440  10.186   4.168
   99    HA3  GLY  14           HA3      GLY  14  -9.702   8.607   3.945
  100    H    LYS  15           H        LYS  15  -8.849   8.105   5.866
  101    HA   LYS  15           HA       LYS  15  -6.598   9.595   6.827
  102    HB2  LYS  15           HB2      LYS  15  -8.671  10.775   7.770
  103    HB3  LYS  15           HB3      LYS  15  -8.896   9.337   8.756
  104    HG2  LYS  15           HG2      LYS  15  -6.207  10.532   8.835
  105    HG3  LYS  15           HG3      LYS  15  -7.505  11.494   9.545
  106    HD2  LYS  15           HD2      LYS  15  -7.338   8.604  10.239
  107    HD3  LYS  15           HD3      LYS  15  -6.172   9.711  10.967
  108    HE2  LYS  15           HE2      LYS  15  -7.846   9.813  12.522
  109    HE3  LYS  15           HE3      LYS  15  -8.334  11.131  11.457
  110    HZ1  LYS  15           HZ1      LYS  15 -10.124   9.515  12.128
  111    HZ2  LYS  15           HZ2      LYS  15  -9.363   8.372  11.141
  112    HZ3  LYS  15           HZ3      LYS  15  -9.975   9.797  10.466
  113    H    LEU  16           H        LEU  16  -5.239   8.339   8.027
  114    HA   LEU  16           HA       LEU  16  -5.650   5.534   7.998
  115    HB2  LEU  16           HB2      LEU  16  -3.444   6.890   7.957
  116    HB3  LEU  16           HB3      LEU  16  -3.600   6.911   9.701
  117    HG   LEU  16           HG       LEU  16  -3.459   4.508   9.810
  118   HD11  LEU  16          HD11      LEU  16  -2.986   3.231   7.687
  119   HD12  LEU  16          HD12      LEU  16  -3.543   4.655   6.808
  120   HD13  LEU  16          HD13      LEU  16  -4.643   3.801   7.890
  121   HD21  LEU  16          HD21      LEU  16  -1.218   4.379   9.508
  122   HD22  LEU  16          HD22      LEU  16  -1.395   6.118   9.275
  123   HD23  LEU  16          HD23      LEU  16  -1.286   5.048   7.878
  124    H    THR  17           H        THR  17  -7.379   4.870   9.199
  125    HA   THR  17           HA       THR  17  -7.853   5.821  11.860
  126    HB   THR  17           HB       THR  17  -9.671   5.075  10.337
  127    HG1  THR  17           HG1      THR  17 -10.789   4.575  12.037
  128   HG21  THR  17          HG21      THR  17  -9.075   2.242  11.006
  129   HG22  THR  17          HG22      THR  17  -8.289   2.983   9.612
  130   HG23  THR  17          HG23      THR  17 -10.049   2.917   9.700
  131    H    GLN  18           H        GLN  18  -6.505   2.861  10.450
  132    HA   GLN  18           HA       GLN  18  -4.939   2.354  12.777
  133    HB2  GLN  18           HB2      GLN  18  -7.492   1.461  13.055
  134    HB3  GLN  18           HB3      GLN  18  -6.731   0.050  12.333
  135    HG2  GLN  18           HG2      GLN  18  -4.917   0.529  14.196
  136    HG3  GLN  18           HG3      GLN  18  -6.293   1.299  14.985
  137   HE21  GLN  18          HE21      GLN  18  -5.571  -0.567  16.468
  138   HE22  GLN  18          HE22      GLN  18  -6.433  -2.050  16.264
  139    H    TYR  19           H        TYR  19  -4.595  -0.438  12.419
  140    HA   TYR  19           HA       TYR  19  -3.910  -0.842   9.624
  141    HB2  TYR  19           HB2      TYR  19  -1.546  -1.419  10.194
  142    HB3  TYR  19           HB3      TYR  19  -1.925   0.289  10.392
  143    HD1  TYR  19           HD2      TYR  19  -1.143  -2.842  12.139
  144    HD2  TYR  19           HD1      TYR  19  -1.944   1.313  12.583
  145    HE1  TYR  19           HE2      TYR  19  -0.316  -2.936  14.452
  146    HE2  TYR  19           HE1      TYR  19  -1.119   1.230  14.898
  147    HH   TYR  19           HH       TYR  19  -0.934  -1.097  16.704
  148    H    THR  20           H        THR  20  -3.810  -2.974   9.047
  149    HA   THR  20           HA       THR  20  -4.658  -4.878  11.093
  150    HB   THR  20           HB       THR  20  -5.460  -6.248   9.329
  151    HG1  THR  20           HG1      THR  20  -4.464  -6.324   7.502
  152   HG21  THR  20          HG21      THR  20  -6.688  -4.614   7.799
  153   HG22  THR  20          HG22      THR  20  -5.958  -3.349   8.787
  154   HG23  THR  20          HG23      THR  20  -7.024  -4.542   9.528
  155    H    VAL  21           H        VAL  21  -1.852  -4.006   9.367
  156    HA   VAL  21           HA       VAL  21  -0.451  -6.307  10.465
  157    HB   VAL  21           HB       VAL  21   0.697  -6.810   8.347
  158   HG11  VAL  21          HG11      VAL  21  -1.096  -8.061   7.322
  159   HG12  VAL  21          HG12      VAL  21  -2.300  -7.040   8.109
  160   HG13  VAL  21          HG13      VAL  21  -1.277  -8.103   9.076
  161   HG21  VAL  21          HG21      VAL  21   0.189  -4.507   7.374
  162   HG22  VAL  21          HG22      VAL  21  -1.390  -5.166   6.944
  163   HG23  VAL  21          HG23      VAL  21   0.076  -5.885   6.278
  164    H    GLU  22           H        GLU  22   1.727  -5.967  10.822
  165    HA   GLU  22           HA       GLU  22   2.547  -3.273  11.152
  166    HB2  GLU  22           HB2      GLU  22   4.662  -4.212  11.922
  167    HB3  GLU  22           HB3      GLU  22   3.308  -5.086  12.626
  168    HG2  GLU  22           HG2      GLU  22   3.928  -6.446  10.265
  169    HG3  GLU  22           HG3      GLU  22   5.476  -6.059  11.015
  170    H    ASP  23           H        ASP  23   5.008  -2.852  10.407
  171    HA   ASP  23           HA       ASP  23   4.883  -2.265   7.673
  172    HB2  ASP  23           HB2      ASP  23   6.317  -1.052   9.279
  173    HB3  ASP  23           HB3      ASP  23   7.346  -2.474   9.419
  174    H    GLY  24           H        GLY  24   5.250  -3.449   5.913
  175    HA2  GLY  24           HA2      GLY  24   6.124  -5.081   4.535
  176    HA3  GLY  24           HA3      GLY  24   7.233  -5.516   5.828
  177    H    GLY  25           H        GLY  25   3.796  -5.433   6.383
  178    HA2  GLY  25           HA2      GLY  25   3.763  -8.129   7.281
  179    HA3  GLY  25           HA3      GLY  25   2.359  -7.096   7.061
  180    H    HIS  26           H        HIS  26   3.893  -9.848   6.000
  181    HA   HIS  26           HA       HIS  26   3.367  -9.850   3.240
  182    HB2  HIS  26           HB2      HIS  26   4.811 -11.490   4.506
  183    HB3  HIS  26           HB3      HIS  26   3.329 -12.272   5.046
  184    HD1  HIS  26           HD1      HIS  26   3.782 -14.456   3.800
  185    HD2  HIS  26           HD2      HIS  26   3.713 -11.119   1.326
  186    HE1  HIS  26           HE1      HIS  26   3.736 -15.360   1.454
  187    HE2  HIS  26           HE2      HIS  26   3.782 -13.322  -0.027
  188    H    VAL  27           H        VAL  27   1.506  -9.838   2.178
  189    HA   VAL  27           HA       VAL  27  -0.799 -11.264   3.256
  190    HB   VAL  27           HB       VAL  27  -2.317  -9.370   2.846
  191   HG11  VAL  27          HG11      VAL  27  -1.292  -9.845   5.094
  192   HG12  VAL  27          HG12      VAL  27  -1.866  -8.194   4.859
  193   HG13  VAL  27          HG13      VAL  27  -0.142  -8.550   4.758
  194   HG21  VAL  27          HG21      VAL  27  -1.472  -7.858   1.393
  195   HG22  VAL  27          HG22      VAL  27   0.190  -8.116   1.924
  196   HG23  VAL  27          HG23      VAL  27  -0.889  -7.090   2.870
  197    H    GLU  28           H        GLU  28  -2.045 -12.182   1.709
  198    HA   GLU  28           HA       GLU  28  -1.112 -12.007  -1.025
  199    HB2  GLU  28           HB2      GLU  28  -2.529 -13.894  -1.463
  200    HB3  GLU  28           HB3      GLU  28  -1.695 -14.181   0.058
  201    HG2  GLU  28           HG2      GLU  28  -4.143 -12.877   0.640
  202    HG3  GLU  28           HG3      GLU  28  -4.479 -14.197  -0.478
  203    H    ALA  29           H        ALA  29  -2.698 -11.819  -2.822
  204    HA   ALA  29           HA       ALA  29  -3.968  -9.397  -2.894
  205    HB1  ALA  29           HB1      ALA  29  -4.588  -9.945  -4.993
  206    HB2  ALA  29           HB2      ALA  29  -5.264 -11.499  -4.504
  207    HB3  ALA  29           HB3      ALA  29  -3.522 -11.322  -4.715
  208    H    GLY  30           H        GLY  30  -5.820  -8.555  -2.159
  209    HA2  GLY  30           HA2      GLY  30  -8.135  -8.605  -1.646
  210    HA3  GLY  30           HA3      GLY  30  -8.025 -10.346  -1.438
  211    H    SER  31           H        SER  31  -5.567 -10.016   0.233
  212    HA   SER  31           HA       SER  31  -6.888  -9.869   2.754
  213    HB2  SER  31           HB2      SER  31  -3.972 -10.097   1.994
  214    HB3  SER  31           HB3      SER  31  -4.536 -10.102   3.665
  215    HG   SER  31           HG       SER  31  -5.520 -11.898   1.711
  216    H    SER  32           H        SER  32  -7.268  -8.148   3.976
  217    HA   SER  32           HA       SER  32  -6.527  -5.539   3.168
  218    HB2  SER  32           HB2      SER  32  -7.389  -5.001   5.584
  219    HB3  SER  32           HB3      SER  32  -8.521  -5.573   4.358
  220    HG   SER  32           HG       SER  32  -8.547  -6.634   6.511
  221    H    TYR  33           H        TYR  33  -5.010  -4.133   3.932
  222    HA   TYR  33           HA       TYR  33  -2.980  -5.271   5.741
  223    HB2  TYR  33           HB2      TYR  33  -1.295  -4.013   4.567
  224    HB3  TYR  33           HB3      TYR  33  -2.230  -4.922   3.384
  225    HD1  TYR  33           HD2      TYR  33  -3.752  -3.768   1.851
  226    HD2  TYR  33           HD1      TYR  33  -1.373  -1.602   4.635
  227    HE1  TYR  33           HE2      TYR  33  -4.194  -1.694   0.606
  228    HE2  TYR  33           HE1      TYR  33  -1.810   0.478   3.399
  229    HH   TYR  33           HH       TYR  33  -2.470   1.200   1.182
  230    H    ALA  34           H        ALA  34  -5.305  -2.851   5.393
  231    HA   ALA  34           HA       ALA  34  -4.713  -1.681   7.897
  232    HB1  ALA  34           HB1      ALA  34  -4.338   0.305   5.698
  233    HB2  ALA  34           HB2      ALA  34  -2.975  -0.674   6.240
  234    HB3  ALA  34           HB3      ALA  34  -3.812   0.380   7.380
  235    H    GLU  35           H        GLU  35  -5.961   0.684   7.828
  236    HA   GLU  35           HA       GLU  35  -8.454   0.405   6.347
  237    HB2  GLU  35           HB2      GLU  35  -8.580   0.825   9.322
  238    HB3  GLU  35           HB3      GLU  35  -9.878   0.384   8.223
  239    HG2  GLU  35           HG2      GLU  35  -8.503  -1.774   7.851
  240    HG3  GLU  35           HG3      GLU  35  -7.699  -1.317   9.351
  241    H    MET  36           H        MET  36  -9.840   2.339   6.565
  242    HA   MET  36           HA       MET  36  -8.580   4.728   7.614
  243    HB2  MET  36           HB2      MET  36  -8.593   5.939   5.511
  244    HB3  MET  36           HB3      MET  36  -7.594   4.501   5.362
  245    HG2  MET  36           HG2      MET  36  -9.874   3.479   4.471
  246    HG3  MET  36           HG3      MET  36 -10.168   5.170   4.066
  247    HE1  MET  36           HE1      MET  36  -9.678   4.784   0.859
  248    HE2  MET  36           HE2      MET  36 -10.595   3.822   2.018
  249    HE3  MET  36           HE3      MET  36  -9.386   3.050   0.993
  250    H    GLU  37           H        GLU  37 -10.100   5.925   8.534
  251    HA   GLU  37           HA       GLU  37 -12.895   5.397   7.921
  252    HB2  GLU  37           HB2      GLU  37 -11.977   5.543  10.282
  253    HB3  GLU  37           HB3      GLU  37 -11.801   7.273  10.017
  254    HG2  GLU  37           HG2      GLU  37 -14.327   7.123   9.358
  255    HG3  GLU  37           HG3      GLU  37 -14.271   5.640  10.310
  256    H    VAL  38           H        VAL  38 -13.768   6.491   6.298
  257    HA   VAL  38           HA       VAL  38 -12.833   9.179   5.658
  258    HB   VAL  38           HB       VAL  38 -15.035   7.843   4.139
  259   HG11  VAL  38          HG11      VAL  38 -13.451   8.886   2.287
  260   HG12  VAL  38          HG12      VAL  38 -12.932   9.878   3.650
  261   HG13  VAL  38          HG13      VAL  38 -14.628   9.861   3.167
  262   HG21  VAL  38          HG21      VAL  38 -13.320   6.691   2.741
  263   HG22  VAL  38          HG22      VAL  38 -13.483   6.030   4.368
  264   HG23  VAL  38          HG23      VAL  38 -12.122   7.081   3.975
  265    H    MET  39           H        MET  39 -14.648  10.751   4.959
  266    HA   MET  39           HA       MET  39 -16.154  11.436   7.206
  267    HB2  MET  39           HB2      MET  39 -16.848  12.266   4.392
  268    HB3  MET  39           HB3      MET  39 -17.120  13.160   5.881
  269    HG2  MET  39           HG2      MET  39 -14.366  12.716   5.774
  270    HG3  MET  39           HG3      MET  39 -14.839  13.156   4.134
  271    HE1  MET  39           HE1      MET  39 -14.570  15.246   3.386
  272    HE2  MET  39           HE2      MET  39 -14.949  16.781   4.167
  273    HE3  MET  39           HE3      MET  39 -16.250  15.697   3.673
  274    H    LYS  40           H        LYS  40 -16.900   9.376   4.499
  275    HA   LYS  40           HA       LYS  40 -19.726   9.287   5.001
  276    HB2  LYS  40           HB2      LYS  40 -17.833   7.886   3.167
  277    HB3  LYS  40           HB3      LYS  40 -19.403   7.153   3.465
  278    HG2  LYS  40           HG2      LYS  40 -19.813   8.413   1.588
  279    HG3  LYS  40           HG3      LYS  40 -20.324   9.509   2.874
  280    HD2  LYS  40           HD2      LYS  40 -18.258  10.722   2.743
  281    HD3  LYS  40           HD3      LYS  40 -17.583   9.542   1.617
  282    HE2  LYS  40           HE2      LYS  40 -19.275  10.160  -0.039
  283    HE3  LYS  40           HE3      LYS  40 -19.952  11.334   1.088
  284    HZ1  LYS  40           HZ1      LYS  40 -18.490  12.385  -0.524
  285    HZ2  LYS  40           HZ2      LYS  40 -17.201  11.406  -0.030
  286    HZ3  LYS  40           HZ3      LYS  40 -17.860  12.538   1.040
  287    H    MET  41           H        MET  41 -17.402   6.588   4.991
  288    HA   MET  41           HA       MET  41 -18.273   5.757   7.631
  289    HB2  MET  41           HB2      MET  41 -19.075   4.384   5.125
  290    HB3  MET  41           HB3      MET  41 -18.557   3.358   6.456
  291    HG2  MET  41           HG2      MET  41 -20.687   5.464   6.709
  292    HG3  MET  41           HG3      MET  41 -21.015   3.777   6.320
  293    HE1  MET  41           HE1      MET  41 -20.591   1.873   9.527
  294    HE2  MET  41           HE2      MET  41 -19.868   1.807   7.920
  295    HE3  MET  41           HE3      MET  41 -21.600   2.086   8.097
  296    H    ILE  42           H        ILE  42 -17.207   3.358   7.917
  297    HA   ILE  42           HA       ILE  42 -14.373   3.860   7.681
  298    HB   ILE  42           HB       ILE  42 -15.232   2.926   9.757
  299   HG12  ILE  42          HG12      ILE  42 -13.697   1.010   9.992
  300   HG13  ILE  42          HG13      ILE  42 -13.546   0.920   8.240
  301   HG21  ILE  42          HG21      ILE  42 -17.134   1.712   9.090
  302   HG22  ILE  42          HG22      ILE  42 -16.010   0.514   9.731
  303   HG23  ILE  42          HG23      ILE  42 -16.201   0.700   7.988
  304   HD11  ILE  42          HD11      ILE  42 -12.920   3.563   8.987
  305   HD12  ILE  42          HD12      ILE  42 -11.845   2.320   8.347
  306   HD13  ILE  42          HD13      ILE  42 -12.062   2.486  10.089
  307    H    MET  43           H        MET  43 -12.860   2.484   6.665
  308    HA   MET  43           HA       MET  43 -13.890   0.442   4.855
  309    HB2  MET  43           HB2      MET  43 -12.519   2.969   4.004
  310    HB3  MET  43           HB3      MET  43 -12.320   1.500   3.058
  311    HG2  MET  43           HG2      MET  43 -15.073   2.350   3.775
  312    HG3  MET  43           HG3      MET  43 -14.212   3.249   2.527
  313    HE1  MET  43           HE1      MET  43 -14.730   2.489  -0.047
  314    HE2  MET  43           HE2      MET  43 -13.904   0.973  -0.409
  315    HE3  MET  43           HE3      MET  43 -13.093   2.214   0.547
  316    H    THR  44           H        THR  44 -12.177  -0.888   3.907
  317    HA   THR  44           HA       THR  44  -9.749  -0.905   5.579
  318    HB   THR  44           HB       THR  44 -10.464  -3.478   4.392
  319    HG1  THR  44           HG1      THR  44 -12.563  -2.889   4.782
  320   HG21  THR  44          HG21      THR  44 -10.136  -2.760   7.288
  321   HG22  THR  44          HG22      THR  44  -8.789  -3.113   6.206
  322   HG23  THR  44          HG23      THR  44  -9.999  -4.352   6.541
  323    H    LEU  45           H        LEU  45  -7.830  -0.971   4.568
  324    HA   LEU  45           HA       LEU  45  -7.838  -0.909   1.652
  325    HB2  LEU  45           HB2      LEU  45  -5.579  -0.390   3.588
  326    HB3  LEU  45           HB3      LEU  45  -5.541  -0.106   1.858
  327    HG   LEU  45           HG       LEU  45  -7.629   1.443   2.453
  328   HD11  LEU  45          HD11      LEU  45  -6.247   0.945   5.014
  329   HD12  LEU  45          HD12      LEU  45  -7.923   1.393   4.692
  330   HD13  LEU  45          HD13      LEU  45  -6.658   2.622   4.653
  331   HD21  LEU  45          HD21      LEU  45  -5.950   2.504   1.326
  332   HD22  LEU  45          HD22      LEU  45  -4.698   1.942   2.434
  333   HD23  LEU  45          HD23      LEU  45  -5.770   3.259   2.910
  334    H    ASN  46           H        ASN  46  -7.065  -2.504   0.398
  335    HA   ASN  46           HA       ASN  46  -5.534  -4.664   1.681
  336    HB2  ASN  46           HB2      ASN  46  -6.826  -6.136  -0.098
  337    HB3  ASN  46           HB3      ASN  46  -7.527  -5.795   1.480
  338   HD21  ASN  46          HD21      ASN  46  -7.290  -4.104  -1.636
  339   HD22  ASN  46          HD22      ASN  46  -8.969  -3.713  -1.742
  340    H    VAL  47           H        VAL  47  -4.561  -6.150  -0.058
  341    HA   VAL  47           HA       VAL  47  -3.173  -4.425  -1.960
  342    HB   VAL  47           HB       VAL  47  -1.650  -6.357  -2.267
  343   HG11  VAL  47          HG11      VAL  47  -1.915  -5.864   0.674
  344   HG12  VAL  47          HG12      VAL  47  -1.469  -4.557  -0.423
  345   HG13  VAL  47          HG13      VAL  47  -0.457  -5.997  -0.308
  346   HG21  VAL  47          HG21      VAL  47  -3.571  -7.980  -1.563
  347   HG22  VAL  47          HG22      VAL  47  -2.942  -7.708   0.062
  348   HG23  VAL  47          HG23      VAL  47  -1.895  -8.380  -1.188
  349    H    GLN  48           H        GLN  48  -2.869  -5.045  -4.163
  350    HA   GLN  48           HA       GLN  48  -5.243  -6.255  -5.300
  351    HB2  GLN  48           HB2      GLN  48  -4.511  -5.384  -7.400
  352    HB3  GLN  48           HB3      GLN  48  -4.237  -4.137  -6.193
  353    HG2  GLN  48           HG2      GLN  48  -2.029  -6.000  -6.956
  354    HG3  GLN  48           HG3      GLN  48  -2.429  -4.620  -7.976
  355   HE21  GLN  48          HE21      GLN  48  -0.763  -5.692  -5.248
  356   HE22  GLN  48          HE22      GLN  48  -0.263  -4.154  -4.641
  357    H    GLU  49           H        GLU  49  -2.028  -7.190  -4.560
  358    HA   GLU  49           HA       GLU  49  -2.519  -9.824  -5.647
  359    HB2  GLU  49           HB2      GLU  49  -0.239  -8.104  -6.629
  360    HB3  GLU  49           HB3      GLU  49  -0.305  -9.848  -6.845
  361    HG2  GLU  49           HG2      GLU  49  -2.305  -7.869  -7.916
  362    HG3  GLU  49           HG3      GLU  49  -1.025  -8.650  -8.843
  363    H    ARG  50           H        ARG  50  -0.428 -11.213  -5.232
  364    HA   ARG  50           HA       ARG  50   0.015 -11.157  -2.432
  365    HB2  ARG  50           HB2      ARG  50   1.193 -12.778  -4.678
  366    HB3  ARG  50           HB3      ARG  50   1.737 -12.969  -3.017
  367    HG2  ARG  50           HG2      ARG  50   0.149 -14.636  -3.260
  368    HG3  ARG  50           HG3      ARG  50  -0.746 -13.339  -2.466
  369    HD2  ARG  50           HD2      ARG  50  -2.008 -14.375  -4.315
  370    HD3  ARG  50           HD3      ARG  50  -1.706 -12.658  -4.575
  371    HE   ARG  50           HE       ARG  50   0.306 -14.260  -5.785
  372   HH11  ARG  50          HH11      ARG  50  -2.976 -13.149  -6.195
  373   HH12  ARG  50          HH12      ARG  50  -2.937 -13.279  -7.921
  374   HH21  ARG  50          HH21      ARG  50   0.360 -14.432  -8.056
  375   HH22  ARG  50          HH22      ARG  50  -1.044 -14.008  -8.978
  376    H    GLY  51           H        GLY  51   1.753 -10.513  -1.237
  377    HA2  GLY  51           HA2      GLY  51   4.329 -10.029  -1.927
  378    HA3  GLY  51           HA3      GLY  51   3.505  -8.570  -2.456
  379    H    ARG  52           H        ARG  52   5.379  -8.129  -0.676
  380    HA   ARG  52           HA       ARG  52   4.205  -8.171   1.998
  381    HB2  ARG  52           HB2      ARG  52   6.936  -7.838   0.892
  382    HB3  ARG  52           HB3      ARG  52   6.578  -6.954   2.370
  383    HG2  ARG  52           HG2      ARG  52   7.500  -8.987   3.071
  384    HG3  ARG  52           HG3      ARG  52   5.761  -9.162   3.317
  385    HD2  ARG  52           HD2      ARG  52   6.544 -11.181   2.329
  386    HD3  ARG  52           HD3      ARG  52   5.652 -10.301   1.090
  387    HE   ARG  52           HE       ARG  52   7.591 -10.086  -0.112
  388   HH11  ARG  52          HH11      ARG  52   8.372 -11.097   3.135
  389   HH12  ARG  52          HH12      ARG  52  10.039 -11.395   2.775
  390   HH21  ARG  52          HH21      ARG  52   9.784 -10.477  -0.587
  391   HH22  ARG  52          HH22      ARG  52  10.842 -11.043   0.662
  392    H    VAL  53           H        VAL  53   3.073  -6.506   2.719
  393    HA   VAL  53           HA       VAL  53   3.043  -4.005   1.280
  394    HB   VAL  53           HB       VAL  53   1.600  -4.676   3.846
  395   HG11  VAL  53          HG11      VAL  53   0.036  -2.923   3.081
  396   HG12  VAL  53          HG12      VAL  53   1.114  -2.587   1.725
  397   HG13  VAL  53          HG13      VAL  53   1.662  -2.307   3.378
  398   HG21  VAL  53          HG21      VAL  53  -0.324  -5.240   2.421
  399   HG22  VAL  53          HG22      VAL  53   1.039  -6.329   2.159
  400   HG23  VAL  53          HG23      VAL  53   0.694  -5.051   0.993
  401    H    LYS  54           H        LYS  54   4.255  -2.294   1.720
  402    HA   LYS  54           HA       LYS  54   5.517  -2.112   4.377
  403    HB2  LYS  54           HB2      LYS  54   6.577  -0.839   1.859
  404    HB3  LYS  54           HB3      LYS  54   7.414  -1.079   3.387
  405    HG2  LYS  54           HG2      LYS  54   7.317  -3.525   3.000
  406    HG3  LYS  54           HG3      LYS  54   6.609  -3.206   1.415
  407    HD2  LYS  54           HD2      LYS  54   8.628  -1.847   0.866
  408    HD3  LYS  54           HD3      LYS  54   9.336  -2.370   2.395
  409    HE2  LYS  54           HE2      LYS  54   8.419  -4.233   0.210
  410    HE3  LYS  54           HE3      LYS  54  10.085  -3.699   0.431
  411    HZ1  LYS  54           HZ1      LYS  54   9.859  -4.636   2.761
  412    HZ2  LYS  54           HZ2      LYS  54   9.954  -5.756   1.497
  413    HZ3  LYS  54           HZ3      LYS  54   8.459  -5.412   2.211
  414    H    TYR  55           H        TYR  55   4.507  -0.642   5.570
  415    HA   TYR  55           HA       TYR  55   2.800   1.351   4.641
  416    HB2  TYR  55           HB2      TYR  55   4.170   0.787   7.222
  417    HB3  TYR  55           HB3      TYR  55   3.471   2.389   7.006
  418    HD1  TYR  55           HD1      TYR  55   2.212  -0.893   5.779
  419    HD2  TYR  55           HD2      TYR  55   1.609   2.393   8.414
  420    HE1  TYR  55           HE1      TYR  55  -0.001  -1.785   6.375
  421    HE2  TYR  55           HE2      TYR  55  -0.605   1.509   9.019
  422    HH   TYR  55           HH       TYR  55  -1.617  -1.638   8.192
  423    H    ILE  56           H        ILE  56   3.070   3.349   3.875
  424    HA   ILE  56           HA       ILE  56   5.806   4.411   3.743
  425    HB   ILE  56           HB       ILE  56   3.453   4.587   1.934
  426   HG12  ILE  56          HG12      ILE  56   5.114   4.301   0.217
  427   HG13  ILE  56          HG13      ILE  56   6.417   4.655   1.346
  428   HG21  ILE  56          HG21      ILE  56   4.544   6.606   0.822
  429   HG22  ILE  56          HG22      ILE  56   5.375   6.854   2.358
  430   HG23  ILE  56          HG23      ILE  56   3.614   6.899   2.292
  431   HD11  ILE  56          HD11      ILE  56   4.656   2.223   1.294
  432   HD12  ILE  56          HD12      ILE  56   5.794   2.590   2.590
  433   HD13  ILE  56          HD13      ILE  56   6.383   2.313   0.951
  434    H    LYS  57           H        LYS  57   2.459   5.554   4.116
  435    HA   LYS  57           HA       LYS  57   3.233   8.085   5.171
  436    HB2  LYS  57           HB2      LYS  57   0.858   6.842   4.268
  437    HB3  LYS  57           HB3      LYS  57   0.553   7.382   5.914
  438    HG2  LYS  57           HG2      LYS  57  -0.087   9.065   4.267
  439    HG3  LYS  57           HG3      LYS  57   1.207   9.642   5.320
  440    HD2  LYS  57           HD2      LYS  57   2.659   8.573   3.312
  441    HD3  LYS  57           HD3      LYS  57   1.221   9.082   2.424
  442    HE2  LYS  57           HE2      LYS  57   2.644  10.934   2.328
  443    HE3  LYS  57           HE3      LYS  57   1.504  11.327   3.614
  444    HZ1  LYS  57           HZ1      LYS  57   3.750  11.856   4.278
  445    HZ2  LYS  57           HZ2      LYS  57   4.254  10.268   3.985
  446    HZ3  LYS  57           HZ3      LYS  57   3.159  10.590   5.232
  447    H    ARG  58           H        ARG  58   2.393   8.833   7.346
  448    HA   ARG  58           HA       ARG  58   3.310   6.938   9.364
  449    HB2  ARG  58           HB2      ARG  58   3.134   9.873   9.138
  450    HB3  ARG  58           HB3      ARG  58   2.791   9.230  10.738
  451    HG2  ARG  58           HG2      ARG  58   5.056   7.863  10.022
  452    HG3  ARG  58           HG3      ARG  58   5.319   9.456   9.310
  453    HD2  ARG  58           HD2      ARG  58   4.399  10.168  11.739
  454    HD3  ARG  58           HD3      ARG  58   5.177   8.638  12.142
  455    HE   ARG  58           HE       ARG  58   6.465  11.094  11.379
  456   HH11  ARG  58          HH11      ARG  58   6.786   7.623  11.550
  457   HH12  ARG  58          HH12      ARG  58   8.517   7.659  11.578
  458   HH21  ARG  58          HH21      ARG  58   8.741  11.143  11.415
  459   HH22  ARG  58          HH22      ARG  58   9.627   9.658  11.502
  460    HA   PRO  59           HA       PRO  59  -0.611   6.060  11.162
  461    HB2  PRO  59           HB2      PRO  59  -0.217   6.427  13.835
  462    HB3  PRO  59           HB3      PRO  59   0.424   5.044  12.941
  463    HG2  PRO  59           HG2      PRO  59   1.800   7.572  13.763
  464    HG3  PRO  59           HG3      PRO  59   2.395   5.903  13.824
  465    HD2  PRO  59           HD2      PRO  59   3.115   7.615  11.866
  466    HD3  PRO  59           HD3      PRO  59   2.921   5.874  11.576
  467    H    GLY  60           H        GLY  60  -2.448   7.179  11.191
  468    HA2  GLY  60           HA2      GLY  60  -3.973   8.783  11.968
  469    HA3  GLY  60           HA3      GLY  60  -2.642   9.655  12.712
  470    H    ALA  61           H        ALA  61  -1.281   9.260   9.921
  471    HA   ALA  61           HA       ALA  61  -1.666  11.844   8.973
  472    HB1  ALA  61           HB1      ALA  61   0.274  10.447   8.415
  473    HB2  ALA  61           HB2      ALA  61  -0.480  11.134   6.977
  474    HB3  ALA  61           HB3      ALA  61  -0.753   9.442   7.393
  475    H    VAL  62           H        VAL  62  -2.873  12.744   7.330
  476    HA   VAL  62           HA       VAL  62  -5.399  11.478   6.796
  477    HB   VAL  62           HB       VAL  62  -5.953  13.526   5.558
  478   HG11  VAL  62          HG11      VAL  62  -6.291  13.484   7.962
  479   HG12  VAL  62          HG12      VAL  62  -5.802  15.096   7.440
  480   HG13  VAL  62          HG13      VAL  62  -4.635  14.031   8.224
  481   HG21  VAL  62          HG21      VAL  62  -3.083  14.269   6.110
  482   HG22  VAL  62          HG22      VAL  62  -4.316  15.405   5.564
  483   HG23  VAL  62          HG23      VAL  62  -3.847  14.051   4.536
  484    H    LEU  63           H        LEU  63  -5.920  10.275   5.093
  485    HA   LEU  63           HA       LEU  63  -3.968   9.826   3.009
  486    HB2  LEU  63           HB2      LEU  63  -6.507   8.550   3.881
  487    HB3  LEU  63           HB3      LEU  63  -6.026   8.329   2.210
  488    HG   LEU  63           HG       LEU  63  -3.959   7.279   2.877
  489   HD11  LEU  63          HD11      LEU  63  -3.707   8.721   4.947
  490   HD12  LEU  63          HD12      LEU  63  -3.235   7.029   5.103
  491   HD13  LEU  63          HD13      LEU  63  -4.781   7.576   5.752
  492   HD21  LEU  63          HD21      LEU  63  -6.260   6.061   2.930
  493   HD22  LEU  63          HD22      LEU  63  -5.979   6.004   4.670
  494   HD23  LEU  63          HD23      LEU  63  -4.825   5.256   3.566
  495    H    GLU  64           H        GLU  64  -4.297  10.147   0.791
  496    HA   GLU  64           HA       GLU  64  -6.525  11.935   0.079
  497    HB2  GLU  64           HB2      GLU  64  -3.751  12.210  -1.067
  498    HB3  GLU  64           HB3      GLU  64  -5.097  13.331  -1.211
  499    HG2  GLU  64           HG2      GLU  64  -4.814  13.280   1.462
  500    HG3  GLU  64           HG3      GLU  64  -3.151  12.972   0.965
  501    H    ALA  65           H        ALA  65  -7.339  11.739  -2.015
  502    HA   ALA  65           HA       ALA  65  -7.308   9.165  -3.131
  503    HB1  ALA  65           HB1      ALA  65  -8.125  11.670  -4.586
  504    HB2  ALA  65           HB2      ALA  65  -9.124  10.897  -3.355
  505    HB3  ALA  65           HB3      ALA  65  -8.715  10.027  -4.834
  506    H    GLY  66           H        GLY  66  -5.388   8.360  -3.813
  507    HA2  GLY  66           HA2      GLY  66  -4.148   8.125  -5.926
  508    HA3  GLY  66           HA3      GLY  66  -4.009   9.877  -5.943
  509    H    CYS  67           H        CYS  67  -3.504   9.840  -2.976
  510    HA   CYS  67           HA       CYS  67  -0.686   9.840  -3.090
  511    HB2  CYS  67           HB2      CYS  67  -1.966  11.216  -1.501
  512    HB3  CYS  67           HB3      CYS  67  -2.491   9.759  -0.664
  513    HG   CYS  67           HG       CYS  67  -0.528  10.452   0.723
  514    H    VAL  68           H        VAL  68   0.839   8.444  -2.189
  515    HA   VAL  68           HA       VAL  68   0.080   5.660  -2.232
  516    HB   VAL  68           HB       VAL  68   2.791   6.817  -1.583
  517   HG11  VAL  68          HG11      VAL  68   3.653   4.674  -2.188
  518   HG12  VAL  68          HG12      VAL  68   2.068   4.130  -2.737
  519   HG13  VAL  68          HG13      VAL  68   2.355   4.420  -1.021
  520   HG21  VAL  68          HG21      VAL  68   3.173   6.167  -4.074
  521   HG22  VAL  68          HG22      VAL  68   2.417   7.712  -3.681
  522   HG23  VAL  68          HG23      VAL  68   1.423   6.350  -4.200
  523    H    VAL  69           H        VAL  69  -0.914   4.880  -0.479
  524    HA   VAL  69           HA       VAL  69  -0.310   5.848   2.174
  525    HB   VAL  69           HB       VAL  69  -2.054   3.492   1.465
  526   HG11  VAL  69          HG11      VAL  69  -3.174   4.034   3.569
  527   HG12  VAL  69          HG12      VAL  69  -2.046   5.365   3.830
  528   HG13  VAL  69          HG13      VAL  69  -1.460   3.701   3.822
  529   HG21  VAL  69          HG21      VAL  69  -2.503   6.383   1.096
  530   HG22  VAL  69          HG22      VAL  69  -3.816   5.490   1.864
  531   HG23  VAL  69          HG23      VAL  69  -3.233   5.004   0.273
  532    H    ALA  70           H        ALA  70   0.706   3.246   0.146
  533    HA   ALA  70           HA       ALA  70   2.676   2.415   2.036
  534    HB1  ALA  70           HB1      ALA  70   0.476   1.285   2.765
  535    HB2  ALA  70           HB2      ALA  70   1.930   0.295   2.634
  536    HB3  ALA  70           HB3      ALA  70   0.717   0.254   1.354
  537    H    ARG  71           H        ARG  71   3.211  -0.138   1.038
  538    HA   ARG  71           HA       ARG  71   3.506   0.206  -1.854
  539    HB2  ARG  71           HB2      ARG  71   5.687   0.138   0.157
  540    HB3  ARG  71           HB3      ARG  71   5.942  -0.788  -1.316
  541    HG2  ARG  71           HG2      ARG  71   5.129   2.101  -1.352
  542    HG3  ARG  71           HG3      ARG  71   6.815   1.585  -1.292
  543    HD2  ARG  71           HD2      ARG  71   5.160   0.291  -3.355
  544    HD3  ARG  71           HD3      ARG  71   5.437   2.018  -3.578
  545    HE   ARG  71           HE       ARG  71   7.345  -0.088  -3.897
  546   HH11  ARG  71          HH11      ARG  71   6.975   3.281  -3.067
  547   HH12  ARG  71          HH12      ARG  71   8.586   3.703  -3.538
  548   HH21  ARG  71          HH21      ARG  71   9.465   0.465  -4.518
  549   HH22  ARG  71          HH22      ARG  71  10.000   2.105  -4.362
  550    H    LEU  72           H        LEU  72   4.904  -1.922  -2.578
  551    HA   LEU  72           HA       LEU  72   3.846  -4.264  -1.188
  552    HB2  LEU  72           HB2      LEU  72   2.801  -3.220  -3.644
  553    HB3  LEU  72           HB3      LEU  72   3.543  -4.778  -3.954
  554    HG   LEU  72           HG       LEU  72   1.137  -4.959  -3.473
  555   HD11  LEU  72          HD11      LEU  72   2.968  -6.676  -2.778
  556   HD12  LEU  72          HD12      LEU  72   1.311  -6.875  -2.208
  557   HD13  LEU  72          HD13      LEU  72   2.534  -6.188  -1.139
  558   HD21  LEU  72          HD21      LEU  72   1.386  -2.983  -1.744
  559   HD22  LEU  72          HD22      LEU  72   1.616  -4.314  -0.611
  560   HD23  LEU  72          HD23      LEU  72   0.134  -4.213  -1.561
  561    H    GLU  73           H        GLU  73   4.789  -6.302  -2.025
  562    HA   GLU  73           HA       GLU  73   7.324  -5.985  -3.441
  563    HB2  GLU  73           HB2      GLU  73   7.408  -5.991  -0.755
  564    HB3  GLU  73           HB3      GLU  73   7.413  -7.726  -1.040
  565    HG2  GLU  73           HG2      GLU  73   9.670  -6.800  -0.826
  566    HG3  GLU  73           HG3      GLU  73   9.392  -7.539  -2.403
  567    H    LEU  74           H        LEU  74   6.544  -7.146  -5.168
  568    HA   LEU  74           HA       LEU  74   5.075  -9.535  -4.997
  569    HB2  LEU  74           HB2      LEU  74   6.153  -7.881  -7.041
  570    HB3  LEU  74           HB3      LEU  74   6.652  -9.528  -7.377
  571    HG   LEU  74           HG       LEU  74   4.588  -9.037  -8.540
  572   HD11  LEU  74          HD11      LEU  74   4.066 -10.861  -6.198
  573   HD12  LEU  74          HD12      LEU  74   4.935 -11.309  -7.665
  574   HD13  LEU  74          HD13      LEU  74   3.228 -10.875  -7.749
  575   HD21  LEU  74          HD21      LEU  74   3.426  -8.459  -5.817
  576   HD22  LEU  74          HD22      LEU  74   2.538  -8.495  -7.340
  577   HD23  LEU  74          HD23      LEU  74   3.771  -7.264  -7.067
  578    H    ASP  75           H        ASP  75   5.717 -11.702  -5.416
  579    HA   ASP  75           HA       ASP  75   8.108 -12.454  -4.055
  580    HB2  ASP  75           HB2      ASP  75   7.428 -14.774  -4.678
  581    HB3  ASP  75           HB3      ASP  75   6.159 -13.862  -3.866
  582    H    ASP  76           H        ASP  76   7.241 -11.966  -7.381
  583    HA   ASP  76           HA       ASP  76   9.440 -13.450  -8.474
  584    HB2  ASP  76           HB2      ASP  76   7.187 -12.833  -9.605
  585    HB3  ASP  76           HB3      ASP  76   7.960 -11.288  -9.948
  586    H    LEU  77           H        LEU  77  11.447 -12.775  -8.941
  587    HA   LEU  77           HA       LEU  77  12.249 -10.146  -8.014
  588    HB2  LEU  77           HB2      LEU  77  13.445 -12.574  -7.893
  589    HB3  LEU  77           HB3      LEU  77  14.235 -11.902  -9.306
  590    HG   LEU  77           HG       LEU  77  14.903  -9.929  -7.942
  591   HD11  LEU  77          HD11      LEU  77  13.256  -9.897  -6.237
  592   HD12  LEU  77          HD12      LEU  77  14.796 -10.244  -5.452
  593   HD13  LEU  77          HD13      LEU  77  13.641 -11.545  -5.741
  594   HD21  LEU  77          HD21      LEU  77  16.365 -11.921  -8.306
  595   HD22  LEU  77          HD22      LEU  77  15.816 -12.540  -6.748
  596   HD23  LEU  77          HD23      LEU  77  16.711 -11.022  -6.828
  597    H    GLU  78           H        GLU  78  10.680  -9.643 -10.065
  598    HA   GLU  78           HA       GLU  78  12.005  -9.611 -12.597
  599    HB2  GLU  78           HB2      GLU  78   9.470  -9.562 -12.111
  600    HB3  GLU  78           HB3      GLU  78   9.693  -7.837 -11.851
  601    HG2  GLU  78           HG2      GLU  78  10.698  -7.724 -14.148
  602    HG3  GLU  78           HG3      GLU  78  10.174  -9.392 -14.376
  603    H    HIS  79           H        HIS  79  14.014  -8.632 -11.695
  604    HA   HIS  79           HA       HIS  79  13.838  -5.738 -11.288
  605    HB2  HIS  79           HB2      HIS  79  16.209  -5.913 -10.593
  606    HB3  HIS  79           HB3      HIS  79  15.152  -6.952  -9.642
  607    HD1  HIS  79           HD1      HIS  79  17.237  -7.373 -12.810
  608    HD2  HIS  79           HD2      HIS  79  16.253  -9.387  -9.311
  609    HE1  HIS  79           HE1      HIS  79  18.514  -9.537 -12.898
  610    HE2  HIS  79           HE2      HIS  79  17.971 -10.700 -10.730
  611    H    HIS  80           H        HIS  80  15.916  -4.587 -12.232
  612    HA   HIS  80           HA       HIS  80  15.882  -5.159 -15.108
  613    HB2  HIS  80           HB2      HIS  80  16.806  -2.828 -15.308
  614    HB3  HIS  80           HB3      HIS  80  15.193  -2.920 -14.608
  615    HD1  HIS  80           HD1      HIS  80  15.078  -1.078 -12.959
  616    HD2  HIS  80           HD2      HIS  80  18.680  -3.138 -12.733
  617    HE1  HIS  80           HE1      HIS  80  16.302  -0.079 -11.002
  618    HE2  HIS  80           HE2      HIS  80  18.514  -1.285 -10.937
  619    H    HIS  81           H        HIS  81  18.078  -4.149 -16.110
  620    HA   HIS  81           HA       HIS  81  20.322  -5.366 -14.643
  621    HB2  HIS  81           HB2      HIS  81  21.219  -6.073 -16.895
  622    HB3  HIS  81           HB3      HIS  81  19.779  -6.933 -16.362
  623    HD1  HIS  81           HD1      HIS  81  17.495  -6.184 -17.532
  624    HD2  HIS  81           HD2      HIS  81  20.985  -4.788 -19.302
  625    HE1  HIS  81           HE1      HIS  81  16.822  -5.418 -19.830
  626    HE2  HIS  81           HE2      HIS  81  18.966  -4.656 -20.913
  627    H    HIS  82           H        HIS  82  20.324  -2.941 -14.074
  628    HA   HIS  82           HA       HIS  82  21.593  -1.313 -16.143
  629    HB2  HIS  82           HB2      HIS  82  20.534  -0.627 -13.396
  630    HB3  HIS  82           HB3      HIS  82  21.352   0.527 -14.444
  631    HD1  HIS  82           HD1      HIS  82  18.326   0.694 -13.468
  632    HD2  HIS  82           HD2      HIS  82  19.651  -0.582 -17.194
  633    HE1  HIS  82           HE1      HIS  82  16.383   1.039 -15.027
  634    HE2  HIS  82           HE2      HIS  82  17.237   0.342 -17.292
  635    H    HIS  83           H        HIS  83  23.547  -2.640 -16.084
  636    HA   HIS  83           HA       HIS  83  25.564  -1.448 -14.484
  637    HB2  HIS  83           HB2      HIS  83  24.607  -2.955 -12.780
  638    HB3  HIS  83           HB3      HIS  83  24.892  -4.329 -13.845
  639    HD1  HIS  83           HD1      HIS  83  26.664  -5.581 -12.611
  640    HD2  HIS  83           HD2      HIS  83  27.540  -1.534 -12.957
  641    HE1  HIS  83           HE1      HIS  83  29.004  -5.322 -11.727
  642    HE2  HIS  83           HE2      HIS  83  29.480  -2.851 -11.866
  643    H    HIS  84           H        HIS  84  27.599  -1.830 -15.293
  644    HA   HIS  84           HA       HIS  84  28.120  -4.009 -17.097
  645    HB2  HIS  84           HB2      HIS  84  26.903  -2.027 -18.361
  646    HB3  HIS  84           HB3      HIS  84  28.518  -1.326 -18.347
  647    HD1  HIS  84           HD1      HIS  84  27.251  -2.067 -21.012
  648    HD2  HIS  84           HD2      HIS  84  29.655  -4.651 -18.819
  649    HE1  HIS  84           HE1      HIS  84  28.147  -3.726 -22.676
  650    HE2  HIS  84           HE2      HIS  84  29.530  -5.331 -21.311
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1   2.281  11.635 -15.835
    2    H2   MET   1           H2       MET   1   3.521  10.487 -16.122
    3    H3   MET   1           H3       MET   1   1.926  10.182 -16.677
    4    HA   MET   1           HA       MET   1   2.674  10.497 -13.850
    5    HB2  MET   1           HB2      MET   1   0.188   9.564 -15.297
    6    HB3  MET   1           HB3      MET   1   0.424   9.427 -13.560
    7    HG2  MET   1           HG2      MET   1   0.434  12.015 -15.094
    8    HG3  MET   1           HG3      MET   1  -0.951  11.364 -14.219
    9    HE1  MET   1           HE1      MET   1  -0.293  14.109 -13.718
   10    HE2  MET   1           HE2      MET   1   0.183  14.403 -12.046
   11    HE3  MET   1           HE3      MET   1  -1.265  13.460 -12.398
   12    H    GLU   2           H        GLU   2   3.871   8.892 -13.085
   13    HA   GLU   2           HA       GLU   2   3.875   6.319 -14.503
   14    HB2  GLU   2           HB2      GLU   2   5.870   7.229 -12.433
   15    HB3  GLU   2           HB3      GLU   2   6.037   5.914 -13.588
   16    HG2  GLU   2           HG2      GLU   2   7.338   7.530 -14.551
   17    HG3  GLU   2           HG3      GLU   2   5.795   7.807 -15.359
   18    H    ASN   3           H        ASN   3   2.247   5.141 -13.637
   19    HA   ASN   3           HA       ASN   3   2.167   4.868 -10.707
   20    HB2  ASN   3           HB2      ASN   3   0.028   4.486 -12.802
   21    HB3  ASN   3           HB3      ASN   3  -0.160   3.940 -11.138
   22   HD21  ASN   3          HD21      ASN   3  -1.388   5.274 -10.044
   23   HD22  ASN   3          HD22      ASN   3  -1.370   6.999 -10.146
   24    H    ASP   4           H        ASP   4   3.680   3.260 -10.427
   25    HA   ASP   4           HA       ASP   4   3.595   0.846 -12.003
   26    HB2  ASP   4           HB2      ASP   4   5.342   1.965  -9.881
   27    HB3  ASP   4           HB3      ASP   4   5.277   0.209 -10.002
   28    HA   PRO   5           HA       PRO   5   0.932  -1.581  -9.470
   29    HB2  PRO   5           HB2      PRO   5   2.095  -4.031  -9.563
   30    HB3  PRO   5           HB3      PRO   5   1.254  -3.316 -10.943
   31    HG2  PRO   5           HG2      PRO   5   4.190  -3.428 -10.364
   32    HG3  PRO   5           HG3      PRO   5   3.339  -3.714 -11.894
   33    HD2  PRO   5           HD2      PRO   5   4.577  -1.373 -11.335
   34    HD3  PRO   5           HD3      PRO   5   3.114  -1.462 -12.336
   35    H    THR   6           H        THR   6   4.321  -1.452  -8.667
   36    HA   THR   6           HA       THR   6   3.903  -2.622  -6.035
   37    HB   THR   6           HB       THR   6   6.314  -2.380  -5.761
   38    HG1  THR   6           HG1      THR   6   7.551  -1.350  -7.263
   39   HG21  THR   6          HG21      THR   6   5.477  -4.303  -7.092
   40   HG22  THR   6          HG22      THR   6   7.125  -3.810  -7.479
   41   HG23  THR   6          HG23      THR   6   5.798  -3.366  -8.551
   42    H    VAL   7           H        VAL   7   2.401  -0.311  -6.393
   43    HA   VAL   7           HA       VAL   7   3.533   1.365  -4.303
   44    HB   VAL   7           HB       VAL   7   2.503   2.654  -6.824
   45   HG11  VAL   7          HG11      VAL   7   4.298   4.099  -5.006
   46   HG12  VAL   7          HG12      VAL   7   2.727   3.680  -4.323
   47   HG13  VAL   7          HG13      VAL   7   2.819   4.631  -5.806
   48   HG21  VAL   7          HG21      VAL   7   4.512   1.532  -7.465
   49   HG22  VAL   7          HG22      VAL   7   5.346   2.077  -6.010
   50   HG23  VAL   7          HG23      VAL   7   4.898   3.240  -7.257
   51    H    LEU   8           H        LEU   8   2.009   1.672  -2.833
   52    HA   LEU   8           HA       LEU   8  -0.781   1.234  -3.532
   53    HB2  LEU   8           HB2      LEU   8   0.690   0.546  -1.344
   54    HB3  LEU   8           HB3      LEU   8  -0.114   1.994  -0.768
   55    HG   LEU   8           HG       LEU   8  -1.443   0.119  -0.128
   56   HD11  LEU   8          HD11      LEU   8  -3.491   0.835  -0.864
   57   HD12  LEU   8          HD12      LEU   8  -2.944   1.043  -2.527
   58   HD13  LEU   8          HD13      LEU   8  -2.489   2.221  -1.295
   59   HD21  LEU   8          HD21      LEU   8  -0.846  -0.797  -2.876
   60   HD22  LEU   8          HD22      LEU   8  -2.434  -1.204  -2.224
   61   HD23  LEU   8          HD23      LEU   8  -0.975  -1.714  -1.375
   62    H    ARG   9           H        ARG   9  -2.392   2.747  -3.400
   63    HA   ARG   9           HA       ARG   9  -1.798   5.421  -2.434
   64    HB2  ARG   9           HB2      ARG   9  -2.238   4.748  -5.316
   65    HB3  ARG   9           HB3      ARG   9  -2.844   6.276  -4.692
   66    HG2  ARG   9           HG2      ARG   9  -0.607   6.904  -3.991
   67    HG3  ARG   9           HG3      ARG   9   0.019   5.351  -4.547
   68    HD2  ARG   9           HD2      ARG   9  -1.397   6.447  -6.710
   69    HD3  ARG   9           HD3      ARG   9  -0.450   7.767  -6.029
   70    HE   ARG   9           HE       ARG   9   1.469   6.726  -6.738
   71   HH11  ARG   9          HH11      ARG   9  -1.207   4.501  -7.001
   72   HH12  ARG   9          HH12      ARG   9  -0.304   3.327  -7.897
   73   HH21  ARG   9          HH21      ARG   9   2.656   5.184  -7.918
   74   HH22  ARG   9          HH22      ARG   9   1.889   3.714  -8.418
   75    H    SER  10           H        SER  10  -3.559   6.431  -1.630
   76    HA   SER  10           HA       SER  10  -5.938   4.938  -1.248
   77    HB2  SER  10           HB2      SER  10  -5.265   6.488   0.460
   78    HB3  SER  10           HB3      SER  10  -5.264   7.831  -0.683
   79    HG   SER  10           HG       SER  10  -7.179   8.001   0.331
   80    HA   PRO  11           HA       PRO  11  -8.242   6.105  -4.836
   81    HB2  PRO  11           HB2      PRO  11 -10.760   5.693  -3.954
   82    HB3  PRO  11           HB3      PRO  11  -9.644   4.362  -4.281
   83    HG2  PRO  11           HG2      PRO  11 -10.373   5.625  -1.666
   84    HG3  PRO  11           HG3      PRO  11 -10.187   3.907  -2.065
   85    HD2  PRO  11           HD2      PRO  11  -8.258   5.354  -0.806
   86    HD3  PRO  11           HD3      PRO  11  -7.897   3.981  -1.872
   87    H    SER  12           H        SER  12  -8.895   7.628  -1.751
   88    HA   SER  12           HA       SER  12  -9.423  10.141  -3.089
   89    HB2  SER  12           HB2      SER  12 -11.486   8.840  -1.297
   90    HB3  SER  12           HB3      SER  12 -11.532  10.530  -1.798
   91    HG   SER  12           HG       SER  12 -12.806   9.206  -3.156
   92    H    ALA  13           H        ALA  13  -9.854  11.893  -1.346
   93    HA   ALA  13           HA       ALA  13  -7.664  11.768   0.500
   94    HB1  ALA  13           HB1      ALA  13  -8.336  13.826  -0.736
   95    HB2  ALA  13           HB2      ALA  13  -8.172  14.052   1.006
   96    HB3  ALA  13           HB3      ALA  13  -9.774  13.909   0.282
   97    H    GLY  14           H        GLY  14  -7.720  10.989   2.496
   98    HA2  GLY  14           HA2      GLY  14 -10.196  11.235   4.056
   99    HA3  GLY  14           HA3      GLY  14  -9.472   9.644   3.872
  100    H    LYS  15           H        LYS  15  -8.619   9.120   5.778
  101    HA   LYS  15           HA       LYS  15  -6.423  10.639   6.818
  102    HB2  LYS  15           HB2      LYS  15  -8.415  11.838   7.756
  103    HB3  LYS  15           HB3      LYS  15  -8.856  10.352   8.586
  104    HG2  LYS  15           HG2      LYS  15  -6.102  11.283   9.036
  105    HG3  LYS  15           HG3      LYS  15  -7.379  12.317   9.682
  106    HD2  LYS  15           HD2      LYS  15  -8.315   9.989  10.539
  107    HD3  LYS  15           HD3      LYS  15  -6.611   9.543  10.428
  108    HE2  LYS  15           HE2      LYS  15  -6.238  11.778  11.722
  109    HE3  LYS  15           HE3      LYS  15  -7.932  11.583  12.167
  110    HZ1  LYS  15           HZ1      LYS  15  -6.080  10.586  13.656
  111    HZ2  LYS  15           HZ2      LYS  15  -6.077   9.330  12.523
  112    HZ3  LYS  15           HZ3      LYS  15  -7.492   9.697  13.374
  113    H    LEU  16           H        LEU  16  -5.052   9.374   7.972
  114    HA   LEU  16           HA       LEU  16  -5.433   6.566   7.919
  115    HB2  LEU  16           HB2      LEU  16  -3.241   7.928   7.872
  116    HB3  LEU  16           HB3      LEU  16  -3.394   7.970   9.616
  117    HG   LEU  16           HG       LEU  16  -3.229   5.570   9.756
  118   HD11  LEU  16          HD11      LEU  16  -2.753   4.267   7.652
  119   HD12  LEU  16          HD12      LEU  16  -3.314   5.676   6.752
  120   HD13  LEU  16          HD13      LEU  16  -4.412   4.832   7.845
  121   HD21  LEU  16          HD21      LEU  16  -0.993   5.504   9.506
  122   HD22  LEU  16          HD22      LEU  16  -1.185   7.217   9.129
  123   HD23  LEU  16          HD23      LEU  16  -1.058   6.036   7.825
  124    H    THR  17           H        THR  17  -7.108   5.819   9.133
  125    HA   THR  17           HA       THR  17  -7.627   6.769  11.785
  126    HB   THR  17           HB       THR  17  -9.403   5.926  10.254
  127    HG1  THR  17           HG1      THR  17 -10.469   5.538  12.000
  128   HG21  THR  17          HG21      THR  17  -8.639   3.139  10.985
  129   HG22  THR  17          HG22      THR  17  -7.972   3.896   9.539
  130   HG23  THR  17          HG23      THR  17  -9.717   3.714   9.714
  131    H    GLN  18           H        GLN  18  -6.223   3.809  10.414
  132    HA   GLN  18           HA       GLN  18  -4.583   3.404  12.707
  133    HB2  GLN  18           HB2      GLN  18  -7.144   2.439  13.017
  134    HB3  GLN  18           HB3      GLN  18  -6.274   1.024  12.442
  135    HG2  GLN  18           HG2      GLN  18  -5.545   0.685  14.497
  136    HG3  GLN  18           HG3      GLN  18  -4.640   2.194  14.395
  137   HE21  GLN  18          HE21      GLN  18  -4.949   3.334  16.161
  138   HE22  GLN  18          HE22      GLN  18  -6.453   3.566  16.978
  139    H    TYR  19           H        TYR  19  -4.240   0.585  12.416
  140    HA   TYR  19           HA       TYR  19  -3.606   0.127   9.618
  141    HB2  TYR  19           HB2      TYR  19  -1.235  -0.403  10.116
  142    HB3  TYR  19           HB3      TYR  19  -1.618   1.296  10.370
  143    HD1  TYR  19           HD1      TYR  19  -1.069  -1.924  12.124
  144    HD2  TYR  19           HD2      TYR  19  -1.279   2.311  12.472
  145    HE1  TYR  19           HE1      TYR  19  -0.174  -2.073  14.410
  146    HE2  TYR  19           HE2      TYR  19  -0.384   2.174  14.758
  147    HH   TYR  19           HH       TYR  19  -0.434  -0.252  16.611
  148    H    THR  20           H        THR  20  -3.561  -2.007   9.078
  149    HA   THR  20           HA       THR  20  -4.326  -3.878  11.186
  150    HB   THR  20           HB       THR  20  -5.222  -5.261   9.492
  151    HG1  THR  20           HG1      THR  20  -4.391  -5.382   7.574
  152   HG21  THR  20          HG21      THR  20  -6.480  -3.683   7.955
  153   HG22  THR  20          HG22      THR  20  -5.662  -2.377   8.812
  154   HG23  THR  20          HG23      THR  20  -6.721  -3.480   9.690
  155    H    VAL  21           H        VAL  21  -1.578  -3.013   9.389
  156    HA   VAL  21           HA       VAL  21  -0.147  -5.321  10.431
  157    HB   VAL  21           HB       VAL  21   0.957  -5.789   8.277
  158   HG11  VAL  21          HG11      VAL  21  -0.853  -7.057   7.295
  159   HG12  VAL  21          HG12      VAL  21  -2.043  -6.066   8.139
  160   HG13  VAL  21          HG13      VAL  21  -0.967  -7.123   9.053
  161   HG21  VAL  21          HG21      VAL  21   0.829  -4.105   6.787
  162   HG22  VAL  21          HG22      VAL  21  -0.709  -3.522   7.424
  163   HG23  VAL  21          HG23      VAL  21  -0.677  -4.889   6.310
  164    H    GLU  22           H        GLU  22   2.016  -4.958  10.791
  165    HA   GLU  22           HA       GLU  22   2.834  -2.260  11.083
  166    HB2  GLU  22           HB2      GLU  22   4.953  -3.184  11.855
  167    HB3  GLU  22           HB3      GLU  22   3.606  -4.059  12.571
  168    HG2  GLU  22           HG2      GLU  22   4.212  -5.444  10.229
  169    HG3  GLU  22           HG3      GLU  22   5.770  -5.028  10.942
  170    H    ASP  23           H        ASP  23   5.364  -1.961  10.333
  171    HA   ASP  23           HA       ASP  23   5.220  -1.297   7.619
  172    HB2  ASP  23           HB2      ASP  23   6.760  -0.219   9.224
  173    HB3  ASP  23           HB3      ASP  23   7.702  -1.705   9.302
  174    H    GLY  24           H        GLY  24   5.657  -2.369   5.785
  175    HA2  GLY  24           HA2      GLY  24   6.306  -4.050   4.358
  176    HA3  GLY  24           HA3      GLY  24   7.455  -4.551   5.589
  177    H    GLY  25           H        GLY  25   4.047  -4.357   6.290
  178    HA2  GLY  25           HA2      GLY  25   3.926  -7.024   7.206
  179    HA3  GLY  25           HA3      GLY  25   2.545  -5.973   6.927
  180    H    HIS  26           H        HIS  26   4.048  -8.783   5.982
  181    HA   HIS  26           HA       HIS  26   3.575  -8.862   3.214
  182    HB2  HIS  26           HB2      HIS  26   3.627 -11.349   3.513
  183    HB3  HIS  26           HB3      HIS  26   5.002 -10.512   4.225
  184    HD1  HIS  26           HD1      HIS  26   5.246 -10.592   6.777
  185    HD2  HIS  26           HD2      HIS  26   1.859 -12.536   5.359
  186    HE1  HIS  26           HE1      HIS  26   4.360 -11.907   8.728
  187    HE2  HIS  26           HE2      HIS  26   2.361 -13.145   7.822
  188    H    VAL  27           H        VAL  27   1.722  -8.776   2.147
  189    HA   VAL  27           HA       VAL  27  -0.617 -10.181   3.182
  190    HB   VAL  27           HB       VAL  27  -2.093  -8.238   2.698
  191   HG11  VAL  27          HG11      VAL  27  -1.237  -8.833   4.990
  192   HG12  VAL  27          HG12      VAL  27  -1.759  -7.161   4.783
  193   HG13  VAL  27          HG13      VAL  27  -0.040  -7.554   4.788
  194   HG21  VAL  27          HG21      VAL  27  -0.424  -7.088   1.216
  195   HG22  VAL  27          HG22      VAL  27   0.434  -6.601   2.678
  196   HG23  VAL  27          HG23      VAL  27  -1.217  -6.047   2.398
  197    H    GLU  28           H        GLU  28  -1.868 -11.056   1.609
  198    HA   GLU  28           HA       GLU  28  -0.881 -10.894  -1.106
  199    HB2  GLU  28           HB2      GLU  28  -2.325 -12.746  -1.577
  200    HB3  GLU  28           HB3      GLU  28  -1.552 -13.053  -0.029
  201    HG2  GLU  28           HG2      GLU  28  -3.967 -11.687   0.494
  202    HG3  GLU  28           HG3      GLU  28  -4.321 -12.966  -0.666
  203    H    ALA  29           H        ALA  29  -2.399 -10.623  -2.935
  204    HA   ALA  29           HA       ALA  29  -3.618  -8.174  -2.996
  205    HB1  ALA  29           HB1      ALA  29  -4.405  -8.711  -5.098
  206    HB2  ALA  29           HB2      ALA  29  -4.756 -10.382  -4.656
  207    HB3  ALA  29           HB3      ALA  29  -3.087  -9.866  -4.898
  208    H    GLY  30           H        GLY  30  -5.423  -7.313  -2.192
  209    HA2  GLY  30           HA2      GLY  30  -7.760  -7.306  -1.756
  210    HA3  GLY  30           HA3      GLY  30  -7.716  -9.058  -1.640
  211    H    SER  31           H        SER  31  -5.248  -8.794   0.111
  212    HA   SER  31           HA       SER  31  -6.636  -8.825   2.599
  213    HB2  SER  31           HB2      SER  31  -3.719  -8.994   1.855
  214    HB3  SER  31           HB3      SER  31  -4.252  -8.984   3.535
  215    HG   SER  31           HG       SER  31  -5.319 -10.798   1.652
  216    H    SER  32           H        SER  32  -6.940  -7.259   4.055
  217    HA   SER  32           HA       SER  32  -6.412  -4.558   3.392
  218    HB2  SER  32           HB2      SER  32  -7.090  -4.292   5.936
  219    HB3  SER  32           HB3      SER  32  -8.289  -4.738   4.723
  220    HG   SER  32           HG       SER  32  -7.162  -6.255   6.760
  221    H    TYR  33           H        TYR  33  -4.801  -3.216   3.938
  222    HA   TYR  33           HA       TYR  33  -2.672  -4.291   5.669
  223    HB2  TYR  33           HB2      TYR  33  -1.063  -3.061   4.386
  224    HB3  TYR  33           HB3      TYR  33  -2.074  -3.953   3.256
  225    HD1  TYR  33           HD1      TYR  33  -1.313  -0.614   4.612
  226    HD2  TYR  33           HD2      TYR  33  -3.469  -2.812   1.676
  227    HE1  TYR  33           HE1      TYR  33  -1.797   1.476   3.411
  228    HE2  TYR  33           HE2      TYR  33  -3.958  -0.728   0.466
  229    HH   TYR  33           HH       TYR  33  -2.360   2.049   0.865
  230    H    ALA  34           H        ALA  34  -5.033  -1.890   5.385
  231    HA   ALA  34           HA       ALA  34  -4.361  -0.694   7.855
  232    HB1  ALA  34           HB1      ALA  34  -4.041   1.239   5.589
  233    HB2  ALA  34           HB2      ALA  34  -2.666   0.315   6.193
  234    HB3  ALA  34           HB3      ALA  34  -3.541   1.402   7.272
  235    H    GLU  35           H        GLU  35  -5.613   1.698   7.750
  236    HA   GLU  35           HA       GLU  35  -8.168   1.344   6.392
  237    HB2  GLU  35           HB2      GLU  35  -7.872   1.535   9.391
  238    HB3  GLU  35           HB3      GLU  35  -9.388   1.819   8.548
  239    HG2  GLU  35           HG2      GLU  35  -9.578  -0.408   7.889
  240    HG3  GLU  35           HG3      GLU  35  -7.875  -0.741   8.202
  241    H    MET  36           H        MET  36  -9.540   3.278   6.540
  242    HA   MET  36           HA       MET  36  -8.282   5.720   7.449
  243    HB2  MET  36           HB2      MET  36  -8.287   6.831   5.309
  244    HB3  MET  36           HB3      MET  36  -7.338   5.358   5.179
  245    HG2  MET  36           HG2      MET  36  -9.624   4.353   4.354
  246    HG3  MET  36           HG3      MET  36  -9.962   6.039   3.967
  247    HE1  MET  36           HE1      MET  36  -8.936   4.101   0.595
  248    HE2  MET  36           HE2      MET  36 -10.281   4.853   1.453
  249    HE3  MET  36           HE3      MET  36  -9.620   3.320   2.021
  250    H    GLU  37           H        GLU  37  -9.805   6.924   8.354
  251    HA   GLU  37           HA       GLU  37 -12.603   6.360   7.784
  252    HB2  GLU  37           HB2      GLU  37 -11.617   6.608  10.130
  253    HB3  GLU  37           HB3      GLU  37 -11.545   8.334   9.800
  254    HG2  GLU  37           HG2      GLU  37 -13.927   8.439   9.535
  255    HG3  GLU  37           HG3      GLU  37 -14.059   6.686   9.671
  256    H    VAL  38           H        VAL  38 -13.530   7.407   6.165
  257    HA   VAL  38           HA       VAL  38 -12.607  10.070   5.409
  258    HB   VAL  38           HB       VAL  38 -14.845   8.686   3.991
  259   HG11  VAL  38          HG11      VAL  38 -14.460  10.670   2.941
  260   HG12  VAL  38          HG12      VAL  38 -13.306   9.662   2.066
  261   HG13  VAL  38          HG13      VAL  38 -12.752  10.700   3.381
  262   HG21  VAL  38          HG21      VAL  38 -13.177   7.476   2.595
  263   HG22  VAL  38          HG22      VAL  38 -13.281   6.883   4.252
  264   HG23  VAL  38          HG23      VAL  38 -11.937   7.918   3.769
  265    H    MET  39           H        MET  39 -14.440  11.618   4.700
  266    HA   MET  39           HA       MET  39 -15.891  12.381   6.958
  267    HB2  MET  39           HB2      MET  39 -16.647  13.114   4.132
  268    HB3  MET  39           HB3      MET  39 -16.893  14.057   5.596
  269    HG2  MET  39           HG2      MET  39 -14.195  13.768   5.600
  270    HG3  MET  39           HG3      MET  39 -14.539  13.823   3.872
  271    HE1  MET  39           HE1      MET  39 -14.239  16.116   2.719
  272    HE2  MET  39           HE2      MET  39 -15.445  17.345   3.101
  273    HE3  MET  39           HE3      MET  39 -15.951  15.694   2.743
  274    H    LYS  40           H        LYS  40 -16.692  10.212   4.359
  275    HA   LYS  40           HA       LYS  40 -19.510  10.154   4.908
  276    HB2  LYS  40           HB2      LYS  40 -17.698   8.429   3.224
  277    HB3  LYS  40           HB3      LYS  40 -19.417   8.102   3.402
  278    HG2  LYS  40           HG2      LYS  40 -18.608  10.833   2.576
  279    HG3  LYS  40           HG3      LYS  40 -18.457   9.529   1.397
  280    HD2  LYS  40           HD2      LYS  40 -20.842   8.940   1.867
  281    HD3  LYS  40           HD3      LYS  40 -20.948  10.394   2.861
  282    HE2  LYS  40           HE2      LYS  40 -20.005  11.546   0.694
  283    HE3  LYS  40           HE3      LYS  40 -20.681  10.123  -0.096
  284    HZ1  LYS  40           HZ1      LYS  40 -22.828  10.643   0.882
  285    HZ2  LYS  40           HZ2      LYS  40 -22.266  11.942  -0.044
  286    HZ3  LYS  40           HZ3      LYS  40 -22.179  12.008   1.644
  287    H    MET  41           H        MET  41 -17.217   7.431   4.973
  288    HA   MET  41           HA       MET  41 -18.026   6.738   7.671
  289    HB2  MET  41           HB2      MET  41 -18.978   5.311   5.266
  290    HB3  MET  41           HB3      MET  41 -18.355   4.287   6.552
  291    HG2  MET  41           HG2      MET  41 -20.323   4.430   7.542
  292    HG3  MET  41           HG3      MET  41 -20.012   6.142   7.820
  293    HE1  MET  41           HE1      MET  41 -22.020   3.481   6.017
  294    HE2  MET  41           HE2      MET  41 -20.981   3.886   4.650
  295    HE3  MET  41           HE3      MET  41 -22.698   4.286   4.601
  296    H    ILE  42           H        ILE  42 -17.000   4.310   8.004
  297    HA   ILE  42           HA       ILE  42 -14.165   4.763   7.697
  298    HB   ILE  42           HB       ILE  42 -15.008   3.894   9.814
  299   HG12  ILE  42          HG12      ILE  42 -13.467   1.995  10.083
  300   HG13  ILE  42          HG13      ILE  42 -13.351   1.837   8.333
  301   HG21  ILE  42          HG21      ILE  42 -16.920   2.665   9.212
  302   HG22  ILE  42          HG22      ILE  42 -15.785   1.477   9.854
  303   HG23  ILE  42          HG23      ILE  42 -16.009   1.631   8.112
  304   HD11  ILE  42          HD11      ILE  42 -12.710   4.511   9.006
  305   HD12  ILE  42          HD12      ILE  42 -11.667   3.261   8.326
  306   HD13  ILE  42          HD13      ILE  42 -11.803   3.441  10.075
  307    H    MET  43           H        MET  43 -12.698   3.385   6.650
  308    HA   MET  43           HA       MET  43 -13.771   1.274   4.950
  309    HB2  MET  43           HB2      MET  43 -12.428   3.767   3.947
  310    HB3  MET  43           HB3      MET  43 -12.342   2.267   3.034
  311    HG2  MET  43           HG2      MET  43 -14.898   2.246   3.206
  312    HG3  MET  43           HG3      MET  43 -14.741   3.936   3.679
  313    HE1  MET  43           HE1      MET  43 -14.203   1.250   1.024
  314    HE2  MET  43           HE2      MET  43 -14.502   2.151  -0.462
  315    HE3  MET  43           HE3      MET  43 -15.781   1.984   0.740
  316    H    THR  44           H        THR  44 -12.026   0.006   3.894
  317    HA   THR  44           HA       THR  44  -9.572   0.027   5.528
  318    HB   THR  44           HB       THR  44 -10.256  -2.543   4.304
  319    HG1  THR  44           HG1      THR  44 -11.953  -2.962   5.781
  320   HG21  THR  44          HG21      THR  44 -10.179  -2.552   7.166
  321   HG22  THR  44          HG22      THR  44  -8.816  -1.641   6.517
  322   HG23  THR  44          HG23      THR  44  -9.084  -3.308   6.009
  323    H    LEU  45           H        LEU  45  -7.654  -0.041   4.492
  324    HA   LEU  45           HA       LEU  45  -7.711   0.133   1.582
  325    HB2  LEU  45           HB2      LEU  45  -5.458   0.603   3.536
  326    HB3  LEU  45           HB3      LEU  45  -5.371   0.873   1.806
  327    HG   LEU  45           HG       LEU  45  -7.475   2.440   2.369
  328   HD11  LEU  45          HD11      LEU  45  -6.049   2.003   4.921
  329   HD12  LEU  45          HD12      LEU  45  -7.737   2.417   4.617
  330   HD13  LEU  45          HD13      LEU  45  -6.493   3.664   4.528
  331   HD21  LEU  45          HD21      LEU  45  -5.727   3.378   1.175
  332   HD22  LEU  45          HD22      LEU  45  -4.534   2.980   2.411
  333   HD23  LEU  45          HD23      LEU  45  -5.685   4.287   2.686
  334    H    ASN  46           H        ASN  46  -7.447  -1.657   0.434
  335    HA   ASN  46           HA       ASN  46  -5.862  -3.852   1.580
  336    HB2  ASN  46           HB2      ASN  46  -7.536  -4.259  -0.855
  337    HB3  ASN  46           HB3      ASN  46  -7.186  -5.370   0.464
  338   HD21  ASN  46          HD21      ASN  46  -7.906  -3.600   2.579
  339   HD22  ASN  46          HD22      ASN  46  -9.624  -3.431   2.547
  340    H    VAL  47           H        VAL  47  -4.705  -5.215  -0.101
  341    HA   VAL  47           HA       VAL  47  -3.110  -3.417  -1.758
  342    HB   VAL  47           HB       VAL  47  -1.646  -5.453  -2.055
  343   HG11  VAL  47          HG11      VAL  47  -2.053  -4.736   0.836
  344   HG12  VAL  47          HG12      VAL  47  -1.342  -3.621  -0.332
  345   HG13  VAL  47          HG13      VAL  47  -0.551  -5.159   0.014
  346   HG21  VAL  47          HG21      VAL  47  -2.007  -7.416  -0.882
  347   HG22  VAL  47          HG22      VAL  47  -3.638  -6.980  -1.392
  348   HG23  VAL  47          HG23      VAL  47  -3.113  -6.652   0.259
  349    H    GLN  48           H        GLN  48  -2.739  -3.753  -3.962
  350    HA   GLN  48           HA       GLN  48  -4.950  -5.000  -5.353
  351    HB2  GLN  48           HB2      GLN  48  -4.191  -3.869  -7.301
  352    HB3  GLN  48           HB3      GLN  48  -4.016  -2.741  -5.965
  353    HG2  GLN  48           HG2      GLN  48  -1.708  -4.419  -6.871
  354    HG3  GLN  48           HG3      GLN  48  -2.130  -2.921  -7.698
  355   HE21  GLN  48          HE21      GLN  48  -0.577  -4.332  -5.031
  356   HE22  GLN  48          HE22      GLN  48  -0.122  -2.875  -4.221
  357    H    GLU  49           H        GLU  49  -1.775  -5.861  -4.453
  358    HA   GLU  49           HA       GLU  49  -2.018  -8.362  -5.887
  359    HB2  GLU  49           HB2      GLU  49   0.171  -6.376  -6.467
  360    HB3  GLU  49           HB3      GLU  49   0.376  -8.096  -6.764
  361    HG2  GLU  49           HG2      GLU  49  -1.738  -6.337  -7.987
  362    HG3  GLU  49           HG3      GLU  49  -0.271  -6.904  -8.784
  363    H    ARG  50           H        ARG  50  -0.155  -9.844  -5.330
  364    HA   ARG  50           HA       ARG  50   0.133  -9.932  -2.511
  365    HB2  ARG  50           HB2      ARG  50   1.350 -11.543  -4.748
  366    HB3  ARG  50           HB3      ARG  50   1.726 -11.851  -3.059
  367    HG2  ARG  50           HG2      ARG  50   0.042 -13.369  -3.509
  368    HG3  ARG  50           HG3      ARG  50  -0.825 -12.032  -2.751
  369    HD2  ARG  50           HD2      ARG  50  -1.875 -11.439  -4.678
  370    HD3  ARG  50           HD3      ARG  50  -0.530 -11.950  -5.696
  371    HE   ARG  50           HE       ARG  50  -1.581 -14.263  -4.646
  372   HH11  ARG  50          HH11      ARG  50  -2.765 -11.625  -6.600
  373   HH12  ARG  50          HH12      ARG  50  -3.930 -12.600  -7.432
  374   HH21  ARG  50          HH21      ARG  50  -3.112 -15.546  -5.740
  375   HH22  ARG  50          HH22      ARG  50  -4.128 -14.826  -6.943
  376    H    GLY  51           H        GLY  51   1.916  -9.604  -1.210
  377    HA2  GLY  51           HA2      GLY  51   4.513  -9.269  -1.638
  378    HA3  GLY  51           HA3      GLY  51   3.896  -7.763  -2.303
  379    H    ARG  52           H        ARG  52   5.570  -7.294  -0.409
  380    HA   ARG  52           HA       ARG  52   4.195  -7.192   2.167
  381    HB2  ARG  52           HB2      ARG  52   7.017  -6.939   1.265
  382    HB3  ARG  52           HB3      ARG  52   6.553  -6.050   2.709
  383    HG2  ARG  52           HG2      ARG  52   7.197  -7.983   3.689
  384    HG3  ARG  52           HG3      ARG  52   5.516  -8.408   3.357
  385    HD2  ARG  52           HD2      ARG  52   6.835 -10.240   2.635
  386    HD3  ARG  52           HD3      ARG  52   6.308  -9.392   1.182
  387    HE   ARG  52           HE       ARG  52   8.494  -8.881   0.725
  388   HH11  ARG  52          HH11      ARG  52   8.253  -9.974   4.031
  389   HH12  ARG  52          HH12      ARG  52   9.967 -10.041   4.265
  390   HH21  ARG  52          HH21      ARG  52  10.749  -8.969   1.031
  391   HH22  ARG  52          HH22      ARG  52  11.384  -9.470   2.563
  392    H    VAL  53           H        VAL  53   3.147  -5.443   2.827
  393    HA   VAL  53           HA       VAL  53   3.214  -3.028   1.250
  394    HB   VAL  53           HB       VAL  53   1.717  -3.534   3.825
  395   HG11  VAL  53          HG11      VAL  53   1.725  -1.223   3.443
  396   HG12  VAL  53          HG12      VAL  53   0.192  -1.774   2.768
  397   HG13  VAL  53          HG13      VAL  53   1.549  -1.421   1.699
  398   HG21  VAL  53          HG21      VAL  53   0.434  -3.693   1.139
  399   HG22  VAL  53          HG22      VAL  53  -0.037  -4.451   2.660
  400   HG23  VAL  53          HG23      VAL  53   1.331  -5.085   1.745
  401    H    LYS  54           H        LYS  54   4.400  -1.277   1.635
  402    HA   LYS  54           HA       LYS  54   5.707  -1.031   4.266
  403    HB2  LYS  54           HB2      LYS  54   6.730   0.169   1.697
  404    HB3  LYS  54           HB3      LYS  54   7.590  -0.032   3.217
  405    HG2  LYS  54           HG2      LYS  54   7.236  -2.557   2.820
  406    HG3  LYS  54           HG3      LYS  54   6.908  -2.082   1.152
  407    HD2  LYS  54           HD2      LYS  54   9.385  -1.208   2.617
  408    HD3  LYS  54           HD3      LYS  54   9.306  -2.726   1.721
  409    HE2  LYS  54           HE2      LYS  54   8.860  -1.572  -0.326
  410    HE3  LYS  54           HE3      LYS  54   8.669  -0.038   0.521
  411    HZ1  LYS  54           HZ1      LYS  54  11.003  -0.117   1.127
  412    HZ2  LYS  54           HZ2      LYS  54  10.828  -0.202  -0.553
  413    HZ3  LYS  54           HZ3      LYS  54  11.189  -1.598   0.330
  414    H    TYR  55           H        TYR  55   4.734   0.479   5.438
  415    HA   TYR  55           HA       TYR  55   3.024   2.461   4.484
  416    HB2  TYR  55           HB2      TYR  55   4.429   1.952   7.058
  417    HB3  TYR  55           HB3      TYR  55   3.730   3.549   6.812
  418    HD1  TYR  55           HD1      TYR  55   2.437   0.253   5.670
  419    HD2  TYR  55           HD2      TYR  55   1.900   3.581   8.265
  420    HE1  TYR  55           HE1      TYR  55   0.232  -0.619   6.322
  421    HE2  TYR  55           HE2      TYR  55  -0.306   2.718   8.925
  422    HH   TYR  55           HH       TYR  55  -1.359  -0.443   8.121
  423    H    ILE  56           H        ILE  56   3.301   4.438   3.666
  424    HA   ILE  56           HA       ILE  56   6.042   5.482   3.500
  425    HB   ILE  56           HB       ILE  56   3.706   5.598   1.667
  426   HG12  ILE  56          HG12      ILE  56   5.403   5.288  -0.028
  427   HG13  ILE  56          HG13      ILE  56   6.682   5.624   1.134
  428   HG21  ILE  56          HG21      ILE  56   4.778   7.581   0.497
  429   HG22  ILE  56          HG22      ILE  56   5.640   7.873   2.008
  430   HG23  ILE  56          HG23      ILE  56   3.877   7.926   1.974
  431   HD11  ILE  56          HD11      ILE  56   4.855   3.238   1.092
  432   HD12  ILE  56          HD12      ILE  56   6.017   3.587   2.371
  433   HD13  ILE  56          HD13      ILE  56   6.580   3.271   0.730
  434    H    LYS  57           H        LYS  57   2.694   6.579   3.888
  435    HA   LYS  57           HA       LYS  57   3.421   9.175   4.804
  436    HB2  LYS  57           HB2      LYS  57   0.982   7.649   4.306
  437    HB3  LYS  57           HB3      LYS  57   0.837   8.751   5.671
  438    HG2  LYS  57           HG2      LYS  57   1.628   9.474   2.856
  439    HG3  LYS  57           HG3      LYS  57   0.087   9.824   3.642
  440    HD2  LYS  57           HD2      LYS  57   2.332  10.788   5.201
  441    HD3  LYS  57           HD3      LYS  57   2.334  11.461   3.571
  442    HE2  LYS  57           HE2      LYS  57   0.127  12.324   3.846
  443    HE3  LYS  57           HE3      LYS  57  -0.084  11.456   5.366
  444    HZ1  LYS  57           HZ1      LYS  57   0.399  13.817   5.699
  445    HZ2  LYS  57           HZ2      LYS  57   1.883  13.635   4.909
  446    HZ3  LYS  57           HZ3      LYS  57   1.602  12.836   6.373
  447    H    ARG  58           H        ARG  58   2.464   9.950   6.987
  448    HA   ARG  58           HA       ARG  58   3.609   8.237   9.051
  449    HB2  ARG  58           HB2      ARG  58   3.066  11.133   8.756
  450    HB3  ARG  58           HB3      ARG  58   2.905  10.481  10.381
  451    HG2  ARG  58           HG2      ARG  58   5.141  11.388   9.945
  452    HG3  ARG  58           HG3      ARG  58   5.176   9.664  10.322
  453    HD2  ARG  58           HD2      ARG  58   5.527   9.081   8.057
  454    HD3  ARG  58           HD3      ARG  58   5.131  10.707   7.502
  455    HE   ARG  58           HE       ARG  58   7.301  11.300   7.869
  456   HH11  ARG  58          HH11      ARG  58   6.623   8.422   9.723
  457   HH12  ARG  58          HH12      ARG  58   8.261   8.223  10.247
  458   HH21  ARG  58          HH21      ARG  58   9.456  11.039   8.556
  459   HH22  ARG  58          HH22      ARG  58   9.870   9.708   9.585
  460    HA   PRO  59           HA       PRO  59  -0.205   6.976  10.857
  461    HB2  PRO  59           HB2      PRO  59   0.267   7.213  13.527
  462    HB3  PRO  59           HB3      PRO  59   0.976   5.936  12.531
  463    HG2  PRO  59           HG2      PRO  59   2.190   8.511  13.457
  464    HG3  PRO  59           HG3      PRO  59   2.909   6.891  13.402
  465    HD2  PRO  59           HD2      PRO  59   3.423   8.764  11.523
  466    HD3  PRO  59           HD3      PRO  59   3.362   7.031  11.143
  467    H    GLY  60           H        GLY  60  -2.095   7.987  10.975
  468    HA2  GLY  60           HA2      GLY  60  -3.700   9.439  11.875
  469    HA3  GLY  60           HA3      GLY  60  -2.413  10.330  12.673
  470    H    ALA  61           H        ALA  61  -1.053  10.242   9.866
  471    HA   ALA  61           HA       ALA  61  -1.609  12.855   9.111
  472    HB1  ALA  61           HB1      ALA  61   0.409  11.582   8.463
  473    HB2  ALA  61           HB2      ALA  61  -0.359  12.400   7.102
  474    HB3  ALA  61           HB3      ALA  61  -0.572  10.663   7.322
  475    H    VAL  62           H        VAL  62  -2.777  13.763   7.396
  476    HA   VAL  62           HA       VAL  62  -5.281  12.458   6.845
  477    HB   VAL  62           HB       VAL  62  -4.270  15.051   5.677
  478   HG11  VAL  62          HG11      VAL  62  -7.076  14.039   6.124
  479   HG12  VAL  62          HG12      VAL  62  -6.231  14.054   4.575
  480   HG13  VAL  62          HG13      VAL  62  -6.619  15.573   5.383
  481   HG21  VAL  62          HG21      VAL  62  -4.132  15.140   8.111
  482   HG22  VAL  62          HG22      VAL  62  -5.808  14.606   8.234
  483   HG23  VAL  62          HG23      VAL  62  -5.433  16.172   7.516
  484    H    LEU  63           H        LEU  63  -5.852  11.364   5.065
  485    HA   LEU  63           HA       LEU  63  -3.850  10.864   3.041
  486    HB2  LEU  63           HB2      LEU  63  -6.539   9.732   3.698
  487    HB3  LEU  63           HB3      LEU  63  -5.845   9.438   2.115
  488    HG   LEU  63           HG       LEU  63  -5.390   7.578   3.616
  489   HD11  LEU  63          HD11      LEU  63  -2.792   9.030   3.262
  490   HD12  LEU  63          HD12      LEU  63  -3.708   8.427   1.881
  491   HD13  LEU  63          HD13      LEU  63  -3.129   7.305   3.113
  492   HD21  LEU  63          HD21      LEU  63  -3.678   9.371   5.297
  493   HD22  LEU  63          HD22      LEU  63  -4.289   7.756   5.656
  494   HD23  LEU  63          HD23      LEU  63  -5.386   9.137   5.667
  495    H    GLU  64           H        GLU  64  -4.163  11.157   0.789
  496    HA   GLU  64           HA       GLU  64  -6.243  13.098   0.050
  497    HB2  GLU  64           HB2      GLU  64  -3.377  13.236  -0.895
  498    HB3  GLU  64           HB3      GLU  64  -4.666  14.375  -1.263
  499    HG2  GLU  64           HG2      GLU  64  -3.430  13.883   1.436
  500    HG3  GLU  64           HG3      GLU  64  -3.179  15.289   0.404
  501    H    ALA  65           H        ALA  65  -7.024  12.949  -2.054
  502    HA   ALA  65           HA       ALA  65  -7.054  10.394  -3.211
  503    HB1  ALA  65           HB1      ALA  65  -7.775  12.988  -4.567
  504    HB2  ALA  65           HB2      ALA  65  -8.835  12.107  -3.467
  505    HB3  ALA  65           HB3      ALA  65  -8.337  11.372  -4.991
  506    H    GLY  66           H        GLY  66  -5.057   9.599  -3.747
  507    HA2  GLY  66           HA2      GLY  66  -3.811   9.343  -5.889
  508    HA3  GLY  66           HA3      GLY  66  -3.593  11.086  -5.842
  509    H    CYS  67           H        CYS  67  -3.207  10.859  -2.836
  510    HA   CYS  67           HA       CYS  67  -0.387  10.789  -2.861
  511    HB2  CYS  67           HB2      CYS  67  -1.751  12.078  -1.228
  512    HB3  CYS  67           HB3      CYS  67  -2.229  10.562  -0.472
  513    HG   CYS  67           HG       CYS  67   0.035  10.335   0.572
  514    H    VAL  68           H        VAL  68   1.070   9.294  -2.015
  515    HA   VAL  68           HA       VAL  68   0.239   6.541  -2.254
  516    HB   VAL  68           HB       VAL  68   2.962   7.560  -1.445
  517   HG11  VAL  68          HG11      VAL  68   3.782   5.452  -2.061
  518   HG12  VAL  68          HG12      VAL  68   2.298   5.028  -2.914
  519   HG13  VAL  68          HG13      VAL  68   2.310   5.110  -1.153
  520   HG21  VAL  68          HG21      VAL  68   3.538   7.327  -3.857
  521   HG22  VAL  68          HG22      VAL  68   2.409   8.638  -3.515
  522   HG23  VAL  68          HG23      VAL  68   1.820   7.123  -4.201
  523    H    VAL  69           H        VAL  69  -0.695   5.533  -0.604
  524    HA   VAL  69           HA       VAL  69  -0.285   6.391   2.122
  525    HB   VAL  69           HB       VAL  69  -1.840   3.987   1.166
  526   HG11  VAL  69          HG11      VAL  69  -1.520   3.823   3.488
  527   HG12  VAL  69          HG12      VAL  69  -3.130   4.519   3.298
  528   HG13  VAL  69          HG13      VAL  69  -1.767   5.552   3.730
  529   HG21  VAL  69          HG21      VAL  69  -2.445   6.863   1.024
  530   HG22  VAL  69          HG22      VAL  69  -3.725   5.853   1.696
  531   HG23  VAL  69          HG23      VAL  69  -3.091   5.517   0.085
  532    H    ALA  70           H        ALA  70   0.902   3.884   0.028
  533    HA   ALA  70           HA       ALA  70   2.913   3.140   1.910
  534    HB1  ALA  70           HB1      ALA  70   0.765   1.901   2.634
  535    HB2  ALA  70           HB2      ALA  70   2.273   0.993   2.515
  536    HB3  ALA  70           HB3      ALA  70   1.071   0.880   1.229
  537    H    ARG  71           H        ARG  71   3.641   0.668   0.938
  538    HA   ARG  71           HA       ARG  71   3.842   0.942  -1.967
  539    HB2  ARG  71           HB2      ARG  71   6.096   1.102  -0.016
  540    HB3  ARG  71           HB3      ARG  71   6.374   0.281  -1.546
  541    HG2  ARG  71           HG2      ARG  71   5.293   3.079  -1.337
  542    HG3  ARG  71           HG3      ARG  71   7.008   2.698  -1.498
  543    HD2  ARG  71           HD2      ARG  71   5.341   1.335  -3.462
  544    HD3  ARG  71           HD3      ARG  71   5.236   3.091  -3.567
  545    HE   ARG  71           HE       ARG  71   7.499   1.445  -4.226
  546   HH11  ARG  71          HH11      ARG  71   6.460   4.641  -3.286
  547   HH12  ARG  71          HH12      ARG  71   7.851   5.426  -3.953
  548   HH21  ARG  71          HH21      ARG  71   9.330   2.475  -5.105
  549   HH22  ARG  71          HH22      ARG  71   9.481   4.197  -4.986
  550    H    LEU  72           H        LEU  72   3.971  -0.975  -3.047
  551    HA   LEU  72           HA       LEU  72   3.655  -3.383  -1.422
  552    HB2  LEU  72           HB2      LEU  72   2.559  -2.448  -3.890
  553    HB3  LEU  72           HB3      LEU  72   3.402  -3.956  -4.190
  554    HG   LEU  72           HG       LEU  72   1.092  -4.433  -3.733
  555   HD11  LEU  72          HD11      LEU  72   2.995  -5.845  -2.731
  556   HD12  LEU  72          HD12      LEU  72   1.353  -6.105  -2.142
  557   HD13  LEU  72          HD13      LEU  72   2.492  -5.155  -1.187
  558   HD21  LEU  72          HD21      LEU  72   1.324  -3.277  -0.984
  559   HD22  LEU  72          HD22      LEU  72  -0.122  -3.656  -1.920
  560   HD23  LEU  72          HD23      LEU  72   0.864  -2.258  -2.347
  561    H    GLU  73           H        GLU  73   5.249  -4.779  -1.149
  562    HA   GLU  73           HA       GLU  73   7.698  -4.483  -2.691
  563    HB2  GLU  73           HB2      GLU  73   7.292  -4.950  -0.053
  564    HB3  GLU  73           HB3      GLU  73   7.518  -6.595  -0.630
  565    HG2  GLU  73           HG2      GLU  73   9.462  -4.472  -1.410
  566    HG3  GLU  73           HG3      GLU  73   9.551  -5.206   0.191
  567    H    LEU  74           H        LEU  74   6.864  -5.311  -4.691
  568    HA   LEU  74           HA       LEU  74   5.736  -7.870  -4.982
  569    HB2  LEU  74           HB2      LEU  74   6.777  -5.776  -6.723
  570    HB3  LEU  74           HB3      LEU  74   7.071  -7.382  -7.360
  571    HG   LEU  74           HG       LEU  74   4.965  -6.332  -8.175
  572   HD11  LEU  74          HD11      LEU  74   3.611  -8.310  -7.941
  573   HD12  LEU  74          HD12      LEU  74   4.543  -8.824  -6.534
  574   HD13  LEU  74          HD13      LEU  74   5.301  -8.778  -8.126
  575   HD21  LEU  74          HD21      LEU  74   4.594  -5.437  -5.687
  576   HD22  LEU  74          HD22      LEU  74   3.629  -6.911  -5.599
  577   HD23  LEU  74          HD23      LEU  74   3.266  -5.690  -6.819
  578    H    ASP  75           H        ASP  75   8.940  -6.987  -6.238
  579    HA   ASP  75           HA       ASP  75  10.776  -8.308  -6.632
  580    HB2  ASP  75           HB2      ASP  75  10.988  -7.481  -4.260
  581    HB3  ASP  75           HB3      ASP  75  10.366  -9.041  -3.730
  582    H    ASP  76           H        ASP  76   9.353  -9.742  -7.985
  583    HA   ASP  76           HA       ASP  76   8.557 -12.271  -6.881
  584    HB2  ASP  76           HB2      ASP  76   8.108 -12.851  -9.289
  585    HB3  ASP  76           HB3      ASP  76   7.262 -11.420  -8.707
  586    H    LEU  77           H        LEU  77   9.385 -14.339  -7.569
  587    HA   LEU  77           HA       LEU  77  12.281 -14.333  -7.697
  588    HB2  LEU  77           HB2      LEU  77  10.245 -16.532  -7.380
  589    HB3  LEU  77           HB3      LEU  77  11.967 -16.837  -7.504
  590    HG   LEU  77           HG       LEU  77  10.760 -15.092  -5.364
  591   HD11  LEU  77          HD11      LEU  77   9.853 -17.351  -5.175
  592   HD12  LEU  77          HD12      LEU  77  10.979 -17.000  -3.864
  593   HD13  LEU  77          HD13      LEU  77  11.487 -18.014  -5.215
  594   HD21  LEU  77          HD21      LEU  77  13.112 -14.691  -5.783
  595   HD22  LEU  77          HD22      LEU  77  13.453 -16.417  -5.662
  596   HD23  LEU  77          HD23      LEU  77  12.908 -15.524  -4.242
  597    H    GLU  78           H        GLU  78   9.551 -15.145  -9.735
  598    HA   GLU  78           HA       GLU  78  11.085 -16.475 -11.747
  599    HB2  GLU  78           HB2      GLU  78   8.276 -15.537 -11.461
  600    HB3  GLU  78           HB3      GLU  78   8.877 -15.809 -13.091
  601    HG2  GLU  78           HG2      GLU  78   9.602 -18.104 -12.265
  602    HG3  GLU  78           HG3      GLU  78   8.599 -17.782 -10.851
  603    H    HIS  79           H        HIS  79  12.720 -15.257 -12.559
  604    HA   HIS  79           HA       HIS  79  11.959 -13.026 -14.258
  605    HB2  HIS  79           HB2      HIS  79  12.572 -12.113 -11.959
  606    HB3  HIS  79           HB3      HIS  79  14.213 -12.662 -12.285
  607    HD1  HIS  79           HD1      HIS  79  11.698 -10.094 -13.333
  608    HD2  HIS  79           HD2      HIS  79  15.651 -11.113 -14.107
  609    HE1  HIS  79           HE1      HIS  79  12.654  -8.152 -14.614
  610    HE2  HIS  79           HE2      HIS  79  15.021  -8.829 -15.146
  611    H    HIS  80           H        HIS  80  13.689 -12.391 -15.740
  612    HA   HIS  80           HA       HIS  80  15.031 -14.667 -16.794
  613    HB2  HIS  80           HB2      HIS  80  15.300 -11.738 -17.505
  614    HB3  HIS  80           HB3      HIS  80  15.957 -13.072 -18.447
  615    HD1  HIS  80           HD1      HIS  80  14.043 -14.810 -19.355
  616    HD2  HIS  80           HD2      HIS  80  12.787 -11.015 -18.221
  617    HE1  HIS  80           HE1      HIS  80  11.787 -14.501 -20.423
  618    HE2  HIS  80           HE2      HIS  80  11.009 -12.233 -19.652
  619    H    HIS  81           H        HIS  81  16.705 -15.527 -15.736
  620    HA   HIS  81           HA       HIS  81  18.628 -13.803 -14.385
  621    HB2  HIS  81           HB2      HIS  81  17.638 -15.997 -13.431
  622    HB3  HIS  81           HB3      HIS  81  18.778 -16.805 -14.502
  623    HD1  HIS  81           HD1      HIS  81  19.661 -13.646 -12.670
  624    HD2  HIS  81           HD2      HIS  81  20.406 -17.728 -12.455
  625    HE1  HIS  81           HE1      HIS  81  21.502 -13.905 -10.976
  626    HE2  HIS  81           HE2      HIS  81  21.995 -16.375 -10.927
  627    H    HIS  82           H        HIS  82  19.478 -12.883 -16.359
  628    HA   HIS  82           HA       HIS  82  21.123 -14.709 -17.961
  629    HB2  HIS  82           HB2      HIS  82  21.316 -12.791 -19.537
  630    HB3  HIS  82           HB3      HIS  82  19.654 -13.311 -19.277
  631    HD1  HIS  82           HD1      HIS  82  18.057 -11.652 -18.166
  632    HD2  HIS  82           HD2      HIS  82  21.960 -10.257 -18.459
  633    HE1  HIS  82           HE1      HIS  82  17.941  -9.206 -17.597
  634    HE2  HIS  82           HE2      HIS  82  20.327  -8.403 -17.697
  635    H    HIS  83           H        HIS  83  21.282 -11.995 -15.778
  636    HA   HIS  83           HA       HIS  83  24.195 -11.854 -16.115
  637    HB2  HIS  83           HB2      HIS  83  22.942  -9.729 -16.291
  638    HB3  HIS  83           HB3      HIS  83  22.341  -9.961 -14.652
  639    HD1  HIS  83           HD1      HIS  83  23.867  -9.299 -12.743
  640    HD2  HIS  83           HD2      HIS  83  25.730  -9.118 -16.453
  641    HE1  HIS  83           HE1      HIS  83  26.062  -8.141 -12.338
  642    HE2  HIS  83           HE2      HIS  83  27.134  -7.968 -14.611
  643    H    HIS  84           H        HIS  84  25.592 -12.064 -14.361
  644    HA   HIS  84           HA       HIS  84  24.511 -13.646 -12.160
  645    HB2  HIS  84           HB2      HIS  84  27.368 -13.083 -12.981
  646    HB3  HIS  84           HB3      HIS  84  26.889 -14.138 -11.656
  647    HD1  HIS  84           HD1      HIS  84  26.804 -16.525 -12.269
  648    HD2  HIS  84           HD2      HIS  84  26.128 -14.070 -15.553
  649    HE1  HIS  84           HE1      HIS  84  26.562 -18.079 -14.232
  650    HE2  HIS  84           HE2      HIS  84  26.239 -16.566 -16.221
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1   3.657  11.659 -16.351
    2    H2   MET   1           H2       MET   1   4.979  10.706 -15.822
    3    H3   MET   1           H3       MET   1   4.010  10.174 -17.135
    4    HA   MET   1           HA       MET   1   3.048  10.567 -14.383
    5    HB2  MET   1           HB2      MET   1   1.839   9.248 -16.824
    6    HB3  MET   1           HB3      MET   1   1.092   9.338 -15.235
    7    HG2  MET   1           HG2      MET   1   1.182  11.839 -15.451
    8    HG3  MET   1           HG3      MET   1   1.665  11.598 -17.129
    9    HE1  MET   1           HE1      MET   1  -1.024  11.234 -14.440
   10    HE2  MET   1           HE2      MET   1  -1.050   9.546 -14.950
   11    HE3  MET   1           HE3      MET   1  -2.429  10.593 -15.291
   12    H    GLU   2           H        GLU   2   3.702   9.073 -12.991
   13    HA   GLU   2           HA       GLU   2   4.847   6.576 -14.028
   14    HB2  GLU   2           HB2      GLU   2   5.199   8.052 -11.425
   15    HB3  GLU   2           HB3      GLU   2   5.742   6.394 -11.638
   16    HG2  GLU   2           HG2      GLU   2   6.609   8.413 -13.631
   17    HG3  GLU   2           HG3      GLU   2   7.341   8.453 -12.028
   18    H    ASN   3           H        ASN   3   2.928   5.431 -14.354
   19    HA   ASN   3           HA       ASN   3   1.414   4.785 -11.911
   20    HB2  ASN   3           HB2      ASN   3   0.136   5.900 -13.770
   21    HB3  ASN   3           HB3      ASN   3   0.459   4.482 -14.764
   22   HD21  ASN   3          HD21      ASN   3  -1.687   5.904 -12.682
   23   HD22  ASN   3          HD22      ASN   3  -2.622   4.515 -12.258
   24    H    ASP   4           H        ASP   4   3.423   3.332 -11.700
   25    HA   ASP   4           HA       ASP   4   3.432   0.968 -13.353
   26    HB2  ASP   4           HB2      ASP   4   5.091   2.044 -11.136
   27    HB3  ASP   4           HB3      ASP   4   5.074   0.295 -11.339
   28    HA   PRO   5           HA       PRO   5   0.709  -1.553 -10.977
   29    HB2  PRO   5           HB2      PRO   5   1.856  -4.002 -11.212
   30    HB3  PRO   5           HB3      PRO   5   1.018  -3.203 -12.547
   31    HG2  PRO   5           HG2      PRO   5   3.954  -3.368 -11.981
   32    HG3  PRO   5           HG3      PRO   5   3.099  -3.557 -13.524
   33    HD2  PRO   5           HD2      PRO   5   4.355  -1.263 -12.828
   34    HD3  PRO   5           HD3      PRO   5   2.890  -1.281 -13.831
   35    H    THR   6           H        THR   6   4.077  -1.413 -10.143
   36    HA   THR   6           HA       THR   6   3.684  -2.786  -7.608
   37    HB   THR   6           HB       THR   6   6.095  -2.447  -7.297
   38    HG1  THR   6           HG1      THR   6   6.034  -1.144  -9.812
   39   HG21  THR   6          HG21      THR   6   6.872  -3.491  -9.552
   40   HG22  THR   6          HG22      THR   6   5.139  -3.626  -9.855
   41   HG23  THR   6          HG23      THR   6   5.852  -4.410  -8.445
   42    H    VAL   7           H        VAL   7   2.133  -0.463  -7.853
   43    HA   VAL   7           HA       VAL   7   3.177   1.061  -5.606
   44    HB   VAL   7           HB       VAL   7   2.179   2.552  -8.024
   45   HG11  VAL   7          HG11      VAL   7   3.954   3.681  -5.919
   46   HG12  VAL   7          HG12      VAL   7   2.247   3.434  -5.552
   47   HG13  VAL   7          HG13      VAL   7   2.719   4.472  -6.898
   48   HG21  VAL   7          HG21      VAL   7   5.011   1.846  -7.282
   49   HG22  VAL   7          HG22      VAL   7   4.596   3.166  -8.377
   50   HG23  VAL   7          HG23      VAL   7   4.169   1.507  -8.794
   51    H    LEU   8           H        LEU   8   1.601   1.194  -4.161
   52    HA   LEU   8           HA       LEU   8  -1.158   0.805  -5.003
   53    HB2  LEU   8           HB2      LEU   8   0.277  -0.062  -2.822
   54    HB3  LEU   8           HB3      LEU   8  -0.682   1.246  -2.157
   55    HG   LEU   8           HG       LEU   8  -1.883  -0.797  -1.834
   56   HD11  LEU   8          HD11      LEU   8  -2.959   1.397  -2.969
   57   HD12  LEU   8          HD12      LEU   8  -3.895  -0.013  -2.472
   58   HD13  LEU   8          HD13      LEU   8  -3.408   0.174  -4.157
   59   HD21  LEU   8          HD21      LEU   8  -2.203  -1.389  -4.708
   60   HD22  LEU   8          HD22      LEU   8  -2.083  -2.481  -3.329
   61   HD23  LEU   8          HD23      LEU   8  -0.627  -1.750  -4.004
   62    H    ARG   9           H        ARG   9  -1.846   2.707  -5.880
   63    HA   ARG   9           HA       ARG   9  -1.529   5.178  -4.362
   64    HB2  ARG   9           HB2      ARG   9  -2.331   4.507  -7.159
   65    HB3  ARG   9           HB3      ARG   9  -2.891   6.024  -6.468
   66    HG2  ARG   9           HG2      ARG   9  -0.916   6.566  -7.593
   67    HG3  ARG   9           HG3      ARG   9  -0.457   6.480  -5.893
   68    HD2  ARG   9           HD2      ARG   9   1.070   5.355  -7.624
   69    HD3  ARG   9           HD3      ARG   9   0.657   4.462  -6.162
   70    HE   ARG   9           HE       ARG   9  -0.505   2.956  -7.438
   71   HH11  ARG   9          HH11      ARG   9   0.242   5.758  -9.378
   72   HH12  ARG   9          HH12      ARG   9  -0.261   5.020 -10.861
   73   HH21  ARG   9          HH21      ARG   9  -1.168   1.983  -9.388
   74   HH22  ARG   9          HH22      ARG   9  -1.062   2.877 -10.868
   75    H    SER  10           H        SER  10  -3.244   6.402  -3.590
   76    HA   SER  10           HA       SER  10  -5.483   4.939  -2.648
   77    HB2  SER  10           HB2      SER  10  -6.156   7.597  -2.303
   78    HB3  SER  10           HB3      SER  10  -5.242   6.615  -1.159
   79    HG   SER  10           HG       SER  10  -4.170   8.574  -1.702
   80    HA   PRO  11           HA       PRO  11  -8.276   5.485  -6.036
   81    HB2  PRO  11           HB2      PRO  11 -10.632   5.083  -4.785
   82    HB3  PRO  11           HB3      PRO  11  -9.481   3.772  -5.069
   83    HG2  PRO  11           HG2      PRO  11  -9.964   5.361  -2.578
   84    HG3  PRO  11           HG3      PRO  11  -9.718   3.614  -2.761
   85    HD2  PRO  11           HD2      PRO  11  -7.748   5.321  -1.975
   86    HD3  PRO  11           HD3      PRO  11  -7.432   3.822  -2.872
   87    H    SER  12           H        SER  12  -8.947   7.248  -3.038
   88    HA   SER  12           HA       SER  12  -9.529   9.642  -4.558
   89    HB2  SER  12           HB2      SER  12 -11.604   8.650  -2.598
   90    HB3  SER  12           HB3      SER  12 -11.726  10.021  -3.701
   91    HG   SER  12           HG       SER  12 -12.773   8.467  -4.768
   92    H    ALA  13           H        ALA  13 -10.282  11.409  -2.823
   93    HA   ALA  13           HA       ALA  13  -8.081  11.615  -0.998
   94    HB1  ALA  13           HB1      ALA  13  -8.956  13.563  -2.213
   95    HB2  ALA  13           HB2      ALA  13  -8.973  13.809  -0.467
   96    HB3  ALA  13           HB3      ALA  13 -10.470  13.428  -1.318
   97    H    GLY  14           H        GLY  14  -8.045  10.617   0.904
   98    HA2  GLY  14           HA2      GLY  14 -10.458  10.718   2.577
   99    HA3  GLY  14           HA3      GLY  14  -9.689   9.163   2.294
  100    H    LYS  15           H        LYS  15  -8.852   8.630   4.220
  101    HA   LYS  15           HA       LYS  15  -6.600  10.104   5.203
  102    HB2  LYS  15           HB2      LYS  15  -8.666  11.268   6.172
  103    HB3  LYS  15           HB3      LYS  15  -8.897   9.810   7.128
  104    HG2  LYS  15           HG2      LYS  15  -6.202  10.986   7.235
  105    HG3  LYS  15           HG3      LYS  15  -7.493  11.951   7.954
  106    HD2  LYS  15           HD2      LYS  15  -7.343   9.047   8.606
  107    HD3  LYS  15           HD3      LYS  15  -6.188  10.146   9.364
  108    HE2  LYS  15           HE2      LYS  15  -8.336  11.558   9.871
  109    HE3  LYS  15           HE3      LYS  15  -9.157  10.015   9.643
  110    HZ1  LYS  15           HZ1      LYS  15  -8.576  10.424  11.967
  111    HZ2  LYS  15           HZ2      LYS  15  -6.937  10.500  11.557
  112    HZ3  LYS  15           HZ3      LYS  15  -7.789   9.052  11.366
  113    H    LEU  16           H        LEU  16  -5.235   8.826   6.368
  114    HA   LEU  16           HA       LEU  16  -5.647   6.022   6.295
  115    HB2  LEU  16           HB2      LEU  16  -3.436   7.331   6.239
  116    HB3  LEU  16           HB3      LEU  16  -3.587   7.414   7.981
  117    HG   LEU  16           HG       LEU  16  -3.468   5.011   8.171
  118   HD11  LEU  16          HD11      LEU  16  -3.009   3.654   6.106
  119   HD12  LEU  16          HD12      LEU  16  -3.513   5.057   5.163
  120   HD13  LEU  16          HD13      LEU  16  -4.654   4.272   6.255
  121   HD21  LEU  16          HD21      LEU  16  -1.231   4.905   7.938
  122   HD22  LEU  16          HD22      LEU  16  -1.393   6.613   7.530
  123   HD23  LEU  16          HD23      LEU  16  -1.276   5.408   6.248
  124    H    THR  17           H        THR  17  -7.383   5.358   7.492
  125    HA   THR  17           HA       THR  17  -7.841   6.265  10.168
  126    HB   THR  17           HB       THR  17  -9.669   5.552   8.651
  127    HG1  THR  17           HG1      THR  17 -10.784   4.983  10.336
  128   HG21  THR  17          HG21      THR  17  -9.073   2.703   9.240
  129   HG22  THR  17          HG22      THR  17  -8.290   3.479   7.864
  130   HG23  THR  17          HG23      THR  17 -10.050   3.414   7.956
  131    H    GLN  18           H        GLN  18  -6.497   3.328   8.711
  132    HA   GLN  18           HA       GLN  18  -4.932   2.785  11.030
  133    HB2  GLN  18           HB2      GLN  18  -7.491   1.875  11.275
  134    HB3  GLN  18           HB3      GLN  18  -6.701   0.476  10.561
  135    HG2  GLN  18           HG2      GLN  18  -4.925   0.889  12.427
  136    HG3  GLN  18           HG3      GLN  18  -6.239   1.772  13.202
  137   HE21  GLN  18          HE21      GLN  18  -7.654   0.659  14.361
  138   HE22  GLN  18          HE22      GLN  18  -7.828  -1.060  14.357
  139    H    TYR  19           H        TYR  19  -4.530   0.032  10.658
  140    HA   TYR  19           HA       TYR  19  -3.887  -0.378   7.855
  141    HB2  TYR  19           HB2      TYR  19  -1.496  -0.884   8.382
  142    HB3  TYR  19           HB3      TYR  19  -1.920   0.815   8.565
  143    HD1  TYR  19           HD2      TYR  19  -1.143  -2.295  10.387
  144    HD2  TYR  19           HD1      TYR  19  -1.791   1.898  10.691
  145    HE1  TYR  19           HE2      TYR  19  -0.265  -2.332  12.684
  146    HE2  TYR  19           HE1      TYR  19  -0.915   1.874  12.988
  147    HH   TYR  19           HH       TYR  19  -0.743  -0.508  14.867
  148    H    THR  20           H        THR  20  -3.736  -2.512   7.296
  149    HA   THR  20           HA       THR  20  -4.484  -4.420   9.379
  150    HB   THR  20           HB       THR  20  -5.278  -5.832   7.644
  151    HG1  THR  20           HG1      THR  20  -4.313  -5.897   5.800
  152   HG21  THR  20          HG21      THR  20  -6.590  -4.255   6.125
  153   HG22  THR  20          HG22      THR  20  -5.877  -2.955   7.082
  154   HG23  THR  20          HG23      THR  20  -6.890  -4.171   7.861
  155    H    VAL  21           H        VAL  21  -1.743  -3.472   7.594
  156    HA   VAL  21           HA       VAL  21  -0.245  -5.716   8.679
  157    HB   VAL  21           HB       VAL  21   0.880  -6.193   6.541
  158   HG11  VAL  21          HG11      VAL  21  -0.923  -7.484   5.533
  159   HG12  VAL  21          HG12      VAL  21  -2.114  -6.538   6.427
  160   HG13  VAL  21          HG13      VAL  21  -0.989  -7.585   7.292
  161   HG21  VAL  21          HG21      VAL  21   0.345  -3.959   5.521
  162   HG22  VAL  21          HG22      VAL  21  -1.287  -4.562   5.230
  163   HG23  VAL  21          HG23      VAL  21   0.093  -5.345   4.460
  164    H    GLU  22           H        GLU  22   1.917  -5.289   9.015
  165    HA   GLU  22           HA       GLU  22   2.647  -2.564   9.291
  166    HB2  GLU  22           HB2      GLU  22   4.875  -3.483   9.935
  167    HB3  GLU  22           HB3      GLU  22   3.533  -4.185  10.828
  168    HG2  GLU  22           HG2      GLU  22   3.878  -6.239   9.993
  169    HG3  GLU  22           HG3      GLU  22   4.301  -5.633   8.392
  170    H    ASP  23           H        ASP  23   5.082  -2.067   8.509
  171    HA   ASP  23           HA       ASP  23   4.905  -1.527   5.769
  172    HB2  ASP  23           HB2      ASP  23   7.382  -1.619   7.506
  173    HB3  ASP  23           HB3      ASP  23   7.260  -0.834   5.934
  174    H    GLY  24           H        GLY  24   5.144  -2.815   4.071
  175    HA2  GLY  24           HA2      GLY  24   6.101  -4.412   2.688
  176    HA3  GLY  24           HA3      GLY  24   7.245  -4.788   3.968
  177    H    GLY  25           H        GLY  25   3.822  -4.791   4.598
  178    HA2  GLY  25           HA2      GLY  25   3.887  -7.475   5.534
  179    HA3  GLY  25           HA3      GLY  25   2.451  -6.480   5.345
  180    H    HIS  26           H        HIS  26   3.980  -9.223   4.295
  181    HA   HIS  26           HA       HIS  26   3.411  -9.278   1.546
  182    HB2  HIS  26           HB2      HIS  26   3.528 -11.763   1.802
  183    HB3  HIS  26           HB3      HIS  26   4.903 -10.911   2.496
  184    HD1  HIS  26           HD1      HIS  26   5.174 -10.984   5.059
  185    HD2  HIS  26           HD2      HIS  26   1.868 -13.070   3.649
  186    HE1  HIS  26           HE1      HIS  26   4.372 -12.365   7.001
  187    HE2  HIS  26           HE2      HIS  26   2.422 -13.682   6.100
  188    H    VAL  27           H        VAL  27   1.536  -9.282   0.514
  189    HA   VAL  27           HA       VAL  27  -0.751 -10.694   1.650
  190    HB   VAL  27           HB       VAL  27  -2.277  -8.805   1.212
  191   HG11  VAL  27          HG11      VAL  27  -1.243  -9.252   3.462
  192   HG12  VAL  27          HG12      VAL  27  -1.816  -7.604   3.207
  193   HG13  VAL  27          HG13      VAL  27  -0.093  -7.963   3.105
  194   HG21  VAL  27          HG21      VAL  27  -1.380  -7.364  -0.307
  195   HG22  VAL  27          HG22      VAL  27   0.254  -7.528   0.336
  196   HG23  VAL  27          HG23      VAL  27  -0.925  -6.518   1.172
  197    H    GLU  28           H        GLU  28  -1.997 -11.660   0.137
  198    HA   GLU  28           HA       GLU  28  -1.102 -11.528  -2.611
  199    HB2  GLU  28           HB2      GLU  28  -2.504 -13.436  -2.994
  200    HB3  GLU  28           HB3      GLU  28  -1.654 -13.684  -1.474
  201    HG2  GLU  28           HG2      GLU  28  -4.105 -12.389  -0.893
  202    HG3  GLU  28           HG3      GLU  28  -4.444 -13.730  -1.986
  203    H    ALA  29           H        ALA  29  -2.700 -11.386  -4.393
  204    HA   ALA  29           HA       ALA  29  -3.999  -8.980  -4.500
  205    HB1  ALA  29           HB1      ALA  29  -3.543 -10.945  -6.284
  206    HB2  ALA  29           HB2      ALA  29  -4.606  -9.571  -6.588
  207    HB3  ALA  29           HB3      ALA  29  -5.285 -11.114  -6.070
  208    H    GLY  30           H        GLY  30  -5.849  -8.147  -3.753
  209    HA2  GLY  30           HA2      GLY  30  -8.150  -8.193  -3.208
  210    HA3  GLY  30           HA3      GLY  30  -8.049  -9.938  -3.031
  211    H    SER  31           H        SER  31  -5.547  -9.562  -1.372
  212    HA   SER  31           HA       SER  31  -6.852  -9.524   1.160
  213    HB2  SER  31           HB2      SER  31  -4.932 -10.950   0.872
  214    HB3  SER  31           HB3      SER  31  -3.925  -9.582   0.401
  215    HG   SER  31           HG       SER  31  -4.008  -8.816   2.479
  216    H    SER  32           H        SER  32  -7.250  -7.863   2.465
  217    HA   SER  32           HA       SER  32  -6.669  -5.200   1.704
  218    HB2  SER  32           HB2      SER  32  -7.626  -4.602   3.925
  219    HB3  SER  32           HB3      SER  32  -8.655  -5.706   3.011
  220    HG   SER  32           HG       SER  32  -7.043  -6.229   5.261
  221    H    TYR  33           H        TYR  33  -5.094  -3.814   2.313
  222    HA   TYR  33           HA       TYR  33  -3.011  -4.877   4.107
  223    HB2  TYR  33           HB2      TYR  33  -1.370  -3.643   2.859
  224    HB3  TYR  33           HB3      TYR  33  -2.338  -4.568   1.717
  225    HD1  TYR  33           HD2      TYR  33  -1.507  -1.219   2.939
  226    HD2  TYR  33           HD1      TYR  33  -3.838  -3.449   0.166
  227    HE1  TYR  33           HE2      TYR  33  -1.975   0.843   1.684
  228    HE2  TYR  33           HE1      TYR  33  -4.313  -1.393  -1.097
  229    HH   TYR  33           HH       TYR  33  -2.635   1.526  -0.556
  230    H    ALA  34           H        ALA  34  -5.349  -2.455   3.729
  231    HA   ALA  34           HA       ALA  34  -4.741  -1.253   6.213
  232    HB1  ALA  34           HB1      ALA  34  -4.370   0.726   4.015
  233    HB2  ALA  34           HB2      ALA  34  -3.010  -0.286   4.501
  234    HB3  ALA  34           HB3      ALA  34  -3.791   0.768   5.680
  235    H    GLU  35           H        GLU  35  -5.959   1.126   6.108
  236    HA   GLU  35           HA       GLU  35  -8.463   0.853   4.644
  237    HB2  GLU  35           HB2      GLU  35  -8.541   1.310   7.619
  238    HB3  GLU  35           HB3      GLU  35  -9.873   0.914   6.542
  239    HG2  GLU  35           HG2      GLU  35  -8.567  -1.290   6.153
  240    HG3  GLU  35           HG3      GLU  35  -7.747  -0.860   7.653
  241    H    MET  36           H        MET  36  -9.796   2.813   4.772
  242    HA   MET  36           HA       MET  36  -8.519   5.203   5.801
  243    HB2  MET  36           HB2      MET  36  -8.474   6.369   3.672
  244    HB3  MET  36           HB3      MET  36  -7.493   4.913   3.576
  245    HG2  MET  36           HG2      MET  36  -9.623   3.830   2.594
  246    HG3  MET  36           HG3      MET  36 -10.138   5.493   2.318
  247    HE1  MET  36           HE1      MET  36  -8.778   6.516  -0.748
  248    HE2  MET  36           HE2      MET  36  -7.901   7.221   0.610
  249    HE3  MET  36           HE3      MET  36  -9.622   6.867   0.760
  250    H    GLU  37           H        GLU  37 -10.006   6.556   6.565
  251    HA   GLU  37           HA       GLU  37 -12.809   6.009   6.009
  252    HB2  GLU  37           HB2      GLU  37 -11.753   6.427   8.342
  253    HB3  GLU  37           HB3      GLU  37 -11.808   8.125   7.891
  254    HG2  GLU  37           HG2      GLU  37 -14.097   8.211   7.946
  255    HG3  GLU  37           HG3      GLU  37 -14.278   6.486   7.632
  256    H    VAL  38           H        VAL  38 -13.693   6.975   4.312
  257    HA   VAL  38           HA       VAL  38 -12.703   9.567   3.411
  258    HB   VAL  38           HB       VAL  38 -14.971   8.196   2.040
  259   HG11  VAL  38          HG11      VAL  38 -14.449  10.051   0.843
  260   HG12  VAL  38          HG12      VAL  38 -13.295   8.940   0.106
  261   HG13  VAL  38          HG13      VAL  38 -12.765  10.052   1.367
  262   HG21  VAL  38          HG21      VAL  38 -13.315   6.816   0.758
  263   HG22  VAL  38          HG22      VAL  38 -13.564   6.308   2.429
  264   HG23  VAL  38          HG23      VAL  38 -12.120   7.221   1.991
  265    H    MET  39           H        MET  39 -14.521  11.084   2.557
  266    HA   MET  39           HA       MET  39 -15.952  12.052   4.750
  267    HB2  MET  39           HB2      MET  39 -16.638  12.558   1.853
  268    HB3  MET  39           HB3      MET  39 -16.978  13.602   3.226
  269    HG2  MET  39           HG2      MET  39 -14.150  13.004   2.958
  270    HG3  MET  39           HG3      MET  39 -14.821  13.779   1.524
  271    HE1  MET  39           HE1      MET  39 -14.227  17.276   2.413
  272    HE2  MET  39           HE2      MET  39 -15.397  16.407   1.419
  273    HE3  MET  39           HE3      MET  39 -13.712  15.886   1.456
  274    H    LYS  40           H        LYS  40 -16.814   9.729   2.297
  275    HA   LYS  40           HA       LYS  40 -19.624   9.749   2.890
  276    HB2  LYS  40           HB2      LYS  40 -17.813   8.135   1.153
  277    HB3  LYS  40           HB3      LYS  40 -19.379   7.458   1.578
  278    HG2  LYS  40           HG2      LYS  40 -19.580   8.573  -0.521
  279    HG3  LYS  40           HG3      LYS  40 -20.447   9.517   0.692
  280    HD2  LYS  40           HD2      LYS  40 -17.624  10.251   0.329
  281    HD3  LYS  40           HD3      LYS  40 -18.657  10.547  -1.071
  282    HE2  LYS  40           HE2      LYS  40 -19.387  11.451   1.702
  283    HE3  LYS  40           HE3      LYS  40 -18.428  12.443   0.604
  284    HZ1  LYS  40           HZ1      LYS  40 -21.237  11.577   0.321
  285    HZ2  LYS  40           HZ2      LYS  40 -20.341  12.080  -1.022
  286    HZ3  LYS  40           HZ3      LYS  40 -20.602  13.144   0.266
  287    H    MET  41           H        MET  41 -17.362   7.007   3.082
  288    HA   MET  41           HA       MET  41 -18.148   6.477   5.824
  289    HB2  MET  41           HB2      MET  41 -19.654   5.308   3.877
  290    HB3  MET  41           HB3      MET  41 -18.411   4.087   4.118
  291    HG2  MET  41           HG2      MET  41 -19.121   3.572   6.206
  292    HG3  MET  41           HG3      MET  41 -19.682   5.209   6.540
  293    HE1  MET  41           HE1      MET  41 -20.839   1.615   5.085
  294    HE2  MET  41           HE2      MET  41 -20.224   2.632   3.783
  295    HE3  MET  41           HE3      MET  41 -21.942   2.238   3.859
  296    H    ILE  42           H        ILE  42 -17.168   3.969   6.162
  297    HA   ILE  42           HA       ILE  42 -14.324   4.419   5.929
  298    HB   ILE  42           HB       ILE  42 -15.210   3.519   8.011
  299   HG12  ILE  42          HG12      ILE  42 -13.700   1.590   8.274
  300   HG13  ILE  42          HG13      ILE  42 -13.545   1.472   6.525
  301   HG21  ILE  42          HG21      ILE  42 -17.123   2.321   7.359
  302   HG22  ILE  42          HG22      ILE  42 -16.013   1.108   7.994
  303   HG23  ILE  42          HG23      ILE  42 -16.207   1.299   6.251
  304   HD11  ILE  42          HD11      ILE  42 -12.886   4.118   7.244
  305   HD12  ILE  42          HD12      ILE  42 -11.830   2.855   6.611
  306   HD13  ILE  42          HD13      ILE  42 -12.040   3.038   8.352
  307    H    MET  43           H        MET  43 -12.834   3.009   4.927
  308    HA   MET  43           HA       MET  43 -13.895   0.967   3.136
  309    HB2  MET  43           HB2      MET  43 -12.462   3.453   2.257
  310    HB3  MET  43           HB3      MET  43 -12.329   1.971   1.319
  311    HG2  MET  43           HG2      MET  43 -14.719   1.917   0.992
  312    HG3  MET  43           HG3      MET  43 -14.918   3.331   2.025
  313    HE1  MET  43           HE1      MET  43 -16.416   4.178  -0.028
  314    HE2  MET  43           HE2      MET  43 -15.940   2.911  -1.159
  315    HE3  MET  43           HE3      MET  43 -15.768   4.608  -1.611
  316    H    THR  44           H        THR  44 -12.208  -0.403   2.208
  317    HA   THR  44           HA       THR  44  -9.777  -0.441   3.875
  318    HB   THR  44           HB       THR  44 -10.532  -3.016   2.720
  319    HG1  THR  44           HG1      THR  44 -12.620  -2.458   3.089
  320   HG21  THR  44          HG21      THR  44 -10.085  -3.871   4.877
  321   HG22  THR  44          HG22      THR  44 -10.214  -2.272   5.610
  322   HG23  THR  44          HG23      THR  44  -8.861  -2.646   4.541
  323    H    LEU  45           H        LEU  45  -7.866  -0.517   2.853
  324    HA   LEU  45           HA       LEU  45  -7.888  -0.512  -0.064
  325    HB2  LEU  45           HB2      LEU  45  -5.596   0.024   1.826
  326    HB3  LEU  45           HB3      LEU  45  -5.612   0.319   0.098
  327    HG   LEU  45           HG       LEU  45  -7.650   1.880   0.702
  328   HD11  LEU  45          HD11      LEU  45  -6.379   1.289   3.299
  329   HD12  LEU  45          HD12      LEU  45  -8.034   1.770   2.924
  330   HD13  LEU  45          HD13      LEU  45  -6.754   2.981   2.975
  331   HD21  LEU  45          HD21      LEU  45  -5.830   2.858  -0.353
  332   HD22  LEU  45          HD22      LEU  45  -4.714   2.415   0.940
  333   HD23  LEU  45          HD23      LEU  45  -5.888   3.707   1.192
  334    H    ASN  46           H        ASN  46  -7.176  -2.151  -1.280
  335    HA   ASN  46           HA       ASN  46  -5.633  -4.291   0.028
  336    HB2  ASN  46           HB2      ASN  46  -6.875  -5.905  -1.452
  337    HB3  ASN  46           HB3      ASN  46  -7.858  -5.148  -0.202
  338   HD21  ASN  46          HD21      ASN  46  -9.230  -3.379  -0.828
  339   HD22  ASN  46          HD22      ASN  46  -9.854  -3.306  -2.437
  340    H    VAL  47           H        VAL  47  -4.668  -5.802  -1.706
  341    HA   VAL  47           HA       VAL  47  -3.259  -4.097  -3.611
  342    HB   VAL  47           HB       VAL  47  -1.761  -6.061  -3.912
  343   HG11  VAL  47          HG11      VAL  47  -0.525  -5.609  -2.026
  344   HG12  VAL  47          HG12      VAL  47  -1.940  -5.567  -0.976
  345   HG13  VAL  47          HG13      VAL  47  -1.608  -4.218  -2.062
  346   HG21  VAL  47          HG21      VAL  47  -3.749  -7.603  -3.082
  347   HG22  VAL  47          HG22      VAL  47  -2.955  -7.367  -1.526
  348   HG23  VAL  47          HG23      VAL  47  -2.062  -8.071  -2.873
  349    H    GLN  48           H        GLN  48  -3.061  -4.602  -5.815
  350    HA   GLN  48           HA       GLN  48  -5.397  -5.916  -6.918
  351    HB2  GLN  48           HB2      GLN  48  -4.333  -5.133  -9.125
  352    HB3  GLN  48           HB3      GLN  48  -4.949  -3.910  -8.025
  353    HG2  GLN  48           HG2      GLN  48  -2.781  -3.322  -9.030
  354    HG3  GLN  48           HG3      GLN  48  -2.734  -3.390  -7.270
  355   HE21  GLN  48          HE21      GLN  48  -1.134  -4.489  -6.388
  356   HE22  GLN  48          HE22      GLN  48  -0.158  -5.674  -7.180
  357    H    GLU  49           H        GLU  49  -2.185  -6.762  -6.200
  358    HA   GLU  49           HA       GLU  49  -2.543  -9.338  -7.460
  359    HB2  GLU  49           HB2      GLU  49  -0.445  -7.384  -8.356
  360    HB3  GLU  49           HB3      GLU  49  -0.170  -9.116  -8.479
  361    HG2  GLU  49           HG2      GLU  49  -2.421  -7.584  -9.761
  362    HG3  GLU  49           HG3      GLU  49  -0.985  -8.203 -10.574
  363    H    ARG  50           H        ARG  50  -0.533 -10.746  -7.004
  364    HA   ARG  50           HA       ARG  50  -0.108 -10.742  -4.200
  365    HB2  ARG  50           HB2      ARG  50   0.996 -12.361  -6.478
  366    HB3  ARG  50           HB3      ARG  50   1.618 -12.564  -4.845
  367    HG2  ARG  50           HG2      ARG  50   0.008 -14.209  -4.984
  368    HG3  ARG  50           HG3      ARG  50  -0.861 -12.891  -4.193
  369    HD2  ARG  50           HD2      ARG  50  -2.263 -13.826  -5.906
  370    HD3  ARG  50           HD3      ARG  50  -1.750 -12.215  -6.407
  371    HE   ARG  50           HE       ARG  50  -0.047 -14.290  -7.405
  372   HH11  ARG  50          HH11      ARG  50  -3.026 -12.560  -7.959
  373   HH12  ARG  50          HH12      ARG  50  -3.034 -12.866  -9.663
  374   HH21  ARG  50          HH21      ARG  50  -0.055 -14.694  -9.647
  375   HH22  ARG  50          HH22      ARG  50  -1.348 -14.078 -10.621
  376    H    GLY  51           H        GLY  51   1.542  -9.999  -2.986
  377    HA2  GLY  51           HA2      GLY  51   4.167  -9.616  -3.603
  378    HA3  GLY  51           HA3      GLY  51   3.391  -8.154  -4.195
  379    H    ARG  52           H        ARG  52   5.229  -7.736  -2.352
  380    HA   ARG  52           HA       ARG  52   3.945  -7.661   0.271
  381    HB2  ARG  52           HB2      ARG  52   6.726  -7.505  -0.722
  382    HB3  ARG  52           HB3      ARG  52   6.363  -6.517   0.686
  383    HG2  ARG  52           HG2      ARG  52   6.342  -8.280   2.036
  384    HG3  ARG  52           HG3      ARG  52   5.305  -9.201   0.946
  385    HD2  ARG  52           HD2      ARG  52   7.315 -10.423   1.102
  386    HD3  ARG  52           HD3      ARG  52   7.370  -9.606  -0.459
  387    HE   ARG  52           HE       ARG  52   8.645  -7.915   1.284
  388   HH11  ARG  52          HH11      ARG  52   9.072 -11.222   0.253
  389   HH12  ARG  52          HH12      ARG  52  10.788 -11.204   0.483
  390   HH21  ARG  52          HH21      ARG  52  10.902  -7.889   1.586
  391   HH22  ARG  52          HH22      ARG  52  11.828  -9.312   1.240
  392    H    VAL  53           H        VAL  53   2.891  -5.926   0.942
  393    HA   VAL  53           HA       VAL  53   2.991  -3.469  -0.572
  394    HB   VAL  53           HB       VAL  53   1.473  -3.997   1.983
  395   HG11  VAL  53          HG11      VAL  53   1.544  -1.673   1.527
  396   HG12  VAL  53          HG12      VAL  53  -0.040  -2.239   0.995
  397   HG13  VAL  53          HG13      VAL  53   1.230  -1.929  -0.189
  398   HG21  VAL  53          HG21      VAL  53   0.479  -4.345  -0.841
  399   HG22  VAL  53          HG22      VAL  53  -0.409  -4.662   0.650
  400   HG23  VAL  53          HG23      VAL  53   0.970  -5.671   0.213
  401    H    LYS  54           H        LYS  54   4.190  -1.737  -0.122
  402    HA   LYS  54           HA       LYS  54   5.458  -1.578   2.534
  403    HB2  LYS  54           HB2      LYS  54   6.480  -0.841  -0.197
  404    HB3  LYS  54           HB3      LYS  54   7.185  -0.150   1.258
  405    HG2  LYS  54           HG2      LYS  54   6.914  -3.111   1.002
  406    HG3  LYS  54           HG3      LYS  54   8.232  -2.267   0.187
  407    HD2  LYS  54           HD2      LYS  54   7.695  -1.760   3.085
  408    HD3  LYS  54           HD3      LYS  54   8.584  -3.202   2.592
  409    HE2  LYS  54           HE2      LYS  54  10.027  -1.558   1.218
  410    HE3  LYS  54           HE3      LYS  54   9.324  -0.318   2.255
  411    HZ1  LYS  54           HZ1      LYS  54  10.148  -1.564   4.185
  412    HZ2  LYS  54           HZ2      LYS  54  11.404  -1.068   3.166
  413    HZ3  LYS  54           HZ3      LYS  54  10.889  -2.679   3.149
  414    H    TYR  55           H        TYR  55   4.483  -0.085   3.726
  415    HA   TYR  55           HA       TYR  55   2.817   1.945   2.795
  416    HB2  TYR  55           HB2      TYR  55   4.198   1.384   5.378
  417    HB3  TYR  55           HB3      TYR  55   3.479   2.975   5.151
  418    HD1  TYR  55           HD1      TYR  55   2.254  -0.330   3.953
  419    HD2  TYR  55           HD2      TYR  55   1.623   2.966   6.568
  420    HE1  TYR  55           HE1      TYR  55   0.055  -1.244   4.565
  421    HE2  TYR  55           HE2      TYR  55  -0.578   2.061   7.188
  422    HH   TYR  55           HH       TYR  55  -1.557  -1.105   6.383
  423    H    ILE  56           H        ILE  56   3.119   3.970   2.088
  424    HA   ILE  56           HA       ILE  56   5.884   4.949   1.916
  425    HB   ILE  56           HB       ILE  56   3.515   5.209   0.139
  426   HG12  ILE  56          HG12      ILE  56   5.132   4.868  -1.599
  427   HG13  ILE  56          HG13      ILE  56   6.467   5.203  -0.502
  428   HG21  ILE  56          HG21      ILE  56   4.636   7.203  -0.972
  429   HG22  ILE  56          HG22      ILE  56   5.523   7.408   0.539
  430   HG23  ILE  56          HG23      ILE  56   3.763   7.515   0.528
  431   HD11  ILE  56          HD11      ILE  56   5.847   3.156   0.763
  432   HD12  ILE  56          HD12      ILE  56   6.372   2.857  -0.894
  433   HD13  ILE  56          HD13      ILE  56   4.657   2.806  -0.490
  434    H    LYS  57           H        LYS  57   2.580   6.200   2.326
  435    HA   LYS  57           HA       LYS  57   3.450   8.691   3.396
  436    HB2  LYS  57           HB2      LYS  57   0.994   7.475   2.577
  437    HB3  LYS  57           HB3      LYS  57   0.770   8.182   4.171
  438    HG2  LYS  57           HG2      LYS  57   1.805   9.619   1.734
  439    HG3  LYS  57           HG3      LYS  57   0.178   9.750   2.406
  440    HD2  LYS  57           HD2      LYS  57   1.036  10.730   4.429
  441    HD3  LYS  57           HD3      LYS  57   2.699  10.454   3.906
  442    HE2  LYS  57           HE2      LYS  57   0.718  12.228   2.483
  443    HE3  LYS  57           HE3      LYS  57   1.945  12.799   3.613
  444    HZ1  LYS  57           HZ1      LYS  57   2.823  13.075   1.459
  445    HZ2  LYS  57           HZ2      LYS  57   2.366  11.520   0.974
  446    HZ3  LYS  57           HZ3      LYS  57   3.612  11.721   2.100
  447    H    ARG  58           H        ARG  58   2.438   9.408   5.589
  448    HA   ARG  58           HA       ARG  58   3.454   7.548   7.591
  449    HB2  ARG  58           HB2      ARG  58   3.024  10.474   7.437
  450    HB3  ARG  58           HB3      ARG  58   2.801   9.743   9.020
  451    HG2  ARG  58           HG2      ARG  58   5.064  10.550   8.773
  452    HG3  ARG  58           HG3      ARG  58   5.053   8.789   8.891
  453    HD2  ARG  58           HD2      ARG  58   5.338   8.581   6.509
  454    HD3  ARG  58           HD3      ARG  58   5.181  10.324   6.299
  455    HE   ARG  58           HE       ARG  58   7.306   9.860   8.044
  456   HH11  ARG  58          HH11      ARG  58   6.481   9.283   4.703
  457   HH12  ARG  58          HH12      ARG  58   8.123   9.342   4.157
  458   HH21  ARG  58          HH21      ARG  58   9.467   9.938   7.328
  459   HH22  ARG  58          HH22      ARG  58   9.818   9.713   5.647
  460    HA   PRO  59           HA       PRO  59  -0.445   6.383   9.273
  461    HB2  PRO  59           HB2      PRO  59  -0.082   6.570  11.959
  462    HB3  PRO  59           HB3      PRO  59   0.657   5.301  10.975
  463    HG2  PRO  59           HG2      PRO  59   1.855   7.849  11.994
  464    HG3  PRO  59           HG3      PRO  59   2.559   6.221  11.948
  465    HD2  PRO  59           HD2      PRO  59   3.171   8.119  10.120
  466    HD3  PRO  59           HD3      PRO  59   3.122   6.390   9.717
  467    H    GLY  60           H        GLY  60  -2.338   7.395   9.398
  468    HA2  GLY  60           HA2      GLY  60  -3.937   8.869  10.269
  469    HA3  GLY  60           HA3      GLY  60  -2.651   9.754  11.073
  470    H    ALA  61           H        ALA  61  -1.267   9.635   8.274
  471    HA   ALA  61           HA       ALA  61  -1.803  12.252   7.506
  472    HB1  ALA  61           HB1      ALA  61   0.226  11.042   6.873
  473    HB2  ALA  61           HB2      ALA  61  -0.572  11.746   5.467
  474    HB3  ALA  61           HB3      ALA  61  -0.721  10.019   5.792
  475    H    VAL  62           H        VAL  62  -3.008  13.177   5.854
  476    HA   VAL  62           HA       VAL  62  -5.475  11.833   5.237
  477    HB   VAL  62           HB       VAL  62  -4.519  14.490   4.169
  478   HG11  VAL  62          HG11      VAL  62  -7.339  13.555   4.636
  479   HG12  VAL  62          HG12      VAL  62  -6.499  13.333   3.101
  480   HG13  VAL  62          HG13      VAL  62  -6.791  14.958   3.720
  481   HG21  VAL  62          HG21      VAL  62  -4.402  14.478   6.613
  482   HG22  VAL  62          HG22      VAL  62  -6.076  13.928   6.692
  483   HG23  VAL  62          HG23      VAL  62  -5.702  15.522   6.038
  484    H    LEU  63           H        LEU  63  -5.948  10.713   3.458
  485    HA   LEU  63           HA       LEU  63  -3.941  10.409   1.400
  486    HB2  LEU  63           HB2      LEU  63  -6.471   9.034   2.146
  487    HB3  LEU  63           HB3      LEU  63  -5.935   8.900   0.482
  488    HG   LEU  63           HG       LEU  63  -3.856   7.880   1.173
  489   HD11  LEU  63          HD11      LEU  63  -4.790   8.657   3.901
  490   HD12  LEU  63          HD12      LEU  63  -3.204   8.857   3.156
  491   HD13  LEU  63          HD13      LEU  63  -3.730   7.263   3.696
  492   HD21  LEU  63          HD21      LEU  63  -4.692   5.802   2.054
  493   HD22  LEU  63          HD22      LEU  63  -5.869   6.462   0.919
  494   HD23  LEU  63          HD23      LEU  63  -6.147   6.598   2.655
  495    H    GLU  64           H        GLU  64  -4.213  10.846  -0.796
  496    HA   GLU  64           HA       GLU  64  -6.446  12.650  -1.462
  497    HB2  GLU  64           HB2      GLU  64  -3.650  12.905  -2.568
  498    HB3  GLU  64           HB3      GLU  64  -4.984  14.035  -2.753
  499    HG2  GLU  64           HG2      GLU  64  -3.581  13.392  -0.169
  500    HG3  GLU  64           HG3      GLU  64  -3.316  14.829  -1.156
  501    H    ALA  65           H        ALA  65  -7.299  12.504  -3.535
  502    HA   ALA  65           HA       ALA  65  -7.278   9.967  -4.736
  503    HB1  ALA  65           HB1      ALA  65  -8.083  12.291  -6.386
  504    HB2  ALA  65           HB2      ALA  65  -8.953  12.036  -4.873
  505    HB3  ALA  65           HB3      ALA  65  -8.914  10.763  -6.094
  506    H    GLY  66           H        GLY  66  -5.349   9.206  -5.450
  507    HA2  GLY  66           HA2      GLY  66  -4.160   9.058  -7.615
  508    HA3  GLY  66           HA3      GLY  66  -3.996  10.806  -7.536
  509    H    CYS  67           H        CYS  67  -3.446  10.649  -4.603
  510    HA   CYS  67           HA       CYS  67  -0.628  10.567  -4.754
  511    HB2  CYS  67           HB2      CYS  67  -1.887  11.931  -3.112
  512    HB3  CYS  67           HB3      CYS  67  -2.378  10.455  -2.288
  513    HG   CYS  67           HG       CYS  67   0.627  10.662  -2.397
  514    H    VAL  68           H        VAL  68   0.858   9.104  -3.856
  515    HA   VAL  68           HA       VAL  68   0.012   6.350  -3.997
  516    HB   VAL  68           HB       VAL  68   2.758   7.352  -3.261
  517   HG11  VAL  68          HG11      VAL  68   3.337   5.148  -4.445
  518   HG12  VAL  68          HG12      VAL  68   1.632   4.750  -4.232
  519   HG13  VAL  68          HG13      VAL  68   2.647   5.062  -2.824
  520   HG21  VAL  68          HG21      VAL  68   3.353   7.411  -5.550
  521   HG22  VAL  68          HG22      VAL  68   1.850   8.323  -5.417
  522   HG23  VAL  68          HG23      VAL  68   1.828   6.674  -6.042
  523    H    VAL  69           H        VAL  69  -0.856   5.355  -2.321
  524    HA   VAL  69           HA       VAL  69  -0.428   6.292   0.380
  525    HB   VAL  69           HB       VAL  69  -1.955   3.819  -0.405
  526   HG11  VAL  69          HG11      VAL  69  -1.534   4.110   1.970
  527   HG12  VAL  69          HG12      VAL  69  -3.246   4.346   1.616
  528   HG13  VAL  69          HG13      VAL  69  -2.206   5.740   1.907
  529   HG21  VAL  69          HG21      VAL  69  -3.057   6.623  -0.287
  530   HG22  VAL  69          HG22      VAL  69  -3.940   5.149  -0.684
  531   HG23  VAL  69          HG23      VAL  69  -2.694   5.753  -1.777
  532    H    ALA  70           H        ALA  70   0.684   3.692  -1.656
  533    HA   ALA  70           HA       ALA  70   2.754   3.011   0.188
  534    HB1  ALA  70           HB1      ALA  70   0.648   1.839   1.068
  535    HB2  ALA  70           HB2      ALA  70   2.112   0.874   0.876
  536    HB3  ALA  70           HB3      ALA  70   0.825   0.772  -0.325
  537    H    ARG  71           H        ARG  71   3.228   0.366  -0.768
  538    HA   ARG  71           HA       ARG  71   3.522   0.717  -3.664
  539    HB2  ARG  71           HB2      ARG  71   5.721   0.276  -1.665
  540    HB3  ARG  71           HB3      ARG  71   5.894  -0.279  -3.324
  541    HG2  ARG  71           HG2      ARG  71   5.212   2.562  -2.634
  542    HG3  ARG  71           HG3      ARG  71   6.873   1.983  -2.778
  543    HD2  ARG  71           HD2      ARG  71   5.062   1.310  -5.006
  544    HD3  ARG  71           HD3      ARG  71   5.465   3.017  -4.826
  545    HE   ARG  71           HE       ARG  71   7.212   0.901  -5.682
  546   HH11  ARG  71          HH11      ARG  71   7.055   4.079  -4.247
  547   HH12  ARG  71          HH12      ARG  71   8.659   4.513  -4.730
  548   HH21  ARG  71          HH21      ARG  71   9.324   1.471  -6.318
  549   HH22  ARG  71          HH22      ARG  71   9.948   3.034  -5.906
  550    H    LEU  72           H        LEU  72   4.763  -1.455  -4.450
  551    HA   LEU  72           HA       LEU  72   3.645  -3.775  -3.072
  552    HB2  LEU  72           HB2      LEU  72   2.547  -2.636  -5.456
  553    HB3  LEU  72           HB3      LEU  72   3.227  -4.205  -5.842
  554    HG   LEU  72           HG       LEU  72   0.813  -4.268  -5.254
  555   HD11  LEU  72          HD11      LEU  72   2.279  -6.232  -4.996
  556   HD12  LEU  72          HD12      LEU  72   0.960  -6.209  -3.826
  557   HD13  LEU  72          HD13      LEU  72   2.590  -5.755  -3.327
  558   HD21  LEU  72          HD21      LEU  72   1.170  -2.457  -3.442
  559   HD22  LEU  72          HD22      LEU  72   1.605  -3.815  -2.405
  560   HD23  LEU  72          HD23      LEU  72   0.006  -3.748  -3.145
  561    H    GLU  73           H        GLU  73   5.125  -5.317  -2.933
  562    HA   GLU  73           HA       GLU  73   7.533  -5.143  -4.552
  563    HB2  GLU  73           HB2      GLU  73   7.162  -5.755  -1.935
  564    HB3  GLU  73           HB3      GLU  73   7.237  -7.368  -2.630
  565    HG2  GLU  73           HG2      GLU  73   9.391  -6.721  -3.707
  566    HG3  GLU  73           HG3      GLU  73   9.326  -5.213  -2.797
  567    H    LEU  74           H        LEU  74   6.461  -5.739  -6.552
  568    HA   LEU  74           HA       LEU  74   5.163  -8.202  -6.943
  569    HB2  LEU  74           HB2      LEU  74   6.534  -6.261  -8.768
  570    HB3  LEU  74           HB3      LEU  74   5.956  -7.796  -9.388
  571    HG   LEU  74           HG       LEU  74   4.290  -5.615  -8.134
  572   HD11  LEU  74          HD11      LEU  74   3.478  -5.161 -10.242
  573   HD12  LEU  74          HD12      LEU  74   3.935  -6.742 -10.875
  574   HD13  LEU  74          HD13      LEU  74   5.171  -5.519 -10.580
  575   HD21  LEU  74          HD21      LEU  74   3.575  -8.411  -8.978
  576   HD22  LEU  74          HD22      LEU  74   2.380  -7.123  -8.824
  577   HD23  LEU  74          HD23      LEU  74   3.307  -7.638  -7.416
  578    H    ASP  75           H        ASP  75   5.938 -10.057  -8.157
  579    HA   ASP  75           HA       ASP  75   8.425 -11.014  -7.130
  580    HB2  ASP  75           HB2      ASP  75   6.363 -12.416  -7.552
  581    HB3  ASP  75           HB3      ASP  75   6.728 -12.304  -9.271
  582    H    ASP  76           H        ASP  76   9.482  -9.026  -8.251
  583    HA   ASP  76           HA       ASP  76  10.027  -9.293 -11.055
  584    HB2  ASP  76           HB2      ASP  76  11.454  -7.579  -9.012
  585    HB3  ASP  76           HB3      ASP  76  11.490  -7.383 -10.761
  586    H    LEU  77           H        LEU  77  12.612  -8.926 -11.483
  587    HA   LEU  77           HA       LEU  77  13.759 -11.482 -10.746
  588    HB2  LEU  77           HB2      LEU  77  14.527  -9.307 -12.666
  589    HB3  LEU  77           HB3      LEU  77  15.653 -10.590 -12.265
  590    HG   LEU  77           HG       LEU  77  12.896 -11.160 -13.330
  591   HD11  LEU  77          HD11      LEU  77  15.447 -10.837 -14.904
  592   HD12  LEU  77          HD12      LEU  77  14.065  -9.742 -14.941
  593   HD13  LEU  77          HD13      LEU  77  13.898 -11.394 -15.537
  594   HD21  LEU  77          HD21      LEU  77  14.035 -13.275 -14.026
  595   HD22  LEU  77          HD22      LEU  77  13.911 -13.047 -12.281
  596   HD23  LEU  77          HD23      LEU  77  15.443 -12.751 -13.103
  597    H    GLU  78           H        GLU  78  14.052  -8.169  -9.825
  598    HA   GLU  78           HA       GLU  78  16.686  -8.336  -8.731
  599    HB2  GLU  78           HB2      GLU  78  15.332  -6.236  -9.440
  600    HB3  GLU  78           HB3      GLU  78  14.619  -6.349  -7.837
  601    HG2  GLU  78           HG2      GLU  78  16.582  -5.818  -6.773
  602    HG3  GLU  78           HG3      GLU  78  17.584  -6.378  -8.111
  603    H    HIS  79           H        HIS  79  16.596 -10.235  -7.448
  604    HA   HIS  79           HA       HIS  79  15.052  -9.952  -4.955
  605    HB2  HIS  79           HB2      HIS  79  14.676 -11.971  -6.539
  606    HB3  HIS  79           HB3      HIS  79  16.219 -12.550  -5.918
  607    HD1  HIS  79           HD1      HIS  79  15.769 -14.283  -4.224
  608    HD2  HIS  79           HD2      HIS  79  13.055 -11.147  -3.971
  609    HE1  HIS  79           HE1      HIS  79  14.293 -14.829  -2.263
  610    HE2  HIS  79           HE2      HIS  79  12.603 -12.961  -2.184
  611    H    HIS  80           H        HIS  80  16.187  -9.477  -3.205
  612    HA   HIS  80           HA       HIS  80  18.722 -10.718  -2.663
  613    HB2  HIS  80           HB2      HIS  80  19.252  -8.732  -4.165
  614    HB3  HIS  80           HB3      HIS  80  18.704  -7.706  -2.843
  615    HD1  HIS  80           HD1      HIS  80  21.046 -10.714  -2.928
  616    HD2  HIS  80           HD2      HIS  80  20.908  -6.780  -1.599
  617    HE1  HIS  80           HE1      HIS  80  23.240 -10.321  -1.763
  618    HE2  HIS  80           HE2      HIS  80  23.098  -7.962  -0.891
  619    H    HIS  81           H        HIS  81  19.277 -10.643  -0.497
  620    HA   HIS  81           HA       HIS  81  17.544  -9.077   1.280
  621    HB2  HIS  81           HB2      HIS  81  16.934 -11.626   0.936
  622    HB3  HIS  81           HB3      HIS  81  18.255 -11.869   2.073
  623    HD1  HIS  81           HD1      HIS  81  14.873 -10.211   1.829
  624    HD2  HIS  81           HD2      HIS  81  17.643 -11.361   4.705
  625    HE1  HIS  81           HE1      HIS  81  13.717  -9.895   4.040
  626    HE2  HIS  81           HE2      HIS  81  15.382 -10.680   5.760
  627    H    HIS  82           H        HIS  82  18.486  -8.390   3.178
  628    HA   HIS  82           HA       HIS  82  21.398  -8.636   3.272
  629    HB2  HIS  82           HB2      HIS  82  19.432  -6.694   4.457
  630    HB3  HIS  82           HB3      HIS  82  21.081  -6.793   5.067
  631    HD1  HIS  82           HD1      HIS  82  22.482  -5.033   4.068
  632    HD2  HIS  82           HD2      HIS  82  19.647  -6.445   1.377
  633    HE1  HIS  82           HE1      HIS  82  22.866  -3.740   1.945
  634    HE2  HIS  82           HE2      HIS  82  21.083  -4.549   0.361
  635    H    HIS  83           H        HIS  83  22.143 -10.269   4.453
  636    HA   HIS  83           HA       HIS  83  20.646 -11.444   6.591
  637    HB2  HIS  83           HB2      HIS  83  22.586 -12.916   6.863
  638    HB3  HIS  83           HB3      HIS  83  22.124 -12.794   5.169
  639    HD1  HIS  83           HD1      HIS  83  23.690 -11.254   3.655
  640    HD2  HIS  83           HD2      HIS  83  25.166 -12.181   7.427
  641    HE1  HIS  83           HE1      HIS  83  26.146 -10.722   3.565
  642    HE2  HIS  83           HE2      HIS  83  27.001 -11.210   5.885
  643    H    HIS  84           H        HIS  84  21.711 -11.825   8.760
  644    HA   HIS  84           HA       HIS  84  22.388  -9.255   9.887
  645    HB2  HIS  84           HB2      HIS  84  22.291 -10.446  12.054
  646    HB3  HIS  84           HB3      HIS  84  20.839 -10.694  11.089
  647    HD1  HIS  84           HD1      HIS  84  20.124 -13.053  10.810
  648    HD2  HIS  84           HD2      HIS  84  24.135 -12.754  11.855
  649    HE1  HIS  84           HE1      HIS  84  20.908 -15.418  11.151
  650    HE2  HIS  84           HE2      HIS  84  23.315 -15.207  11.866
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1   1.028  11.325 -15.494
    2    H2   MET   1           H2       MET   1   2.320  10.234 -15.217
    3    H3   MET   1           H3       MET   1   1.509  10.234 -16.729
    4    HA   MET   1           HA       MET   1   0.258   9.584 -14.146
    5    HB2  MET   1           HB2      MET   1  -0.618   9.599 -17.026
    6    HB3  MET   1           HB3      MET   1  -1.434   8.599 -15.833
    7    HG2  MET   1           HG2      MET   1  -2.377  10.374 -14.777
    8    HG3  MET   1           HG3      MET   1  -1.056  11.465 -15.190
    9    HE1  MET   1           HE1      MET   1  -4.610  12.729 -16.716
   10    HE2  MET   1           HE2      MET   1  -3.609  12.780 -15.264
   11    HE3  MET   1           HE3      MET   1  -4.641  11.385 -15.576
   12    H    GLU   2           H        GLU   2   1.984   8.158 -13.579
   13    HA   GLU   2           HA       GLU   2   1.990   5.674 -15.164
   14    HB2  GLU   2           HB2      GLU   2   4.142   7.175 -15.121
   15    HB3  GLU   2           HB3      GLU   2   4.366   6.473 -13.525
   16    HG2  GLU   2           HG2      GLU   2   4.590   4.307 -14.384
   17    HG3  GLU   2           HG3      GLU   2   3.923   4.768 -15.949
   18    H    ASN   3           H        ASN   3   0.915   4.189 -14.048
   19    HA   ASN   3           HA       ASN   3   1.330   4.056 -11.132
   20    HB2  ASN   3           HB2      ASN   3  -1.134   3.445 -12.767
   21    HB3  ASN   3           HB3      ASN   3  -0.949   2.941 -11.090
   22   HD21  ASN   3          HD21      ASN   3  -1.555   4.307  -9.562
   23   HD22  ASN   3          HD22      ASN   3  -1.896   5.985  -9.788
   24    H    ASP   4           H        ASP   4   2.858   2.514 -10.921
   25    HA   ASP   4           HA       ASP   4   2.843   0.132 -12.548
   26    HB2  ASP   4           HB2      ASP   4   4.634   1.311 -10.486
   27    HB3  ASP   4           HB3      ASP   4   4.698  -0.436 -10.703
   28    HA   PRO   5           HA       PRO   5   0.527  -2.533  -9.915
   29    HB2  PRO   5           HB2      PRO   5   1.865  -4.886 -10.126
   30    HB3  PRO   5           HB3      PRO   5   0.884  -4.219 -11.436
   31    HG2  PRO   5           HG2      PRO   5   3.851  -4.112 -11.048
   32    HG3  PRO   5           HG3      PRO   5   2.927  -4.439 -12.526
   33    HD2  PRO   5           HD2      PRO   5   4.019  -2.019 -12.000
   34    HD3  PRO   5           HD3      PRO   5   2.502  -2.203 -12.904
   35    H    THR   6           H        THR   6   3.951  -2.193  -9.322
   36    HA   THR   6           HA       THR   6   3.758  -3.399  -6.679
   37    HB   THR   6           HB       THR   6   6.161  -3.067  -6.552
   38    HG1  THR   6           HG1      THR   6   7.254  -1.875  -7.988
   39   HG21  THR   6          HG21      THR   6   5.650  -3.969  -9.361
   40   HG22  THR   6          HG22      THR   6   5.237  -4.958  -7.961
   41   HG23  THR   6          HG23      THR   6   6.913  -4.489  -8.246
   42    H    VAL   7           H        VAL   7   2.188  -1.049  -7.090
   43    HA   VAL   7           HA       VAL   7   3.292   0.591  -4.956
   44    HB   VAL   7           HB       VAL   7   2.293   1.928  -7.462
   45   HG11  VAL   7          HG11      VAL   7   4.092   3.265  -5.539
   46   HG12  VAL   7          HG12      VAL   7   2.450   2.934  -4.987
   47   HG13  VAL   7          HG13      VAL   7   2.715   3.901  -6.439
   48   HG21  VAL   7          HG21      VAL   7   4.340   0.685  -7.989
   49   HG22  VAL   7          HG22      VAL   7   5.163   1.479  -6.646
   50   HG23  VAL   7          HG23      VAL   7   4.610   2.428  -8.026
   51    H    LEU   8           H        LEU   8   1.748   0.840  -3.502
   52    HA   LEU   8           HA       LEU   8  -1.034   0.454  -4.259
   53    HB2  LEU   8           HB2      LEU   8   0.408  -0.313  -2.067
   54    HB3  LEU   8           HB3      LEU   8  -0.424   1.106  -1.459
   55    HG   LEU   8           HG       LEU   8  -1.736  -0.824  -0.926
   56   HD11  LEU   8          HD11      LEU   8  -3.777  -0.069  -1.635
   57   HD12  LEU   8          HD12      LEU   8  -3.221   0.227  -3.282
   58   HD13  LEU   8          HD13      LEU   8  -2.777   1.339  -1.988
   59   HD21  LEU   8          HD21      LEU   8  -2.136  -1.547  -3.785
   60   HD22  LEU   8          HD22      LEU   8  -2.250  -2.550  -2.339
   61   HD23  LEU   8          HD23      LEU   8  -0.669  -2.087  -2.969
   62    H    ARG   9           H        ARG   9  -2.642   1.973  -4.057
   63    HA   ARG   9           HA       ARG   9  -2.018   4.610  -3.014
   64    HB2  ARG   9           HB2      ARG   9  -2.931   4.249  -5.873
   65    HB3  ARG   9           HB3      ARG   9  -2.665   5.781  -5.052
   66    HG2  ARG   9           HG2      ARG   9  -0.251   4.921  -4.726
   67    HG3  ARG   9           HG3      ARG   9  -0.661   3.782  -6.011
   68    HD2  ARG   9           HD2      ARG   9  -1.530   5.991  -7.185
   69    HD3  ARG   9           HD3      ARG   9  -0.348   6.737  -6.109
   70    HE   ARG   9           HE       ARG   9   0.745   4.518  -7.530
   71   HH11  ARG   9          HH11      ARG   9  -0.069   7.900  -7.812
   72   HH12  ARG   9          HH12      ARG   9   1.105   8.208  -9.047
   73   HH21  ARG   9          HH21      ARG   9   2.289   4.921  -9.154
   74   HH22  ARG   9          HH22      ARG   9   2.444   6.517  -9.810
   75    H    SER  10           H        SER  10  -3.786   5.677  -2.250
   76    HA   SER  10           HA       SER  10  -6.159   4.187  -1.825
   77    HB2  SER  10           HB2      SER  10  -5.012   6.274  -0.544
   78    HB3  SER  10           HB3      SER  10  -6.270   7.122  -1.442
   79    HG   SER  10           HG       SER  10  -6.492   5.251   0.611
   80    HA   PRO  11           HA       PRO  11  -8.480   5.256  -5.431
   81    HB2  PRO  11           HB2      PRO  11 -10.998   4.887  -4.519
   82    HB3  PRO  11           HB3      PRO  11  -9.893   3.541  -4.825
   83    HG2  PRO  11           HG2      PRO  11 -10.589   4.870  -2.233
   84    HG3  PRO  11           HG3      PRO  11 -10.419   3.142  -2.594
   85    HD2  PRO  11           HD2      PRO  11  -8.468   4.596  -1.385
   86    HD3  PRO  11           HD3      PRO  11  -8.125   3.205  -2.433
   87    H    SER  12           H        SER  12  -9.146   6.857  -2.383
   88    HA   SER  12           HA       SER  12  -9.635   9.345  -3.781
   89    HB2  SER  12           HB2      SER  12 -11.720   8.321  -1.845
   90    HB3  SER  12           HB3      SER  12 -11.786   9.799  -2.804
   91    HG   SER  12           HG       SER  12 -13.011   8.190  -3.796
   92    H    ALA  13           H        ALA  13 -10.161  11.109  -2.026
   93    HA   ALA  13           HA       ALA  13  -7.963  11.055  -0.187
   94    HB1  ALA  13           HB1      ALA  13  -8.606  13.106  -1.359
   95    HB2  ALA  13           HB2      ALA  13  -8.651  13.320   0.391
   96    HB3  ALA  13           HB3      ALA  13 -10.152  13.106  -0.511
   97    H    GLY  14           H        GLY  14  -8.008  10.155   1.759
   98    HA2  GLY  14           HA2      GLY  14 -10.470  10.364   3.353
   99    HA3  GLY  14           HA3      GLY  14  -9.726   8.788   3.134
  100    H    LYS  15           H        LYS  15  -8.864   8.244   5.031
  101    HA   LYS  15           HA       LYS  15  -6.677   9.767   6.084
  102    HB2  LYS  15           HB2      LYS  15  -8.687  10.926   7.045
  103    HB3  LYS  15           HB3      LYS  15  -9.092   9.425   7.866
  104    HG2  LYS  15           HG2      LYS  15  -6.348  10.354   8.310
  105    HG3  LYS  15           HG3      LYS  15  -7.604  11.426   8.931
  106    HD2  LYS  15           HD2      LYS  15  -7.868   8.517   9.474
  107    HD3  LYS  15           HD3      LYS  15  -6.633   9.412  10.363
  108    HE2  LYS  15           HE2      LYS  15  -9.433  10.454  10.189
  109    HE3  LYS  15           HE3      LYS  15  -9.022   9.198  11.356
  110    HZ1  LYS  15           HZ1      LYS  15  -7.772  11.885  11.156
  111    HZ2  LYS  15           HZ2      LYS  15  -7.292  10.674  12.234
  112    HZ3  LYS  15           HZ3      LYS  15  -8.832  11.360  12.365
  113    H    LEU  16           H        LEU  16  -5.270   8.478   7.138
  114    HA   LEU  16           HA       LEU  16  -5.663   5.671   7.091
  115    HB2  LEU  16           HB2      LEU  16  -3.482   7.208   7.090
  116    HB3  LEU  16           HB3      LEU  16  -3.547   6.862   8.805
  117    HG   LEU  16           HG       LEU  16  -3.369   4.490   8.398
  118   HD11  LEU  16          HD11      LEU  16  -4.594   4.112   6.438
  119   HD12  LEU  16          HD12      LEU  16  -2.925   3.751   5.997
  120   HD13  LEU  16          HD13      LEU  16  -3.651   5.285   5.518
  121   HD21  LEU  16          HD21      LEU  16  -1.342   6.123   8.269
  122   HD22  LEU  16          HD22      LEU  16  -1.311   5.647   6.572
  123   HD23  LEU  16          HD23      LEU  16  -1.137   4.427   7.833
  124    H    THR  17           H        THR  17  -7.261   4.894   8.368
  125    HA   THR  17           HA       THR  17  -7.722   5.852  11.025
  126    HB   THR  17           HB       THR  17  -9.534   4.968   9.592
  127    HG1  THR  17           HG1      THR  17 -10.448   4.590  11.421
  128   HG21  THR  17          HG21      THR  17  -8.616   2.194  10.192
  129   HG22  THR  17          HG22      THR  17  -8.080   3.022   8.731
  130   HG23  THR  17          HG23      THR  17  -9.800   2.754   9.012
  131    H    GLN  18           H        GLN  18  -6.351   2.865   9.661
  132    HA   GLN  18           HA       GLN  18  -4.592   2.541  11.881
  133    HB2  GLN  18           HB2      GLN  18  -7.093   1.624  12.424
  134    HB3  GLN  18           HB3      GLN  18  -6.360   0.182  11.736
  135    HG2  GLN  18           HG2      GLN  18  -4.419   0.743  13.396
  136    HG3  GLN  18           HG3      GLN  18  -5.679   1.649  14.233
  137   HE21  GLN  18          HE21      GLN  18  -5.050  -0.002  15.891
  138   HE22  GLN  18          HE22      GLN  18  -5.922  -1.493  15.887
  139    H    TYR  19           H        TYR  19  -4.233  -0.272  11.675
  140    HA   TYR  19           HA       TYR  19  -3.738  -0.831   8.866
  141    HB2  TYR  19           HB2      TYR  19  -1.330  -1.391   9.361
  142    HB3  TYR  19           HB3      TYR  19  -1.714   0.327   9.387
  143    HD1  TYR  19           HD1      TYR  19  -1.108  -2.619  11.554
  144    HD2  TYR  19           HD2      TYR  19  -1.332   1.623  11.322
  145    HE1  TYR  19           HE1      TYR  19  -0.160  -2.451  13.817
  146    HE2  TYR  19           HE2      TYR  19  -0.384   1.803  13.583
  147    HH   TYR  19           HH       TYR  19  -0.307  -0.576  15.740
  148    H    THR  20           H        THR  20  -3.677  -2.987   8.402
  149    HA   THR  20           HA       THR  20  -4.348  -4.783  10.605
  150    HB   THR  20           HB       THR  20  -5.270  -6.247   8.987
  151    HG1  THR  20           HG1      THR  20  -4.483  -6.410   7.059
  152   HG21  THR  20          HG21      THR  20  -6.618  -4.721   7.458
  153   HG22  THR  20          HG22      THR  20  -5.813  -3.388   8.287
  154   HG23  THR  20          HG23      THR  20  -6.815  -4.518   9.199
  155    H    VAL  21           H        VAL  21  -1.641  -3.923   8.792
  156    HA   VAL  21           HA       VAL  21  -0.190  -6.230   9.805
  157    HB   VAL  21           HB       VAL  21   0.903  -6.682   7.643
  158   HG11  VAL  21          HG11      VAL  21  -0.884  -7.968   6.678
  159   HG12  VAL  21          HG12      VAL  21  -2.094  -6.960   7.472
  160   HG13  VAL  21          HG13      VAL  21  -1.044  -8.001   8.434
  161   HG21  VAL  21          HG21      VAL  21   0.048  -4.289   6.822
  162   HG22  VAL  21          HG22      VAL  21  -1.235  -5.289   6.141
  163   HG23  VAL  21          HG23      VAL  21   0.446  -5.592   5.703
  164    H    GLU  22           H        GLU  22   1.984  -5.863  10.133
  165    HA   GLU  22           HA       GLU  22   2.784  -3.161  10.454
  166    HB2  GLU  22           HB2      GLU  22   4.957  -4.112  11.127
  167    HB3  GLU  22           HB3      GLU  22   3.611  -4.903  11.935
  168    HG2  GLU  22           HG2      GLU  22   4.072  -6.888  11.023
  169    HG3  GLU  22           HG3      GLU  22   4.414  -6.192   9.440
  170    H    ASP  23           H        ASP  23   5.226  -2.712   9.663
  171    HA   ASP  23           HA       ASP  23   5.043  -2.124   6.933
  172    HB2  ASP  23           HB2      ASP  23   7.614  -2.350   8.503
  173    HB3  ASP  23           HB3      ASP  23   7.307  -1.347   7.088
  174    H    GLY  24           H        GLY  24   5.455  -3.265   5.148
  175    HA2  GLY  24           HA2      GLY  24   6.298  -4.900   3.758
  176    HA3  GLY  24           HA3      GLY  24   7.433  -5.324   5.031
  177    H    GLY  25           H        GLY  25   4.011  -5.281   5.659
  178    HA2  GLY  25           HA2      GLY  25   4.023  -7.980   6.544
  179    HA3  GLY  25           HA3      GLY  25   2.605  -6.960   6.360
  180    H    HIS  26           H        HIS  26   4.150  -9.687   5.250
  181    HA   HIS  26           HA       HIS  26   3.549  -9.685   2.505
  182    HB2  HIS  26           HB2      HIS  26   3.787 -12.131   2.645
  183    HB3  HIS  26           HB3      HIS  26   5.084 -11.305   3.502
  184    HD1  HIS  26           HD1      HIS  26   2.161 -13.550   4.028
  185    HD2  HIS  26           HD2      HIS  26   5.048 -11.615   6.305
  186    HE1  HIS  26           HE1      HIS  26   2.019 -14.586   6.315
  187    HE2  HIS  26           HE2      HIS  26   3.834 -13.460   7.651
  188    H    VAL  27           H        VAL  27   1.670  -9.753   1.475
  189    HA   VAL  27           HA       VAL  27  -0.583 -11.195   2.639
  190    HB   VAL  27           HB       VAL  27  -2.148  -9.345   2.236
  191   HG11  VAL  27          HG11      VAL  27  -1.100  -9.704   4.464
  192   HG12  VAL  27          HG12      VAL  27  -1.603  -8.038   4.173
  193   HG13  VAL  27          HG13      VAL  27   0.100  -8.480   4.048
  194   HG21  VAL  27          HG21      VAL  27  -0.772  -8.212   0.499
  195   HG22  VAL  27          HG22      VAL  27   0.289  -7.629   1.782
  196   HG23  VAL  27          HG23      VAL  27  -1.399  -7.120   1.734
  197    H    GLU  28           H        GLU  28  -1.898 -12.126   1.142
  198    HA   GLU  28           HA       GLU  28  -0.997 -12.055  -1.608
  199    HB2  GLU  28           HB2      GLU  28  -2.420 -13.943  -1.965
  200    HB3  GLU  28           HB3      GLU  28  -1.610 -14.178  -0.423
  201    HG2  GLU  28           HG2      GLU  28  -4.025 -12.826   0.113
  202    HG3  GLU  28           HG3      GLU  28  -4.398 -14.137  -1.004
  203    H    ALA  29           H        ALA  29  -2.553 -11.857  -3.399
  204    HA   ALA  29           HA       ALA  29  -3.819  -9.432  -3.506
  205    HB1  ALA  29           HB1      ALA  29  -4.472 -10.004  -5.602
  206    HB2  ALA  29           HB2      ALA  29  -5.054 -11.593  -5.108
  207    HB3  ALA  29           HB3      ALA  29  -3.326 -11.315  -5.324
  208    H    GLY  30           H        GLY  30  -5.696  -8.586  -2.832
  209    HA2  GLY  30           HA2      GLY  30  -8.005  -8.619  -2.326
  210    HA3  GLY  30           HA3      GLY  30  -7.914 -10.364  -2.136
  211    H    SER  31           H        SER  31  -5.457 -10.023  -0.429
  212    HA   SER  31           HA       SER  31  -6.810  -9.933   2.076
  213    HB2  SER  31           HB2      SER  31  -4.879 -11.396   1.740
  214    HB3  SER  31           HB3      SER  31  -3.848  -9.995   1.448
  215    HG   SER  31           HG       SER  31  -3.567 -10.513   3.563
  216    H    SER  32           H        SER  32  -7.172  -8.260   3.379
  217    HA   SER  32           HA       SER  32  -6.534  -5.615   2.600
  218    HB2  SER  32           HB2      SER  32  -7.279  -5.229   5.132
  219    HB3  SER  32           HB3      SER  32  -8.448  -5.623   3.872
  220    HG   SER  32           HG       SER  32  -7.420  -7.233   5.922
  221    H    TYR  33           H        TYR  33  -4.969  -4.227   3.257
  222    HA   TYR  33           HA       TYR  33  -2.888  -5.333   5.025
  223    HB2  TYR  33           HB2      TYR  33  -1.244  -4.076   3.795
  224    HB3  TYR  33           HB3      TYR  33  -2.206  -5.001   2.648
  225    HD1  TYR  33           HD1      TYR  33  -1.439  -1.645   3.915
  226    HD2  TYR  33           HD2      TYR  33  -3.669  -3.891   1.072
  227    HE1  TYR  33           HE1      TYR  33  -1.919   0.420   2.669
  228    HE2  TYR  33           HE2      TYR  33  -4.154  -1.833  -0.182
  229    HH   TYR  33           HH       TYR  33  -2.515   0.946   0.139
  230    H    ALA  34           H        ALA  34  -5.212  -2.894   4.693
  231    HA   ALA  34           HA       ALA  34  -4.583  -1.726   7.190
  232    HB1  ALA  34           HB1      ALA  34  -4.249   0.316   5.058
  233    HB2  ALA  34           HB2      ALA  34  -2.885  -0.744   5.414
  234    HB3  ALA  34           HB3      ALA  34  -3.578   0.260   6.688
  235    H    GLU  35           H        GLU  35  -5.772   0.712   7.028
  236    HA   GLU  35           HA       GLU  35  -8.316   0.387   5.640
  237    HB2  GLU  35           HB2      GLU  35  -8.063   0.671   8.638
  238    HB3  GLU  35           HB3      GLU  35  -9.561   0.928   7.755
  239    HG2  GLU  35           HG2      GLU  35  -9.740  -1.324   7.169
  240    HG3  GLU  35           HG3      GLU  35  -8.050  -1.649   7.550
  241    H    MET  36           H        MET  36  -9.678   2.371   5.838
  242    HA   MET  36           HA       MET  36  -8.295   4.793   6.620
  243    HB2  MET  36           HB2      MET  36  -8.443   5.856   4.440
  244    HB3  MET  36           HB3      MET  36  -7.475   4.393   4.329
  245    HG2  MET  36           HG2      MET  36  -9.868   3.381   3.692
  246    HG3  MET  36           HG3      MET  36 -10.090   5.037   3.130
  247    HE1  MET  36           HE1      MET  36  -9.754   4.836   0.126
  248    HE2  MET  36           HE2      MET  36 -10.694   3.738   1.137
  249    HE3  MET  36           HE3      MET  36  -9.577   3.092  -0.065
  250    H    GLU  37           H        GLU  37  -9.739   6.007   7.629
  251    HA   GLU  37           HA       GLU  37 -12.576   5.561   7.175
  252    HB2  GLU  37           HB2      GLU  37 -11.531   5.724   9.479
  253    HB3  GLU  37           HB3      GLU  37 -11.309   7.440   9.167
  254    HG2  GLU  37           HG2      GLU  37 -13.675   7.774   8.990
  255    HG3  GLU  37           HG3      GLU  37 -13.970   6.040   9.097
  256    H    VAL  38           H        VAL  38 -13.320   6.591   5.420
  257    HA   VAL  38           HA       VAL  38 -12.432   9.301   4.818
  258    HB   VAL  38           HB       VAL  38 -12.610   7.635   2.993
  259   HG11  VAL  38          HG11      VAL  38 -15.501   7.648   3.786
  260   HG12  VAL  38          HG12      VAL  38 -14.419   6.273   3.571
  261   HG13  VAL  38          HG13      VAL  38 -14.983   7.180   2.168
  262   HG21  VAL  38          HG21      VAL  38 -14.640   9.804   2.545
  263   HG22  VAL  38          HG22      VAL  38 -13.510   9.098   1.389
  264   HG23  VAL  38          HG23      VAL  38 -12.914  10.140   2.681
  265    H    MET  39           H        MET  39 -14.179  10.901   4.153
  266    HA   MET  39           HA       MET  39 -15.811  11.497   6.313
  267    HB2  MET  39           HB2      MET  39 -16.401  12.394   3.498
  268    HB3  MET  39           HB3      MET  39 -16.730  13.249   4.999
  269    HG2  MET  39           HG2      MET  39 -14.075  13.042   5.200
  270    HG3  MET  39           HG3      MET  39 -14.231  13.028   3.445
  271    HE1  MET  39           HE1      MET  39 -12.775  15.536   3.366
  272    HE2  MET  39           HE2      MET  39 -14.033  16.577   2.700
  273    HE3  MET  39           HE3      MET  39 -13.935  14.887   2.206
  274    H    LYS  40           H        LYS  40 -16.407   9.398   3.622
  275    HA   LYS  40           HA       LYS  40 -19.261   9.348   3.923
  276    HB2  LYS  40           HB2      LYS  40 -17.265   7.777   2.333
  277    HB3  LYS  40           HB3      LYS  40 -18.909   7.177   2.497
  278    HG2  LYS  40           HG2      LYS  40 -19.146   8.368   0.584
  279    HG3  LYS  40           HG3      LYS  40 -19.496   9.646   1.750
  280    HD2  LYS  40           HD2      LYS  40 -17.966  10.548   0.169
  281    HD3  LYS  40           HD3      LYS  40 -17.058  10.256   1.654
  282    HE2  LYS  40           HE2      LYS  40 -15.599   9.290   0.223
  283    HE3  LYS  40           HE3      LYS  40 -16.671   7.905   0.429
  284    HZ1  LYS  40           HZ1      LYS  40 -16.292   8.215  -1.883
  285    HZ2  LYS  40           HZ2      LYS  40 -16.680   9.859  -1.803
  286    HZ3  LYS  40           HZ3      LYS  40 -17.885   8.695  -1.572
  287    H    MET  41           H        MET  41 -17.050   6.580   4.140
  288    HA   MET  41           HA       MET  41 -18.003   5.915   6.794
  289    HB2  MET  41           HB2      MET  41 -19.450   4.908   4.725
  290    HB3  MET  41           HB3      MET  41 -18.244   3.644   4.924
  291    HG2  MET  41           HG2      MET  41 -19.037   3.007   6.949
  292    HG3  MET  41           HG3      MET  41 -19.587   4.628   7.368
  293    HE1  MET  41           HE1      MET  41 -21.850   1.269   5.357
  294    HE2  MET  41           HE2      MET  41 -20.151   1.333   5.824
  295    HE3  MET  41           HE3      MET  41 -20.670   2.027   4.288
  296    H    ILE  42           H        ILE  42 -17.068   3.466   7.188
  297    HA   ILE  42           HA       ILE  42 -14.207   3.817   6.965
  298    HB   ILE  42           HB       ILE  42 -15.151   3.006   9.066
  299   HG12  ILE  42          HG12      ILE  42 -13.673   1.073   9.413
  300   HG13  ILE  42          HG13      ILE  42 -13.512   0.875   7.671
  301   HG21  ILE  42          HG21      ILE  42 -17.073   1.821   8.462
  302   HG22  ILE  42          HG22      ILE  42 -15.978   0.587   9.084
  303   HG23  ILE  42          HG23      ILE  42 -16.190   0.781   7.344
  304   HD11  ILE  42          HD11      ILE  42 -12.812   3.546   8.345
  305   HD12  ILE  42          HD12      ILE  42 -11.803   2.270   7.663
  306   HD13  ILE  42          HD13      ILE  42 -11.946   2.441   9.412
  307    H    MET  43           H        MET  43 -12.764   2.414   5.939
  308    HA   MET  43           HA       MET  43 -13.855   0.289   4.266
  309    HB2  MET  43           HB2      MET  43 -12.541   2.779   3.247
  310    HB3  MET  43           HB3      MET  43 -12.326   1.268   2.375
  311    HG2  MET  43           HG2      MET  43 -15.070   2.181   3.104
  312    HG3  MET  43           HG3      MET  43 -14.240   2.895   1.722
  313    HE1  MET  43           HE1      MET  43 -15.660   0.714  -0.878
  314    HE2  MET  43           HE2      MET  43 -14.361   1.881  -0.629
  315    HE3  MET  43           HE3      MET  43 -15.971   2.203   0.015
  316    H    THR  44           H        THR  44 -12.130  -1.031   3.256
  317    HA   THR  44           HA       THR  44  -9.679  -1.013   4.894
  318    HB   THR  44           HB       THR  44 -10.425  -3.597   3.723
  319    HG1  THR  44           HG1      THR  44 -12.504  -2.842   4.250
  320   HG21  THR  44          HG21      THR  44  -9.207  -4.334   5.405
  321   HG22  THR  44          HG22      THR  44 -10.304  -3.594   6.571
  322   HG23  THR  44          HG23      THR  44  -8.951  -2.668   5.920
  323    H    LEU  45           H        LEU  45  -7.775  -1.062   3.851
  324    HA   LEU  45           HA       LEU  45  -7.833  -1.021   0.935
  325    HB2  LEU  45           HB2      LEU  45  -5.557  -0.457   2.838
  326    HB3  LEU  45           HB3      LEU  45  -5.531  -0.206   1.102
  327    HG   LEU  45           HG       LEU  45  -7.644   1.328   1.708
  328   HD11  LEU  45          HD11      LEU  45  -6.159   0.929   4.230
  329   HD12  LEU  45          HD12      LEU  45  -7.854   1.336   3.958
  330   HD13  LEU  45          HD13      LEU  45  -6.616   2.586   3.834
  331   HD21  LEU  45          HD21      LEU  45  -4.715   1.896   1.629
  332   HD22  LEU  45          HD22      LEU  45  -5.845   3.199   2.000
  333   HD23  LEU  45          HD23      LEU  45  -5.977   2.325   0.474
  334    H    ASN  46           H        ASN  46  -7.046  -2.601  -0.329
  335    HA   ASN  46           HA       ASN  46  -5.492  -4.752   0.942
  336    HB2  ASN  46           HB2      ASN  46  -6.721  -6.396  -0.441
  337    HB3  ASN  46           HB3      ASN  46  -7.777  -5.550   0.687
  338   HD21  ASN  46          HD21      ASN  46  -9.004  -3.725  -0.176
  339   HD22  ASN  46          HD22      ASN  46  -9.553  -3.796  -1.813
  340    H    VAL  47           H        VAL  47  -4.502  -6.217  -0.799
  341    HA   VAL  47           HA       VAL  47  -3.145  -4.473  -2.709
  342    HB   VAL  47           HB       VAL  47  -1.583  -6.368  -3.010
  343   HG11  VAL  47          HG11      VAL  47  -1.862  -5.926  -0.065
  344   HG12  VAL  47          HG12      VAL  47  -1.471  -4.580  -1.136
  345   HG13  VAL  47          HG13      VAL  47  -0.404  -5.982  -1.055
  346   HG21  VAL  47          HG21      VAL  47  -3.584  -7.962  -2.169
  347   HG22  VAL  47          HG22      VAL  47  -2.657  -7.816  -0.676
  348   HG23  VAL  47          HG23      VAL  47  -1.884  -8.430  -2.138
  349    H    GLN  48           H        GLN  48  -2.844  -5.089  -4.914
  350    HA   GLN  48           HA       GLN  48  -5.201  -6.345  -6.036
  351    HB2  GLN  48           HB2      GLN  48  -4.501  -5.467  -8.139
  352    HB3  GLN  48           HB3      GLN  48  -4.225  -4.214  -6.940
  353    HG2  GLN  48           HG2      GLN  48  -2.011  -6.060  -7.730
  354    HG3  GLN  48           HG3      GLN  48  -2.433  -4.680  -8.741
  355   HE21  GLN  48          HE21      GLN  48  -0.748  -5.749  -6.015
  356   HE22  GLN  48          HE22      GLN  48  -0.244  -4.208  -5.418
  357    H    GLU  49           H        GLU  49  -1.989  -7.241  -5.277
  358    HA   GLU  49           HA       GLU  49  -2.433  -9.877  -6.382
  359    HB2  GLU  49           HB2      GLU  49  -0.260  -8.049  -7.377
  360    HB3  GLU  49           HB3      GLU  49  -0.094  -9.798  -7.455
  361    HG2  GLU  49           HG2      GLU  49  -2.285  -8.181  -8.737
  362    HG3  GLU  49           HG3      GLU  49  -0.886  -8.866  -9.562
  363    H    ARG  50           H        ARG  50  -0.382 -11.270  -5.907
  364    HA   ARG  50           HA       ARG  50   0.027 -11.187  -3.102
  365    HB2  ARG  50           HB2      ARG  50   1.198 -12.852  -5.318
  366    HB3  ARG  50           HB3      ARG  50   1.739 -13.026  -3.655
  367    HG2  ARG  50           HG2      ARG  50   0.136 -14.671  -3.836
  368    HG3  ARG  50           HG3      ARG  50  -0.772 -13.337  -3.121
  369    HD2  ARG  50           HD2      ARG  50  -2.033 -14.392  -4.922
  370    HD3  ARG  50           HD3      ARG  50  -1.623 -12.726  -5.326
  371    HE   ARG  50           HE       ARG  50   0.360 -14.417  -6.358
  372   HH11  ARG  50          HH11      ARG  50  -3.006 -13.643  -6.861
  373   HH12  ARG  50          HH12      ARG  50  -2.976 -14.045  -8.545
  374   HH21  ARG  50          HH21      ARG  50   0.401 -14.946  -8.573
  375   HH22  ARG  50          HH22      ARG  50  -1.042 -14.785  -9.517
  376    H    GLY  51           H        GLY  51   1.795 -10.613  -1.894
  377    HA2  GLY  51           HA2      GLY  51   4.371 -10.158  -2.542
  378    HA3  GLY  51           HA3      GLY  51   3.586  -8.697  -3.121
  379    H    ARG  52           H        ARG  52   5.436  -8.256  -1.314
  380    HA   ARG  52           HA       ARG  52   4.208  -8.205   1.336
  381    HB2  ARG  52           HB2      ARG  52   6.968  -7.955   0.278
  382    HB3  ARG  52           HB3      ARG  52   6.599  -7.034   1.730
  383    HG2  ARG  52           HG2      ARG  52   7.317  -8.965   2.682
  384    HG3  ARG  52           HG3      ARG  52   5.603  -9.350   2.517
  385    HD2  ARG  52           HD2      ARG  52   6.971 -11.208   1.756
  386    HD3  ARG  52           HD3      ARG  52   6.073 -10.508   0.409
  387    HE   ARG  52           HE       ARG  52   8.058  -9.890  -0.556
  388   HH11  ARG  52          HH11      ARG  52   8.637 -10.779   2.769
  389   HH12  ARG  52          HH12      ARG  52  10.361 -10.734   2.611
  390   HH21  ARG  52          HH21      ARG  52  10.325  -9.830  -0.765
  391   HH22  ARG  52          HH22      ARG  52  11.319 -10.195   0.606
  392    H    VAL  53           H        VAL  53   3.120  -6.493   2.014
  393    HA   VAL  53           HA       VAL  53   3.151  -4.036   0.500
  394    HB   VAL  53           HB       VAL  53   1.669  -4.639   3.062
  395   HG11  VAL  53          HG11      VAL  53   1.751  -2.288   2.681
  396   HG12  VAL  53          HG12      VAL  53   0.146  -2.843   2.205
  397   HG13  VAL  53          HG13      VAL  53   1.360  -2.491   0.974
  398   HG21  VAL  53          HG21      VAL  53  -0.087  -5.517   1.863
  399   HG22  VAL  53          HG22      VAL  53   1.288  -6.122   0.939
  400   HG23  VAL  53          HG23      VAL  53   0.393  -4.714   0.368
  401    H    LYS  54           H        LYS  54   4.337  -2.298   0.917
  402    HA   LYS  54           HA       LYS  54   5.632  -2.086   3.557
  403    HB2  LYS  54           HB2      LYS  54   6.608  -1.513   0.792
  404    HB3  LYS  54           HB3      LYS  54   7.228  -0.541   2.119
  405    HG2  LYS  54           HG2      LYS  54   8.020  -2.543   3.244
  406    HG3  LYS  54           HG3      LYS  54   7.354  -3.545   1.953
  407    HD2  LYS  54           HD2      LYS  54   8.962  -2.895   0.436
  408    HD3  LYS  54           HD3      LYS  54   9.275  -1.368   1.264
  409    HE2  LYS  54           HE2      LYS  54  11.164  -2.813   1.581
  410    HE3  LYS  54           HE3      LYS  54  10.315  -2.650   3.118
  411    HZ1  LYS  54           HZ1      LYS  54  11.066  -4.971   2.322
  412    HZ2  LYS  54           HZ2      LYS  54   9.695  -4.907   1.333
  413    HZ3  LYS  54           HZ3      LYS  54   9.532  -4.797   3.013
  414    H    TYR  55           H        TYR  55   4.580  -0.632   4.739
  415    HA   TYR  55           HA       TYR  55   2.877   1.357   3.795
  416    HB2  TYR  55           HB2      TYR  55   4.246   0.833   6.394
  417    HB3  TYR  55           HB3      TYR  55   3.468   2.395   6.159
  418    HD1  TYR  55           HD2      TYR  55   2.426  -0.992   5.004
  419    HD2  TYR  55           HD1      TYR  55   1.560   2.352   7.488
  420    HE1  TYR  55           HE2      TYR  55   0.255  -1.992   5.583
  421    HE2  TYR  55           HE1      TYR  55  -0.613   1.361   8.074
  422    HH   TYR  55           HH       TYR  55  -1.403  -1.857   7.418
  423    H    ILE  56           H        ILE  56   3.110   3.428   3.179
  424    HA   ILE  56           HA       ILE  56   5.851   4.471   2.982
  425    HB   ILE  56           HB       ILE  56   3.424   4.778   1.277
  426   HG12  ILE  56          HG12      ILE  56   4.990   4.465  -0.521
  427   HG13  ILE  56          HG13      ILE  56   6.359   4.716   0.558
  428   HG21  ILE  56          HG21      ILE  56   4.584   6.774   0.181
  429   HG22  ILE  56          HG22      ILE  56   5.475   6.930   1.695
  430   HG23  ILE  56          HG23      ILE  56   3.716   7.065   1.688
  431   HD11  ILE  56          HD11      ILE  56   4.451   2.392   0.612
  432   HD12  ILE  56          HD12      ILE  56   5.786   2.646   1.735
  433   HD13  ILE  56          HD13      ILE  56   6.113   2.377   0.023
  434    H    LYS  57           H        LYS  57   2.546   5.732   3.370
  435    HA   LYS  57           HA       LYS  57   3.423   8.144   4.606
  436    HB2  LYS  57           HB2      LYS  57   0.971   7.020   3.630
  437    HB3  LYS  57           HB3      LYS  57   0.704   7.688   5.235
  438    HG2  LYS  57           HG2      LYS  57   1.854   9.152   2.867
  439    HG3  LYS  57           HG3      LYS  57   0.227   9.335   3.524
  440    HD2  LYS  57           HD2      LYS  57   1.248  10.064   5.676
  441    HD3  LYS  57           HD3      LYS  57   2.827  10.021   4.890
  442    HE2  LYS  57           HE2      LYS  57   1.813  12.287   4.972
  443    HE3  LYS  57           HE3      LYS  57   2.169  11.726   3.338
  444    HZ1  LYS  57           HZ1      LYS  57  -0.509  11.534   4.602
  445    HZ2  LYS  57           HZ2      LYS  57  -0.119  11.229   2.985
  446    HZ3  LYS  57           HZ3      LYS  57  -0.033  12.805   3.591
  447    H    ARG  58           H        ARG  58   2.504   8.810   6.788
  448    HA   ARG  58           HA       ARG  58   3.239   6.757   8.725
  449    HB2  ARG  58           HB2      ARG  58   3.204   9.708   8.676
  450    HB3  ARG  58           HB3      ARG  58   2.776   8.980  10.218
  451    HG2  ARG  58           HG2      ARG  58   5.004   7.561   9.495
  452    HG3  ARG  58           HG3      ARG  58   5.362   9.180   8.891
  453    HD2  ARG  58           HD2      ARG  58   4.413   8.615  11.693
  454    HD3  ARG  58           HD3      ARG  58   6.115   8.718  11.244
  455    HE   ARG  58           HE       ARG  58   5.099  11.048  10.327
  456   HH11  ARG  58          HH11      ARG  58   4.963   9.449  13.426
  457   HH12  ARG  58          HH12      ARG  58   4.868  10.926  14.324
  458   HH21  ARG  58          HH21      ARG  58   4.973  12.991  11.507
  459   HH22  ARG  58          HH22      ARG  58   4.873  12.937  13.235
  460    HA   PRO  59           HA       PRO  59  -0.803   5.978  10.289
  461    HB2  PRO  59           HB2      PRO  59  -0.509   6.128  12.993
  462    HB3  PRO  59           HB3      PRO  59   0.106   4.783  12.026
  463    HG2  PRO  59           HG2      PRO  59   1.562   7.174  13.087
  464    HG3  PRO  59           HG3      PRO  59   2.073   5.476  13.054
  465    HD2  PRO  59           HD2      PRO  59   2.961   7.283  11.255
  466    HD3  PRO  59           HD3      PRO  59   2.701   5.578  10.834
  467    H    GLY  60           H        GLY  60  -2.616   7.145  10.443
  468    HA2  GLY  60           HA2      GLY  60  -4.051   8.775  11.353
  469    HA3  GLY  60           HA3      GLY  60  -2.654   9.591  12.037
  470    H    ALA  61           H        ALA  61  -1.320   9.339   9.307
  471    HA   ALA  61           HA       ALA  61  -1.822  11.908   8.378
  472    HB1  ALA  61           HB1      ALA  61   0.142  10.320   7.880
  473    HB2  ALA  61           HB2      ALA  61  -0.379  11.435   6.616
  474    HB3  ALA  61           HB3      ALA  61  -0.859   9.739   6.550
  475    H    VAL  62           H        VAL  62  -3.053  12.771   6.741
  476    HA   VAL  62           HA       VAL  62  -5.483  11.366   6.113
  477    HB   VAL  62           HB       VAL  62  -6.116  13.416   4.893
  478   HG11  VAL  62          HG11      VAL  62  -6.525  13.219   7.304
  479   HG12  VAL  62          HG12      VAL  62  -6.230  14.889   6.821
  480   HG13  VAL  62          HG13      VAL  62  -4.959  13.966   7.623
  481   HG21  VAL  62          HG21      VAL  62  -3.368  14.386   5.677
  482   HG22  VAL  62          HG22      VAL  62  -4.641  15.378   4.966
  483   HG23  VAL  62          HG23      VAL  62  -3.932  14.057   4.039
  484    H    LEU  63           H        LEU  63  -5.953  10.259   4.320
  485    HA   LEU  63           HA       LEU  63  -3.910   9.928   2.301
  486    HB2  LEU  63           HB2      LEU  63  -6.644   8.696   2.210
  487    HB3  LEU  63           HB3      LEU  63  -5.146   8.086   1.535
  488    HG   LEU  63           HG       LEU  63  -5.842   8.205   4.470
  489   HD11  LEU  63          HD11      LEU  63  -5.963   5.807   4.357
  490   HD12  LEU  63          HD12      LEU  63  -5.507   5.825   2.654
  491   HD13  LEU  63          HD13      LEU  63  -7.058   6.494   3.158
  492   HD21  LEU  63          HD21      LEU  63  -3.502   6.715   3.401
  493   HD22  LEU  63          HD22      LEU  63  -3.750   7.446   4.986
  494   HD23  LEU  63          HD23      LEU  63  -3.365   8.462   3.598
  495    H    GLU  64           H        GLU  64  -4.152  10.343   0.092
  496    HA   GLU  64           HA       GLU  64  -6.361  12.161  -0.612
  497    HB2  GLU  64           HB2      GLU  64  -3.582  12.366  -1.759
  498    HB3  GLU  64           HB3      GLU  64  -4.891  13.533  -1.876
  499    HG2  GLU  64           HG2      GLU  64  -3.432  12.801   0.653
  500    HG3  GLU  64           HG3      GLU  64  -3.137  14.240  -0.322
  501    H    ALA  65           H        ALA  65  -7.160  12.039  -2.726
  502    HA   ALA  65           HA       ALA  65  -7.232   9.479  -3.871
  503    HB1  ALA  65           HB1      ALA  65  -7.919  12.035  -5.305
  504    HB2  ALA  65           HB2      ALA  65  -8.966  11.292  -4.097
  505    HB3  ALA  65           HB3      ALA  65  -8.579  10.423  -5.582
  506    H    GLY  66           H        GLY  66  -5.250   8.661  -4.428
  507    HA2  GLY  66           HA2      GLY  66  -4.015   8.360  -6.557
  508    HA3  GLY  66           HA3      GLY  66  -3.821  10.106  -6.576
  509    H    CYS  67           H        CYS  67  -3.386   9.985  -3.568
  510    HA   CYS  67           HA       CYS  67  -0.567   9.959  -3.635
  511    HB2  CYS  67           HB2      CYS  67  -2.660  10.340  -1.593
  512    HB3  CYS  67           HB3      CYS  67  -1.125   9.737  -0.978
  513    HG   CYS  67           HG       CYS  67  -1.323  12.418  -2.547
  514    H    VAL  68           H        VAL  68   0.926   8.521  -2.734
  515    HA   VAL  68           HA       VAL  68   0.150   5.747  -2.905
  516    HB   VAL  68           HB       VAL  68   2.851   6.851  -2.134
  517   HG11  VAL  68          HG11      VAL  68   3.702   4.722  -2.868
  518   HG12  VAL  68          HG12      VAL  68   2.096   4.218  -3.394
  519   HG13  VAL  68          HG13      VAL  68   2.429   4.452  -1.678
  520   HG21  VAL  68          HG21      VAL  68   3.306   6.323  -4.636
  521   HG22  VAL  68          HG22      VAL  68   2.534   7.847  -4.199
  522   HG23  VAL  68          HG23      VAL  68   1.561   6.509  -4.810
  523    H    VAL  69           H        VAL  69  -0.902   4.914  -1.212
  524    HA   VAL  69           HA       VAL  69  -0.353   5.768   1.492
  525    HB   VAL  69           HB       VAL  69  -2.023   3.932   2.072
  526   HG11  VAL  69          HG11      VAL  69  -3.840   5.340   1.672
  527   HG12  VAL  69          HG12      VAL  69  -3.161   5.943   0.160
  528   HG13  VAL  69          HG13      VAL  69  -2.458   6.435   1.701
  529   HG21  VAL  69          HG21      VAL  69  -1.598   2.777  -0.182
  530   HG22  VAL  69          HG22      VAL  69  -2.697   3.983  -0.851
  531   HG23  VAL  69          HG23      VAL  69  -3.260   2.873   0.399
  532    H    ALA  70           H        ALA  70   0.661   3.221  -0.608
  533    HA   ALA  70           HA       ALA  70   2.583   2.296   1.288
  534    HB1  ALA  70           HB1      ALA  70   0.158   1.152   1.668
  535    HB2  ALA  70           HB2      ALA  70   1.695   0.377   2.054
  536    HB3  ALA  70           HB3      ALA  70   0.887   0.021   0.527
  537    H    ARG  71           H        ARG  71   3.126  -0.215   0.229
  538    HA   ARG  71           HA       ARG  71   3.429   0.176  -2.654
  539    HB2  ARG  71           HB2      ARG  71   5.645   0.005  -0.652
  540    HB3  ARG  71           HB3      ARG  71   5.880  -0.698  -2.247
  541    HG2  ARG  71           HG2      ARG  71   5.009   2.147  -1.826
  542    HG3  ARG  71           HG3      ARG  71   6.701   1.659  -1.944
  543    HD2  ARG  71           HD2      ARG  71   5.100   0.552  -4.091
  544    HD3  ARG  71           HD3      ARG  71   5.007   2.311  -4.044
  545    HE   ARG  71           HE       ARG  71   7.288   0.711  -4.751
  546   HH11  ARG  71          HH11      ARG  71   6.231   3.815  -3.558
  547   HH12  ARG  71          HH12      ARG  71   7.656   4.644  -4.087
  548   HH21  ARG  71          HH21      ARG  71   9.163   1.799  -5.448
  549   HH22  ARG  71          HH22      ARG  71   9.321   3.500  -5.161
  550    H    LEU  72           H        LEU  72   4.765  -1.887  -3.487
  551    HA   LEU  72           HA       LEU  72   3.875  -4.288  -2.082
  552    HB2  LEU  72           HB2      LEU  72   2.646  -3.228  -4.446
  553    HB3  LEU  72           HB3      LEU  72   3.405  -4.761  -4.827
  554    HG   LEU  72           HG       LEU  72   1.066  -5.062  -4.212
  555   HD11  LEU  72          HD11      LEU  72   2.780  -6.789  -3.664
  556   HD12  LEU  72          HD12      LEU  72   1.347  -6.834  -2.637
  557   HD13  LEU  72          HD13      LEU  72   2.845  -6.129  -2.030
  558   HD21  LEU  72          HD21      LEU  72   1.395  -3.033  -2.479
  559   HD22  LEU  72          HD22      LEU  72   1.519  -4.403  -1.375
  560   HD23  LEU  72          HD23      LEU  72   0.080  -4.202  -2.374
  561    H    GLU  73           H        GLU  73   5.482  -5.695  -1.978
  562    HA   GLU  73           HA       GLU  73   7.807  -5.356  -3.692
  563    HB2  GLU  73           HB2      GLU  73   7.270  -6.516  -1.059
  564    HB3  GLU  73           HB3      GLU  73   8.352  -7.495  -2.039
  565    HG2  GLU  73           HG2      GLU  73   9.516  -5.154  -2.437
  566    HG3  GLU  73           HG3      GLU  73   8.746  -4.790  -0.893
  567    H    LEU  74           H        LEU  74   6.666  -6.087  -5.627
  568    HA   LEU  74           HA       LEU  74   5.604  -8.680  -5.896
  569    HB2  LEU  74           HB2      LEU  74   6.458  -6.517  -7.720
  570    HB3  LEU  74           HB3      LEU  74   6.424  -8.128  -8.411
  571    HG   LEU  74           HG       LEU  74   4.335  -6.818  -8.771
  572   HD11  LEU  74          HD11      LEU  74   2.802  -8.656  -7.968
  573   HD12  LEU  74          HD12      LEU  74   4.222  -9.396  -7.230
  574   HD13  LEU  74          HD13      LEU  74   4.157  -9.163  -8.977
  575   HD21  LEU  74          HD21      LEU  74   4.569  -5.919  -6.292
  576   HD22  LEU  74          HD22      LEU  74   3.545  -7.313  -5.952
  577   HD23  LEU  74          HD23      LEU  74   2.999  -6.073  -7.081
  578    H    ASP  75           H        ASP  75   8.855  -7.501  -5.868
  579    HA   ASP  75           HA       ASP  75  10.882  -8.459  -6.338
  580    HB2  ASP  75           HB2      ASP  75   9.609 -10.883  -5.066
  581    HB3  ASP  75           HB3      ASP  75  11.305 -10.413  -5.030
  582    H    ASP  76           H        ASP  76   9.648  -8.466  -8.667
  583    HA   ASP  76           HA       ASP  76   9.338 -11.089  -9.794
  584    HB2  ASP  76           HB2      ASP  76   9.178  -9.812 -11.963
  585    HB3  ASP  76           HB3      ASP  76   8.006  -9.339 -10.736
  586    H    LEU  77           H        LEU  77  10.558 -11.454 -11.988
  587    HA   LEU  77           HA       LEU  77  13.372 -11.551 -11.303
  588    HB2  LEU  77           HB2      LEU  77  11.751 -12.714 -13.558
  589    HB3  LEU  77           HB3      LEU  77  13.498 -12.843 -13.493
  590    HG   LEU  77           HG       LEU  77  11.634 -13.908 -11.371
  591   HD11  LEU  77          HD11      LEU  77  12.132 -16.110 -12.279
  592   HD12  LEU  77          HD12      LEU  77  13.086 -15.376 -13.568
  593   HD13  LEU  77          HD13      LEU  77  11.347 -15.095 -13.490
  594   HD21  LEU  77          HD21      LEU  77  14.595 -14.264 -11.822
  595   HD22  LEU  77          HD22      LEU  77  13.638 -15.105 -10.603
  596   HD23  LEU  77          HD23      LEU  77  13.836 -13.355 -10.515
  597    H    GLU  78           H        GLU  78  11.262  -9.858 -13.504
  598    HA   GLU  78           HA       GLU  78  13.339  -8.848 -15.190
  599    HB2  GLU  78           HB2      GLU  78  10.841  -9.097 -15.740
  600    HB3  GLU  78           HB3      GLU  78  10.622  -7.600 -14.845
  601    HG2  GLU  78           HG2      GLU  78  12.445  -6.669 -16.420
  602    HG3  GLU  78           HG3      GLU  78  12.056  -8.065 -17.424
  603    H    HIS  79           H        HIS  79  14.670  -8.214 -13.241
  604    HA   HIS  79           HA       HIS  79  14.403  -5.358 -12.864
  605    HB2  HIS  79           HB2      HIS  79  13.096  -6.629 -11.002
  606    HB3  HIS  79           HB3      HIS  79  14.696  -6.994 -10.363
  607    HD1  HIS  79           HD1      HIS  79  15.601  -5.313  -8.791
  608    HD2  HIS  79           HD2      HIS  79  12.727  -3.684 -11.311
  609    HE1  HIS  79           HE1      HIS  79  15.288  -2.943  -8.010
  610    HE2  HIS  79           HE2      HIS  79  13.481  -2.005  -9.495
  611    H    HIS  80           H        HIS  80  16.335  -4.350 -12.307
  612    HA   HIS  80           HA       HIS  80  18.685  -6.092 -12.016
  613    HB2  HIS  80           HB2      HIS  80  18.473  -5.311 -14.372
  614    HB3  HIS  80           HB3      HIS  80  18.560  -3.650 -13.797
  615    HD1  HIS  80           HD1      HIS  80  20.855  -2.713 -13.265
  616    HD2  HIS  80           HD2      HIS  80  20.914  -6.772 -14.149
  617    HE1  HIS  80           HE1      HIS  80  23.285  -3.313 -13.504
  618    HE2  HIS  80           HE2      HIS  80  23.292  -5.755 -14.124
  619    H    HIS  81           H        HIS  81  19.245  -5.669  -9.960
  620    HA   HIS  81           HA       HIS  81  19.963  -2.908  -9.308
  621    HB2  HIS  81           HB2      HIS  81  17.688  -3.356  -8.378
  622    HB3  HIS  81           HB3      HIS  81  18.377  -4.666  -7.425
  623    HD1  HIS  81           HD1      HIS  81  19.382  -1.020  -7.927
  624    HD2  HIS  81           HD2      HIS  81  18.693  -3.782  -4.901
  625    HE1  HIS  81           HE1      HIS  81  19.845   0.206  -5.781
  626    HE2  HIS  81           HE2      HIS  81  19.337  -1.460  -3.960
  627    H    HIS  82           H        HIS  82  21.627  -2.701  -7.788
  628    HA   HIS  82           HA       HIS  82  23.153  -5.174  -7.356
  629    HB2  HIS  82           HB2      HIS  82  24.173  -3.227  -8.641
  630    HB3  HIS  82           HB3      HIS  82  24.199  -2.353  -7.113
  631    HD1  HIS  82           HD1      HIS  82  25.099  -5.999  -7.572
  632    HD2  HIS  82           HD2      HIS  82  26.897  -2.368  -6.649
  633    HE1  HIS  82           HE1      HIS  82  27.457  -6.566  -6.907
  634    HE2  HIS  82           HE2      HIS  82  28.499  -4.363  -6.269
  635    H    HIS  83           H        HIS  83  22.463  -5.985  -5.444
  636    HA   HIS  83           HA       HIS  83  23.325  -4.745  -3.046
  637    HB2  HIS  83           HB2      HIS  83  21.280  -3.403  -3.444
  638    HB3  HIS  83           HB3      HIS  83  20.328  -4.883  -3.442
  639    HD1  HIS  83           HD1      HIS  83  22.968  -3.606  -1.008
  640    HD2  HIS  83           HD2      HIS  83  19.028  -4.924  -1.077
  641    HE1  HIS  83           HE1      HIS  83  22.217  -3.605   1.392
  642    HE2  HIS  83           HE2      HIS  83  19.859  -4.489   1.334
  643    H    HIS  84           H        HIS  84  23.941  -6.381  -1.810
  644    HA   HIS  84           HA       HIS  84  23.146  -9.064  -2.359
  645    HB2  HIS  84           HB2      HIS  84  24.588  -9.655  -0.456
  646    HB3  HIS  84           HB3      HIS  84  25.398  -8.545  -1.556
  647    HD1  HIS  84           HD1      HIS  84  26.449  -6.568  -0.494
  648    HD2  HIS  84           HD2      HIS  84  23.486  -8.227   1.901
  649    HE1  HIS  84           HE1      HIS  84  26.526  -5.276   1.662
  650    HE2  HIS  84           HE2      HIS  84  24.782  -6.354   3.127
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1   5.694  10.327 -15.119
    2    H2   MET   1           H2       MET   1   5.811   9.177 -16.384
    3    H3   MET   1           H3       MET   1   4.583  10.376 -16.426
    4    HA   MET   1           HA       MET   1   3.592   9.457 -14.470
    5    HB2  MET   1           HB2      MET   1   3.092   8.732 -16.867
    6    HB3  MET   1           HB3      MET   1   4.057   7.301 -16.530
    7    HG2  MET   1           HG2      MET   1   2.029   6.461 -16.014
    8    HG3  MET   1           HG3      MET   1   2.418   7.165 -14.446
    9    HE1  MET   1           HE1      MET   1  -0.584   6.825 -14.373
   10    HE2  MET   1           HE2      MET   1  -0.994   8.483 -13.935
   11    HE3  MET   1           HE3      MET   1   0.476   7.743 -13.303
   12    H    GLU   2           H        GLU   2   5.248   9.346 -12.798
   13    HA   GLU   2           HA       GLU   2   6.841   6.937 -12.621
   14    HB2  GLU   2           HB2      GLU   2   6.466   9.258 -10.722
   15    HB3  GLU   2           HB3      GLU   2   7.548   7.905 -10.420
   16    HG2  GLU   2           HG2      GLU   2   9.029   8.545 -12.062
   17    HG3  GLU   2           HG3      GLU   2   7.815   9.473 -12.942
   18    H    ASN   3           H        ASN   3   5.009   5.458 -12.652
   19    HA   ASN   3           HA       ASN   3   4.045   4.955  -9.942
   20    HB2  ASN   3           HB2      ASN   3   2.251   6.227 -11.071
   21    HB3  ASN   3           HB3      ASN   3   2.209   5.015 -12.347
   22   HD21  ASN   3          HD21      ASN   3   2.403   4.794  -8.813
   23   HD22  ASN   3          HD22      ASN   3   1.010   3.788  -8.630
   24    H    ASP   4           H        ASP   4   5.248   3.123  -9.721
   25    HA   ASP   4           HA       ASP   4   5.326   1.115 -11.791
   26    HB2  ASP   4           HB2      ASP   4   6.626   1.540  -9.159
   27    HB3  ASP   4           HB3      ASP   4   6.428  -0.134  -9.671
   28    HA   PRO   5           HA       PRO   5   1.974  -1.426 -10.492
   29    HB2  PRO   5           HB2      PRO   5   2.948  -3.939 -10.809
   30    HB3  PRO   5           HB3      PRO   5   2.534  -2.892 -12.171
   31    HG2  PRO   5           HG2      PRO   5   5.214  -3.454 -10.961
   32    HG3  PRO   5           HG3      PRO   5   4.758  -3.353 -12.672
   33    HD2  PRO   5           HD2      PRO   5   5.977  -1.318 -11.367
   34    HD3  PRO   5           HD3      PRO   5   4.814  -1.048 -12.681
   35    H    THR   6           H        THR   6   5.060  -1.886  -8.923
   36    HA   THR   6           HA       THR   6   3.911  -3.452  -6.765
   37    HB   THR   6           HB       THR   6   6.162  -3.586  -5.894
   38    HG1  THR   6           HG1      THR   6   7.269  -1.820  -6.177
   39   HG21  THR   6          HG21      THR   6   6.238  -3.834  -8.891
   40   HG22  THR   6          HG22      THR   6   5.720  -5.081  -7.756
   41   HG23  THR   6          HG23      THR   6   7.398  -4.535  -7.762
   42    H    VAL   7           H        VAL   7   3.729  -0.294  -7.481
   43    HA   VAL   7           HA       VAL   7   4.291   0.727  -4.806
   44    HB   VAL   7           HB       VAL   7   3.239   2.267  -7.178
   45   HG11  VAL   7          HG11      VAL   7   4.738   3.235  -4.750
   46   HG12  VAL   7          HG12      VAL   7   2.981   3.266  -4.905
   47   HG13  VAL   7          HG13      VAL   7   3.980   4.215  -6.006
   48   HG21  VAL   7          HG21      VAL   7   6.116   2.074  -6.312
   49   HG22  VAL   7          HG22      VAL   7   5.467   2.855  -7.753
   50   HG23  VAL   7          HG23      VAL   7   5.427   1.098  -7.609
   51    H    LEU   8           H        LEU   8   2.774   0.946  -3.299
   52    HA   LEU   8           HA       LEU   8  -0.002   0.425  -3.987
   53    HB2  LEU   8           HB2      LEU   8   1.524  -0.303  -1.856
   54    HB3  LEU   8           HB3      LEU   8   0.679   1.086  -1.199
   55    HG   LEU   8           HG       LEU   8  -0.650  -1.328  -2.427
   56   HD11  LEU   8          HD11      LEU   8  -0.656  -0.545   0.469
   57   HD12  LEU   8          HD12      LEU   8   0.553  -1.635  -0.208
   58   HD13  LEU   8          HD13      LEU   8  -1.155  -2.071  -0.263
   59   HD21  LEU   8          HD21      LEU   8  -2.232   0.283  -2.735
   60   HD22  LEU   8          HD22      LEU   8  -1.639   1.277  -1.404
   61   HD23  LEU   8          HD23      LEU   8  -2.598  -0.165  -1.069
   62    H    ARG   9           H        ARG   9  -1.667   1.861  -3.813
   63    HA   ARG   9           HA       ARG   9  -1.206   4.502  -2.695
   64    HB2  ARG   9           HB2      ARG   9  -1.698   3.994  -5.617
   65    HB3  ARG   9           HB3      ARG   9  -2.200   5.502  -4.865
   66    HG2  ARG   9           HG2      ARG   9   0.040   6.067  -4.308
   67    HG3  ARG   9           HG3      ARG   9   0.619   4.462  -4.759
   68    HD2  ARG   9           HD2      ARG   9  -0.089   4.914  -7.090
   69    HD3  ARG   9           HD3      ARG   9  -0.531   6.550  -6.605
   70    HE   ARG   9           HE       ARG   9   2.187   5.851  -5.983
   71   HH11  ARG   9          HH11      ARG   9   0.044   7.112  -8.431
   72   HH12  ARG   9          HH12      ARG   9   1.299   7.958  -9.272
   73   HH21  ARG   9          HH21      ARG   9   3.840   6.963  -7.087
   74   HH22  ARG   9          HH22      ARG   9   3.455   7.873  -8.509
   75    H    SER  10           H        SER  10  -3.053   5.488  -1.985
   76    HA   SER  10           HA       SER  10  -5.339   3.857  -1.593
   77    HB2  SER  10           HB2      SER  10  -4.860   5.442   0.109
   78    HB3  SER  10           HB3      SER  10  -4.776   6.771  -1.047
   79    HG   SER  10           HG       SER  10  -6.751   6.875  -0.031
   80    HA   PRO  11           HA       PRO  11  -7.689   4.835  -5.206
   81    HB2  PRO  11           HB2      PRO  11 -10.178   4.268  -4.348
   82    HB3  PRO  11           HB3      PRO  11  -8.969   3.007  -4.617
   83    HG2  PRO  11           HG2      PRO  11  -9.829   4.291  -2.053
   84    HG3  PRO  11           HG3      PRO  11  -9.517   2.580  -2.397
   85    HD2  PRO  11           HD2      PRO  11  -7.717   4.212  -1.157
   86    HD3  PRO  11           HD3      PRO  11  -7.247   2.817  -2.148
   87    H    SER  12           H        SER  12  -8.453   6.366  -2.152
   88    HA   SER  12           HA       SER  12  -9.147   8.814  -3.537
   89    HB2  SER  12           HB2      SER  12 -11.282   9.099  -2.316
   90    HB3  SER  12           HB3      SER  12 -11.323   7.713  -3.405
   91    HG   SER  12           HG       SER  12 -11.109   6.352  -1.674
   92    H    ALA  13           H        ALA  13  -9.707  10.560  -1.814
   93    HA   ALA  13           HA       ALA  13  -7.503  10.632   0.014
   94    HB1  ALA  13           HB1      ALA  13  -8.407  12.871   0.611
   95    HB2  ALA  13           HB2      ALA  13  -9.761  12.566  -0.477
   96    HB3  ALA  13           HB3      ALA  13  -8.119  12.655  -1.115
   97    H    GLY  14           H        GLY  14  -7.470  10.140   2.113
   98    HA2  GLY  14           HA2      GLY  14  -9.925  10.174   3.679
   99    HA3  GLY  14           HA3      GLY  14  -9.156   8.605   3.488
  100    H    LYS  15           H        LYS  15  -8.346   8.167   5.450
  101    HA   LYS  15           HA       LYS  15  -6.108   9.687   6.393
  102    HB2  LYS  15           HB2      LYS  15  -8.098  10.952   7.286
  103    HB3  LYS  15           HB3      LYS  15  -8.503   9.521   8.224
  104    HG2  LYS  15           HG2      LYS  15  -5.747  10.533   8.514
  105    HG3  LYS  15           HG3      LYS  15  -7.034  11.544   9.174
  106    HD2  LYS  15           HD2      LYS  15  -7.850   9.231  10.166
  107    HD3  LYS  15           HD3      LYS  15  -6.142   8.823   9.984
  108    HE2  LYS  15           HE2      LYS  15  -5.643  10.975  11.228
  109    HE3  LYS  15           HE3      LYS  15  -7.362  11.039  11.612
  110    HZ1  LYS  15           HZ1      LYS  15  -7.219   9.080  12.862
  111    HZ2  LYS  15           HZ2      LYS  15  -5.851   9.968  13.311
  112    HZ3  LYS  15           HZ3      LYS  15  -5.701   8.671  12.236
  113    H    LEU  16           H        LEU  16  -4.756   8.457   7.619
  114    HA   LEU  16           HA       LEU  16  -5.182   5.655   7.686
  115    HB2  LEU  16           HB2      LEU  16  -2.966   6.950   7.571
  116    HB3  LEU  16           HB3      LEU  16  -3.121   7.122   9.307
  117    HG   LEU  16           HG       LEU  16  -2.999   4.738   9.624
  118   HD11  LEU  16          HD11      LEU  16  -2.532   3.285   7.602
  119   HD12  LEU  16          HD12      LEU  16  -3.120   4.629   6.624
  120   HD13  LEU  16          HD13      LEU  16  -4.190   3.856   7.793
  121   HD21  LEU  16          HD21      LEU  16  -0.765   4.608   9.377
  122   HD22  LEU  16          HD22      LEU  16  -0.924   6.292   8.875
  123   HD23  LEU  16          HD23      LEU  16  -0.824   5.015   7.662
  124    H    THR  17           H        THR  17  -6.905   5.032   8.913
  125    HA   THR  17           HA       THR  17  -7.365   6.070  11.545
  126    HB   THR  17           HB       THR  17  -9.202   5.299  10.073
  127    HG1  THR  17           HG1      THR  17 -10.266   4.896  11.821
  128   HG21  THR  17          HG21      THR  17  -8.625   2.471  10.761
  129   HG22  THR  17          HG22      THR  17  -7.816   3.190   9.369
  130   HG23  THR  17          HG23      THR  17  -9.577   3.147   9.439
  131    H    GLN  18           H        GLN  18  -6.037   3.064  10.217
  132    HA   GLN  18           HA       GLN  18  -4.467   2.615  12.554
  133    HB2  GLN  18           HB2      GLN  18  -7.018   1.749  12.876
  134    HB3  GLN  18           HB3      GLN  18  -6.285   0.316  12.168
  135    HG2  GLN  18           HG2      GLN  18  -4.441   0.856  14.018
  136    HG3  GLN  18           HG3      GLN  18  -5.847   1.572  14.805
  137   HE21  GLN  18          HE21      GLN  18  -4.692  -0.469  16.055
  138   HE22  GLN  18          HE22      GLN  18  -5.642  -1.906  15.930
  139    H    TYR  19           H        TYR  19  -4.157  -0.199  12.263
  140    HA   TYR  19           HA       TYR  19  -3.463  -0.667   9.481
  141    HB2  TYR  19           HB2      TYR  19  -1.116  -1.221  10.015
  142    HB3  TYR  19           HB3      TYR  19  -1.478   0.476  10.313
  143    HD1  TYR  19           HD1      TYR  19  -0.676  -2.747  11.862
  144    HD2  TYR  19           HD2      TYR  19  -1.502   1.366  12.569
  145    HE1  TYR  19           HE1      TYR  19   0.170  -2.978  14.159
  146    HE2  TYR  19           HE2      TYR  19  -0.656   1.147  14.868
  147    HH   TYR  19           HH       TYR  19  -0.449  -1.243  16.532
  148    H    THR  20           H        THR  20  -3.404  -2.809   8.945
  149    HA   THR  20           HA       THR  20  -4.283  -4.661  11.027
  150    HB   THR  20           HB       THR  20  -5.120  -6.043   9.292
  151    HG1  THR  20           HG1      THR  20  -4.150  -6.175   7.453
  152   HG21  THR  20          HG21      THR  20  -6.322  -4.426   7.734
  153   HG22  THR  20          HG22      THR  20  -5.548  -3.147   8.671
  154   HG23  THR  20          HG23      THR  20  -6.637  -4.286   9.464
  155    H    VAL  21           H        VAL  21  -1.460  -3.859   9.303
  156    HA   VAL  21           HA       VAL  21  -0.107  -6.180  10.419
  157    HB   VAL  21           HB       VAL  21   1.041  -6.716   8.309
  158   HG11  VAL  21          HG11      VAL  21  -0.762  -7.946   7.289
  159   HG12  VAL  21          HG12      VAL  21  -1.957  -6.887   8.039
  160   HG13  VAL  21          HG13      VAL  21  -0.974  -7.956   9.040
  161   HG21  VAL  21          HG21      VAL  21   0.592  -4.412   7.319
  162   HG22  VAL  21          HG22      VAL  21  -1.004  -5.029   6.893
  163   HG23  VAL  21          HG23      VAL  21   0.441  -5.791   6.230
  164    H    GLU  22           H        GLU  22   2.088  -5.890  10.755
  165    HA   GLU  22           HA       GLU  22   2.956  -3.213  11.102
  166    HB2  GLU  22           HB2      GLU  22   5.077  -4.209  11.822
  167    HB3  GLU  22           HB3      GLU  22   3.707  -5.020  12.568
  168    HG2  GLU  22           HG2      GLU  22   4.419  -6.312  10.100
  169    HG3  GLU  22           HG3      GLU  22   5.820  -6.182  11.163
  170    H    ASP  23           H        ASP  23   5.411  -2.814  10.342
  171    HA   ASP  23           HA       ASP  23   5.277  -2.216   7.611
  172    HB2  ASP  23           HB2      ASP  23   7.657  -1.626   7.805
  173    HB3  ASP  23           HB3      ASP  23   6.729  -0.995   9.162
  174    H    GLY  24           H        GLY  24   5.866  -3.278   5.801
  175    HA2  GLY  24           HA2      GLY  24   6.652  -4.951   4.433
  176    HA3  GLY  24           HA3      GLY  24   7.736  -5.413   5.737
  177    H    GLY  25           H        GLY  25   4.279  -5.290   6.197
  178    HA2  GLY  25           HA2      GLY  25   4.184  -7.972   7.119
  179    HA3  GLY  25           HA3      GLY  25   2.798  -6.936   6.818
  180    H    HIS  26           H        HIS  26   4.402  -9.693   5.855
  181    HA   HIS  26           HA       HIS  26   3.960  -9.730   3.078
  182    HB2  HIS  26           HB2      HIS  26   4.091 -12.231   3.344
  183    HB3  HIS  26           HB3      HIS  26   5.449 -11.343   4.028
  184    HD1  HIS  26           HD1      HIS  26   5.756 -11.423   6.573
  185    HD2  HIS  26           HD2      HIS  26   2.416 -13.495   5.225
  186    HE1  HIS  26           HE1      HIS  26   4.969 -12.781   8.538
  187    HE2  HIS  26           HE2      HIS  26   2.900 -13.964   7.722
  188    H    VAL  27           H        VAL  27   2.119  -9.686   2.001
  189    HA   VAL  27           HA       VAL  27  -0.159 -11.235   2.958
  190    HB   VAL  27           HB       VAL  27  -1.746  -9.405   2.696
  191   HG11  VAL  27          HG11      VAL  27  -0.838  -9.814   4.910
  192   HG12  VAL  27          HG12      VAL  27  -1.128  -8.091   4.675
  193   HG13  VAL  27          HG13      VAL  27   0.513  -8.731   4.577
  194   HG21  VAL  27          HG21      VAL  27  -0.967  -7.871   1.193
  195   HG22  VAL  27          HG22      VAL  27   0.682  -7.935   1.814
  196   HG23  VAL  27          HG23      VAL  27  -0.557  -7.040   2.694
  197    H    GLU  28           H        GLU  28  -1.472 -11.992   1.347
  198    HA   GLU  28           HA       GLU  28  -0.457 -11.733  -1.355
  199    HB2  GLU  28           HB2      GLU  28  -1.911 -13.552  -1.911
  200    HB3  GLU  28           HB3      GLU  28  -1.152 -13.931  -0.371
  201    HG2  GLU  28           HG2      GLU  28  -3.553 -12.572   0.207
  202    HG3  GLU  28           HG3      GLU  28  -3.921 -13.775  -1.028
  203    H    ALA  29           H        ALA  29  -1.955 -11.356  -3.179
  204    HA   ALA  29           HA       ALA  29  -3.172  -8.901  -3.114
  205    HB1  ALA  29           HB1      ALA  29  -3.833  -9.285  -5.266
  206    HB2  ALA  29           HB2      ALA  29  -4.339 -10.942  -4.933
  207    HB3  ALA  29           HB3      ALA  29  -2.625 -10.558  -5.088
  208    H    GLY  30           H        GLY  30  -5.021  -8.087  -2.351
  209    HA2  GLY  30           HA2      GLY  30  -7.378  -8.150  -1.991
  210    HA3  GLY  30           HA3      GLY  30  -7.282  -9.900  -1.872
  211    H    SER  31           H        SER  31  -4.874  -9.599  -0.076
  212    HA   SER  31           HA       SER  31  -6.307  -9.639   2.386
  213    HB2  SER  31           HB2      SER  31  -4.444 -11.077   2.310
  214    HB3  SER  31           HB3      SER  31  -3.389  -9.820   1.665
  215    HG   SER  31           HG       SER  31  -3.394  -8.822   3.663
  216    H    SER  32           H        SER  32  -6.688  -8.057   3.799
  217    HA   SER  32           HA       SER  32  -6.136  -5.359   3.147
  218    HB2  SER  32           HB2      SER  32  -6.821  -5.984   5.958
  219    HB3  SER  32           HB3      SER  32  -7.570  -4.845   4.838
  220    HG   SER  32           HG       SER  32  -9.073  -6.324   4.778
  221    H    TYR  33           H        TYR  33  -4.562  -3.999   3.779
  222    HA   TYR  33           HA       TYR  33  -2.478  -5.086   5.554
  223    HB2  TYR  33           HB2      TYR  33  -0.844  -3.837   4.346
  224    HB3  TYR  33           HB3      TYR  33  -1.844  -4.650   3.148
  225    HD1  TYR  33           HD2      TYR  33  -1.262  -1.387   4.813
  226    HD2  TYR  33           HD1      TYR  33  -2.987  -3.416   1.496
  227    HE1  TYR  33           HE2      TYR  33  -1.690   0.774   3.722
  228    HE2  TYR  33           HE1      TYR  33  -3.421  -1.260   0.395
  229    HH   TYR  33           HH       TYR  33  -2.301   1.157   0.575
  230    H    ALA  34           H        ALA  34  -4.846  -2.682   5.231
  231    HA   ALA  34           HA       ALA  34  -4.291  -1.556   7.764
  232    HB1  ALA  34           HB1      ALA  34  -3.851   0.411   5.544
  233    HB2  ALA  34           HB2      ALA  34  -2.515  -0.502   6.246
  234    HB3  ALA  34           HB3      ALA  34  -3.477   0.574   7.260
  235    H    GLU  35           H        GLU  35  -5.529   0.851   7.640
  236    HA   GLU  35           HA       GLU  35  -8.026   0.526   6.176
  237    HB2  GLU  35           HB2      GLU  35  -8.122   1.009   9.146
  238    HB3  GLU  35           HB3      GLU  35  -9.442   0.577   8.069
  239    HG2  GLU  35           HG2      GLU  35  -8.114  -1.609   7.708
  240    HG3  GLU  35           HG3      GLU  35  -7.274  -1.147   9.187
  241    H    MET  36           H        MET  36  -9.434   2.467   6.403
  242    HA   MET  36           HA       MET  36  -8.136   4.879   7.342
  243    HB2  MET  36           HB2      MET  36  -8.111   6.031   5.253
  244    HB3  MET  36           HB3      MET  36  -7.277   4.503   5.015
  245    HG2  MET  36           HG2      MET  36 -10.143   5.016   4.263
  246    HG3  MET  36           HG3      MET  36  -8.779   5.134   3.156
  247    HE1  MET  36           HE1      MET  36  -9.306   3.297   1.365
  248    HE2  MET  36           HE2      MET  36 -10.905   3.486   2.084
  249    HE3  MET  36           HE3      MET  36 -10.258   1.873   1.782
  250    H    GLU  37           H        GLU  37  -9.593   6.234   8.171
  251    HA   GLU  37           HA       GLU  37 -12.418   5.634   7.785
  252    HB2  GLU  37           HB2      GLU  37 -11.301   6.026  10.062
  253    HB3  GLU  37           HB3      GLU  37 -11.281   7.729   9.626
  254    HG2  GLU  37           HG2      GLU  37 -13.661   7.803   9.511
  255    HG3  GLU  37           HG3      GLU  37 -13.776   6.053   9.691
  256    H    VAL  38           H        VAL  38 -13.338   6.557   6.077
  257    HA   VAL  38           HA       VAL  38 -12.484   9.201   5.189
  258    HB   VAL  38           HB       VAL  38 -14.698   7.680   3.868
  259   HG11  VAL  38          HG11      VAL  38 -14.407   9.644   2.742
  260   HG12  VAL  38          HG12      VAL  38 -13.254   8.633   1.872
  261   HG13  VAL  38          HG13      VAL  38 -12.688   9.738   3.124
  262   HG21  VAL  38          HG21      VAL  38 -11.763   7.032   3.617
  263   HG22  VAL  38          HG22      VAL  38 -13.010   6.472   2.503
  264   HG23  VAL  38          HG23      VAL  38 -13.042   5.963   4.191
  265    H    MET  39           H        MET  39 -14.338  10.691   4.443
  266    HA   MET  39           HA       MET  39 -15.794  11.516   6.674
  267    HB2  MET  39           HB2      MET  39 -16.584  12.122   3.828
  268    HB3  MET  39           HB3      MET  39 -16.830  13.120   5.255
  269    HG2  MET  39           HG2      MET  39 -14.055  12.658   5.030
  270    HG3  MET  39           HG3      MET  39 -14.646  13.098   3.429
  271    HE1  MET  39           HE1      MET  39 -15.371  16.713   3.536
  272    HE2  MET  39           HE2      MET  39 -15.808  15.168   2.806
  273    HE3  MET  39           HE3      MET  39 -14.117  15.667   2.870
  274    H    LYS  40           H        LYS  40 -16.566   9.228   4.172
  275    HA   LYS  40           HA       LYS  40 -19.380   9.136   4.745
  276    HB2  LYS  40           HB2      LYS  40 -17.560   7.346   3.133
  277    HB3  LYS  40           HB3      LYS  40 -19.287   7.061   3.301
  278    HG2  LYS  40           HG2      LYS  40 -18.389   9.735   2.371
  279    HG3  LYS  40           HG3      LYS  40 -18.294   8.376   1.249
  280    HD2  LYS  40           HD2      LYS  40 -20.798   9.010   2.788
  281    HD3  LYS  40           HD3      LYS  40 -20.440   9.757   1.230
  282    HE2  LYS  40           HE2      LYS  40 -20.211   7.471   0.265
  283    HE3  LYS  40           HE3      LYS  40 -20.754   6.815   1.810
  284    HZ1  LYS  40           HZ1      LYS  40 -22.830   8.037   1.546
  285    HZ2  LYS  40           HZ2      LYS  40 -22.579   6.980   0.250
  286    HZ3  LYS  40           HZ3      LYS  40 -22.309   8.638   0.053
  287    H    MET  41           H        MET  41 -17.035   6.462   4.888
  288    HA   MET  41           HA       MET  41 -17.783   5.860   7.622
  289    HB2  MET  41           HB2      MET  41 -18.730   4.296   5.287
  290    HB3  MET  41           HB3      MET  41 -18.137   3.371   6.659
  291    HG2  MET  41           HG2      MET  41 -19.736   5.075   7.953
  292    HG3  MET  41           HG3      MET  41 -20.557   5.038   6.393
  293    HE1  MET  41           HE1      MET  41 -20.075   3.691   9.673
  294    HE2  MET  41           HE2      MET  41 -19.077   2.328   9.166
  295    HE3  MET  41           HE3      MET  41 -20.733   2.054   9.707
  296    H    ILE  42           H        ILE  42 -16.721   3.468   8.039
  297    HA   ILE  42           HA       ILE  42 -13.899   3.929   7.629
  298    HB   ILE  42           HB       ILE  42 -14.669   3.155   9.808
  299   HG12  ILE  42          HG12      ILE  42 -13.110   1.277  10.119
  300   HG13  ILE  42          HG13      ILE  42 -13.045   1.039   8.375
  301   HG21  ILE  42          HG21      ILE  42 -15.912   1.017   8.177
  302   HG22  ILE  42          HG22      ILE  42 -16.515   1.846   9.612
  303   HG23  ILE  42          HG23      ILE  42 -15.302   0.576   9.772
  304   HD11  ILE  42          HD11      ILE  42 -12.399   3.741   8.894
  305   HD12  ILE  42          HD12      ILE  42 -11.364   2.461   8.260
  306   HD13  ILE  42          HD13      ILE  42 -11.463   2.736   9.999
  307    H    MET  43           H        MET  43 -12.449   2.499   6.618
  308    HA   MET  43           HA       MET  43 -13.561   0.314   5.039
  309    HB2  MET  43           HB2      MET  43 -12.305   2.789   3.913
  310    HB3  MET  43           HB3      MET  43 -12.105   1.255   3.076
  311    HG2  MET  43           HG2      MET  43 -14.825   2.202   3.865
  312    HG3  MET  43           HG3      MET  43 -14.042   2.828   2.415
  313    HE1  MET  43           HE1      MET  43 -13.953  -0.066  -0.021
  314    HE2  MET  43           HE2      MET  43 -12.634   0.676   0.886
  315    HE3  MET  43           HE3      MET  43 -13.922   1.680   0.220
  316    H    THR  44           H        THR  44 -11.809  -0.965   3.958
  317    HA   THR  44           HA       THR  44  -9.350  -0.911   5.585
  318    HB   THR  44           HB       THR  44 -10.016  -3.498   4.388
  319    HG1  THR  44           HG1      THR  44 -12.124  -2.891   4.860
  320   HG21  THR  44          HG21      THR  44  -9.429  -4.383   6.487
  321   HG22  THR  44          HG22      THR  44  -9.645  -2.826   7.287
  322   HG23  THR  44          HG23      THR  44  -8.301  -3.065   6.171
  323    H    LEU  45           H        LEU  45  -7.472  -0.806   4.527
  324    HA   LEU  45           HA       LEU  45  -7.531  -0.811   1.611
  325    HB2  LEU  45           HB2      LEU  45  -5.586   0.164   3.673
  326    HB3  LEU  45           HB3      LEU  45  -5.072  -0.064   2.013
  327    HG   LEU  45           HG       LEU  45  -7.529   1.497   2.222
  328   HD11  LEU  45          HD11      LEU  45  -6.695   2.374   4.242
  329   HD12  LEU  45          HD12      LEU  45  -6.262   3.547   2.998
  330   HD13  LEU  45          HD13      LEU  45  -5.044   2.436   3.625
  331   HD21  LEU  45          HD21      LEU  45  -6.472   2.841   0.591
  332   HD22  LEU  45          HD22      LEU  45  -6.018   1.177   0.224
  333   HD23  LEU  45          HD23      LEU  45  -4.871   2.246   1.032
  334    H    ASN  46           H        ASN  46  -6.579  -2.322   0.361
  335    HA   ASN  46           HA       ASN  46  -4.917  -4.361   1.679
  336    HB2  ASN  46           HB2      ASN  46  -6.010  -6.083   0.250
  337    HB3  ASN  46           HB3      ASN  46  -7.112  -5.342   1.407
  338   HD21  ASN  46          HD21      ASN  46  -8.563  -3.705   0.626
  339   HD22  ASN  46          HD22      ASN  46  -9.094  -3.742  -1.017
  340    H    VAL  47           H        VAL  47  -3.945  -5.839  -0.159
  341    HA   VAL  47           HA       VAL  47  -2.544  -4.011  -1.952
  342    HB   VAL  47           HB       VAL  47  -1.091  -6.030  -2.401
  343   HG11  VAL  47          HG11      VAL  47  -1.144  -5.436   0.531
  344   HG12  VAL  47          HG12      VAL  47  -0.755  -4.169  -0.632
  345   HG13  VAL  47          HG13      VAL  47   0.239  -5.624  -0.547
  346   HG21  VAL  47          HG21      VAL  47  -2.915  -7.631  -1.625
  347   HG22  VAL  47          HG22      VAL  47  -2.421  -7.218   0.016
  348   HG23  VAL  47          HG23      VAL  47  -1.270  -7.971  -1.088
  349    H    GLN  48           H        GLN  48  -2.335  -4.387  -4.187
  350    HA   GLN  48           HA       GLN  48  -4.674  -5.616  -5.371
  351    HB2  GLN  48           HB2      GLN  48  -4.089  -4.495  -7.379
  352    HB3  GLN  48           HB3      GLN  48  -3.774  -3.367  -6.070
  353    HG2  GLN  48           HG2      GLN  48  -1.590  -5.077  -7.203
  354    HG3  GLN  48           HG3      GLN  48  -2.062  -3.560  -7.965
  355   HE21  GLN  48          HE21      GLN  48  -0.290  -5.037  -5.474
  356   HE22  GLN  48          HE22      GLN  48   0.271  -3.600  -4.696
  357    H    GLU  49           H        GLU  49  -1.515  -6.592  -4.657
  358    HA   GLU  49           HA       GLU  49  -1.893  -9.035  -6.159
  359    HB2  GLU  49           HB2      GLU  49   0.379  -7.140  -6.740
  360    HB3  GLU  49           HB3      GLU  49   0.437  -8.847  -7.155
  361    HG2  GLU  49           HG2      GLU  49  -1.583  -8.547  -8.536
  362    HG3  GLU  49           HG3      GLU  49  -1.544  -6.822  -8.172
  363    H    ARG  50           H        ARG  50   0.016 -10.557  -5.757
  364    HA   ARG  50           HA       ARG  50   0.369 -10.802  -2.954
  365    HB2  ARG  50           HB2      ARG  50   1.339 -12.298  -5.355
  366    HB3  ARG  50           HB3      ARG  50   2.090 -12.612  -3.796
  367    HG2  ARG  50           HG2      ARG  50   0.448 -14.206  -3.830
  368    HG3  ARG  50           HG3      ARG  50  -0.375 -12.892  -2.987
  369    HD2  ARG  50           HD2      ARG  50  -1.981 -13.381  -4.520
  370    HD3  ARG  50           HD3      ARG  50  -1.041 -12.233  -5.472
  371    HE   ARG  50           HE       ARG  50   0.004 -14.781  -5.920
  372   HH11  ARG  50          HH11      ARG  50  -2.938 -13.004  -6.524
  373   HH12  ARG  50          HH12      ARG  50  -3.333 -13.899  -7.953
  374   HH21  ARG  50          HH21      ARG  50  -0.513 -15.959  -7.799
  375   HH22  ARG  50          HH22      ARG  50  -1.956 -15.577  -8.677
  376    H    GLY  51           H        GLY  51   2.008 -10.211  -1.649
  377    HA2  GLY  51           HA2      GLY  51   4.662  -9.936  -2.125
  378    HA3  GLY  51           HA3      GLY  51   4.004  -8.415  -2.709
  379    H    ARG  52           H        ARG  52   5.724  -8.043  -0.804
  380    HA   ARG  52           HA       ARG  52   4.386  -8.081   1.783
  381    HB2  ARG  52           HB2      ARG  52   7.193  -7.594   0.867
  382    HB3  ARG  52           HB3      ARG  52   6.682  -7.033   2.454
  383    HG2  ARG  52           HG2      ARG  52   5.798  -9.499   2.665
  384    HG3  ARG  52           HG3      ARG  52   7.033  -9.799   1.440
  385    HD2  ARG  52           HD2      ARG  52   8.423  -8.270   3.161
  386    HD3  ARG  52           HD3      ARG  52   7.305  -9.053   4.277
  387    HE   ARG  52           HE       ARG  52   8.343 -11.053   2.674
  388   HH11  ARG  52          HH11      ARG  52   9.565  -8.718   4.962
  389   HH12  ARG  52          HH12      ARG  52  10.891  -9.714   5.460
  390   HH21  ARG  52          HH21      ARG  52  10.086 -12.364   3.328
  391   HH22  ARG  52          HH22      ARG  52  11.188 -11.784   4.532
  392    H    VAL  53           H        VAL  53   3.507  -6.371   2.721
  393    HA   VAL  53           HA       VAL  53   3.358  -3.884   1.249
  394    HB   VAL  53           HB       VAL  53   2.145  -4.473   3.947
  395   HG11  VAL  53          HG11      VAL  53   1.602  -2.435   1.802
  396   HG12  VAL  53          HG12      VAL  53   2.058  -2.157   3.483
  397   HG13  VAL  53          HG13      VAL  53   0.458  -2.790   3.097
  398   HG21  VAL  53          HG21      VAL  53   1.093  -5.077   1.191
  399   HG22  VAL  53          HG22      VAL  53   0.078  -5.020   2.632
  400   HG23  VAL  53          HG23      VAL  53   1.375  -6.209   2.513
  401    H    LYS  54           H        LYS  54   4.650  -2.202   1.553
  402    HA   LYS  54           HA       LYS  54   6.108  -1.996   4.107
  403    HB2  LYS  54           HB2      LYS  54   7.033  -0.779   1.514
  404    HB3  LYS  54           HB3      LYS  54   7.965  -1.076   2.974
  405    HG2  LYS  54           HG2      LYS  54   7.433  -3.574   2.482
  406    HG3  LYS  54           HG3      LYS  54   7.119  -2.987   0.848
  407    HD2  LYS  54           HD2      LYS  54   9.380  -3.614   0.833
  408    HD3  LYS  54           HD3      LYS  54   9.405  -1.858   1.002
  409    HE2  LYS  54           HE2      LYS  54  10.975  -2.640   2.561
  410    HE3  LYS  54           HE3      LYS  54   9.539  -2.260   3.510
  411    HZ1  LYS  54           HZ1      LYS  54  10.477  -4.373   4.175
  412    HZ2  LYS  54           HZ2      LYS  54  10.352  -4.967   2.596
  413    HZ3  LYS  54           HZ3      LYS  54   8.953  -4.613   3.479
  414    H    TYR  55           H        TYR  55   5.147  -0.505   5.321
  415    HA   TYR  55           HA       TYR  55   3.475   1.538   4.430
  416    HB2  TYR  55           HB2      TYR  55   4.878   0.912   6.973
  417    HB3  TYR  55           HB3      TYR  55   4.273   2.554   6.779
  418    HD1  TYR  55           HD1      TYR  55   2.772  -0.625   5.559
  419    HD2  TYR  55           HD2      TYR  55   2.463   2.652   8.256
  420    HE1  TYR  55           HE1      TYR  55   0.525  -1.382   6.213
  421    HE2  TYR  55           HE2      TYR  55   0.216   1.903   8.918
  422    HH   TYR  55           HH       TYR  55  -1.039  -1.165   8.021
  423    H    ILE  56           H        ILE  56   3.808   3.485   3.580
  424    HA   ILE  56           HA       ILE  56   6.565   4.493   3.458
  425    HB   ILE  56           HB       ILE  56   4.262   4.633   1.586
  426   HG12  ILE  56          HG12      ILE  56   6.013   4.346  -0.080
  427   HG13  ILE  56          HG13      ILE  56   7.254   4.608   1.141
  428   HG21  ILE  56          HG21      ILE  56   5.382   6.607   0.436
  429   HG22  ILE  56          HG22      ILE  56   6.198   6.897   1.973
  430   HG23  ILE  56          HG23      ILE  56   4.438   6.957   1.884
  431   HD11  ILE  56          HD11      ILE  56   6.467   2.563   2.295
  432   HD12  ILE  56          HD12      ILE  56   7.098   2.273   0.674
  433   HD13  ILE  56          HD13      ILE  56   5.357   2.285   0.954
  434    H    LYS  57           H        LYS  57   3.229   5.678   3.736
  435    HA   LYS  57           HA       LYS  57   4.004   8.242   4.703
  436    HB2  LYS  57           HB2      LYS  57   1.570   6.857   3.987
  437    HB3  LYS  57           HB3      LYS  57   1.347   7.790   5.462
  438    HG2  LYS  57           HG2      LYS  57   2.394   8.874   2.854
  439    HG3  LYS  57           HG3      LYS  57   0.744   9.054   3.452
  440    HD2  LYS  57           HD2      LYS  57   1.399  10.470   5.187
  441    HD3  LYS  57           HD3      LYS  57   3.085   9.959   5.091
  442    HE2  LYS  57           HE2      LYS  57   2.690  10.975   2.601
  443    HE3  LYS  57           HE3      LYS  57   1.638  12.009   3.566
  444    HZ1  LYS  57           HZ1      LYS  57   3.376  12.984   4.567
  445    HZ2  LYS  57           HZ2      LYS  57   4.250  12.436   3.227
  446    HZ3  LYS  57           HZ3      LYS  57   4.277  11.555   4.671
  447    H    ARG  58           H        ARG  58   2.992   9.040   6.846
  448    HA   ARG  58           HA       ARG  58   3.981   7.273   8.945
  449    HB2  ARG  58           HB2      ARG  58   3.494  10.197   8.686
  450    HB3  ARG  58           HB3      ARG  58   3.365   9.496  10.294
  451    HG2  ARG  58           HG2      ARG  58   5.598  10.400   9.831
  452    HG3  ARG  58           HG3      ARG  58   5.627   8.666  10.158
  453    HD2  ARG  58           HD2      ARG  58   5.900   8.150   7.859
  454    HD3  ARG  58           HD3      ARG  58   5.540   9.806   7.375
  455    HE   ARG  58           HE       ARG  58   8.069   8.770   8.186
  456   HH11  ARG  58          HH11      ARG  58   6.088  11.644   8.204
  457   HH12  ARG  58          HH12      ARG  58   7.438  12.725   8.283
  458   HH21  ARG  58          HH21      ARG  58   9.846  10.191   8.291
  459   HH22  ARG  58          HH22      ARG  58   9.572  11.901   8.332
  460    HA   PRO  59           HA       PRO  59   0.062   6.157  10.610
  461    HB2  PRO  59           HB2      PRO  59   0.408   6.450  13.296
  462    HB3  PRO  59           HB3      PRO  59   1.127   5.130  12.366
  463    HG2  PRO  59           HG2      PRO  59   2.369   7.694  13.288
  464    HG3  PRO  59           HG3      PRO  59   3.042   6.053  13.308
  465    HD2  PRO  59           HD2      PRO  59   3.703   7.860  11.412
  466    HD3  PRO  59           HD3      PRO  59   3.603   6.121  11.069
  467    H    GLY  60           H        GLY  60  -1.827   7.184  10.683
  468    HA2  GLY  60           HA2      GLY  60  -3.422   8.702  11.487
  469    HA3  GLY  60           HA3      GLY  60  -2.134   9.610  12.262
  470    H    ALA  61           H        ALA  61  -0.756   9.337   9.458
  471    HA   ALA  61           HA       ALA  61  -1.232  11.930   8.581
  472    HB1  ALA  61           HB1      ALA  61   0.759  10.671   7.970
  473    HB2  ALA  61           HB2      ALA  61  -0.060  11.281   6.532
  474    HB3  ALA  61           HB3      ALA  61  -0.217   9.583   6.982
  475    H    VAL  62           H        VAL  62  -2.423  12.813   6.893
  476    HA   VAL  62           HA       VAL  62  -4.937  11.517   6.370
  477    HB   VAL  62           HB       VAL  62  -5.499  13.552   5.100
  478   HG11  VAL  62          HG11      VAL  62  -5.884  13.513   7.496
  479   HG12  VAL  62          HG12      VAL  62  -5.398  15.129   6.981
  480   HG13  VAL  62          HG13      VAL  62  -4.238  14.075   7.789
  481   HG21  VAL  62          HG21      VAL  62  -2.675  14.396   5.751
  482   HG22  VAL  62          HG22      VAL  62  -3.917  15.435   5.053
  483   HG23  VAL  62          HG23      VAL  62  -3.320  14.045   4.147
  484    H    LEU  63           H        LEU  63  -5.507  10.377   4.627
  485    HA   LEU  63           HA       LEU  63  -3.526   9.857   2.587
  486    HB2  LEU  63           HB2      LEU  63  -6.202   8.714   3.286
  487    HB3  LEU  63           HB3      LEU  63  -5.500   8.382   1.715
  488    HG   LEU  63           HG       LEU  63  -4.997   6.558   3.200
  489   HD11  LEU  63          HD11      LEU  63  -2.465   8.158   2.975
  490   HD12  LEU  63          HD12      LEU  63  -3.256   7.428   1.577
  491   HD13  LEU  63          HD13      LEU  63  -2.669   6.408   2.891
  492   HD21  LEU  63          HD21      LEU  63  -3.571   8.501   5.002
  493   HD22  LEU  63          HD22      LEU  63  -3.889   6.789   5.283
  494   HD23  LEU  63          HD23      LEU  63  -5.221   7.946   5.289
  495    H    GLU  64           H        GLU  64  -3.882  10.094   0.331
  496    HA   GLU  64           HA       GLU  64  -6.005  11.978  -0.425
  497    HB2  GLU  64           HB2      GLU  64  -3.140  12.199  -1.359
  498    HB3  GLU  64           HB3      GLU  64  -4.464  13.283  -1.761
  499    HG2  GLU  64           HG2      GLU  64  -3.234  12.890   0.957
  500    HG3  GLU  64           HG3      GLU  64  -3.029  14.285  -0.101
  501    H    ALA  65           H        ALA  65  -6.741  11.813  -2.556
  502    HA   ALA  65           HA       ALA  65  -6.729   9.241  -3.675
  503    HB1  ALA  65           HB1      ALA  65  -7.444  11.797  -5.102
  504    HB2  ALA  65           HB2      ALA  65  -8.514  10.955  -3.981
  505    HB3  ALA  65           HB3      ALA  65  -8.007  10.167  -5.475
  506    H    GLY  66           H        GLY  66  -4.685   8.484  -4.127
  507    HA2  GLY  66           HA2      GLY  66  -3.396   8.183  -6.236
  508    HA3  GLY  66           HA3      GLY  66  -3.227   9.931  -6.253
  509    H    CYS  67           H        CYS  67  -2.899   9.801  -3.225
  510    HA   CYS  67           HA       CYS  67  -0.079   9.835  -3.193
  511    HB2  CYS  67           HB2      CYS  67  -1.479  11.121  -1.615
  512    HB3  CYS  67           HB3      CYS  67  -1.990   9.617  -0.856
  513    HG   CYS  67           HG       CYS  67   1.029  10.247  -0.789
  514    H    VAL  68           H        VAL  68   1.412   8.420  -2.254
  515    HA   VAL  68           HA       VAL  68   0.698   5.633  -2.470
  516    HB   VAL  68           HB       VAL  68   3.353   6.736  -1.561
  517   HG11  VAL  68          HG11      VAL  68   4.241   4.666  -2.056
  518   HG12  VAL  68          HG12      VAL  68   2.937   4.254  -3.170
  519   HG13  VAL  68          HG13      VAL  68   2.652   4.230  -1.429
  520   HG21  VAL  68          HG21      VAL  68   3.745   6.179  -4.176
  521   HG22  VAL  68          HG22      VAL  68   3.382   7.789  -3.555
  522   HG23  VAL  68          HG23      VAL  68   2.091   6.789  -4.222
  523    H    VAL  69           H        VAL  69  -0.313   4.674  -0.828
  524    HA   VAL  69           HA       VAL  69   0.027   5.569   1.895
  525    HB   VAL  69           HB       VAL  69  -1.492   3.145   0.931
  526   HG11  VAL  69          HG11      VAL  69  -1.138   3.091   3.294
  527   HG12  VAL  69          HG12      VAL  69  -2.811   3.572   3.009
  528   HG13  VAL  69          HG13      VAL  69  -1.610   4.783   3.457
  529   HG21  VAL  69          HG21      VAL  69  -2.110   6.017   0.745
  530   HG22  VAL  69          HG22      VAL  69  -3.400   5.001   1.389
  531   HG23  VAL  69          HG23      VAL  69  -2.718   4.659  -0.201
  532    H    ALA  70           H        ALA  70   1.250   3.024  -0.135
  533    HA   ALA  70           HA       ALA  70   3.230   2.315   1.798
  534    HB1  ALA  70           HB1      ALA  70   0.941   1.046   2.312
  535    HB2  ALA  70           HB2      ALA  70   2.519   0.302   2.566
  536    HB3  ALA  70           HB3      ALA  70   1.601  -0.057   1.104
  537    H    ARG  71           H        ARG  71   3.948  -0.189   0.847
  538    HA   ARG  71           HA       ARG  71   4.235   0.103  -2.049
  539    HB2  ARG  71           HB2      ARG  71   6.403   0.307  -0.039
  540    HB3  ARG  71           HB3      ARG  71   6.748  -0.677  -1.455
  541    HG2  ARG  71           HG2      ARG  71   5.701   2.129  -1.661
  542    HG3  ARG  71           HG3      ARG  71   7.423   1.756  -1.565
  543    HD2  ARG  71           HD2      ARG  71   6.066   0.124  -3.542
  544    HD3  ARG  71           HD3      ARG  71   5.867   1.847  -3.862
  545    HE   ARG  71           HE       ARG  71   8.260   0.311  -4.138
  546   HH11  ARG  71          HH11      ARG  71   7.026   3.500  -3.441
  547   HH12  ARG  71          HH12      ARG  71   8.462   4.308  -3.971
  548   HH21  ARG  71          HH21      ARG  71  10.151   1.373  -4.836
  549   HH22  ARG  71          HH22      ARG  71  10.236   3.101  -4.764
  550    H    LEU  72           H        LEU  72   4.380  -1.804  -3.145
  551    HA   LEU  72           HA       LEU  72   3.916  -4.218  -1.568
  552    HB2  LEU  72           HB2      LEU  72   3.033  -3.231  -4.120
  553    HB3  LEU  72           HB3      LEU  72   3.785  -4.801  -4.326
  554    HG   LEU  72           HG       LEU  72   1.416  -5.093  -4.020
  555   HD11  LEU  72          HD11      LEU  72   3.099  -6.653  -2.913
  556   HD12  LEU  72          HD12      LEU  72   1.433  -6.722  -2.338
  557   HD13  LEU  72          HD13      LEU  72   2.656  -5.865  -1.399
  558   HD21  LEU  72          HD21      LEU  72   1.458  -2.864  -2.517
  559   HD22  LEU  72          HD22      LEU  72   1.383  -4.086  -1.248
  560   HD23  LEU  72          HD23      LEU  72   0.136  -4.031  -2.494
  561    H    GLU  73           H        GLU  73   4.954  -6.251  -2.282
  562    HA   GLU  73           HA       GLU  73   7.562  -5.907  -3.555
  563    HB2  GLU  73           HB2      GLU  73   7.409  -5.910  -0.832
  564    HB3  GLU  73           HB3      GLU  73   7.635  -7.622  -1.161
  565    HG2  GLU  73           HG2      GLU  73   9.421  -5.668  -2.511
  566    HG3  GLU  73           HG3      GLU  73   9.675  -6.010  -0.800
  567    H    LEU  74           H        LEU  74   6.728  -7.089  -5.291
  568    HA   LEU  74           HA       LEU  74   5.427  -9.572  -5.074
  569    HB2  LEU  74           HB2      LEU  74   6.363  -7.860  -7.155
  570    HB3  LEU  74           HB3      LEU  74   6.910  -9.489  -7.501
  571    HG   LEU  74           HG       LEU  74   4.818  -9.163  -8.605
  572   HD11  LEU  74          HD11      LEU  74   4.219 -10.764  -6.128
  573   HD12  LEU  74          HD12      LEU  74   5.240 -11.343  -7.444
  574   HD13  LEU  74          HD13      LEU  74   3.541 -10.973  -7.742
  575   HD21  LEU  74          HD21      LEU  74   3.862  -8.182  -5.929
  576   HD22  LEU  74          HD22      LEU  74   2.760  -8.668  -7.217
  577   HD23  LEU  74          HD23      LEU  74   3.872  -7.323  -7.469
  578    H    ASP  75           H        ASP  75   8.839  -8.727  -5.449
  579    HA   ASP  75           HA       ASP  75  10.712  -9.880  -4.810
  580    HB2  ASP  75           HB2      ASP  75   8.995 -11.056  -3.185
  581    HB3  ASP  75           HB3      ASP  75   9.199 -12.409  -4.294
  582    H    ASP  76           H        ASP  76  10.476  -9.573  -7.335
  583    HA   ASP  76           HA       ASP  76  10.227 -12.009  -8.837
  584    HB2  ASP  76           HB2      ASP  76   9.788  -9.552  -9.603
  585    HB3  ASP  76           HB3      ASP  76  11.522  -9.522  -9.908
  586    H    LEU  77           H        LEU  77  11.788 -13.373  -9.493
  587    HA   LEU  77           HA       LEU  77  14.441 -13.026  -8.371
  588    HB2  LEU  77           HB2      LEU  77  12.812 -15.207  -8.783
  589    HB3  LEU  77           HB3      LEU  77  13.997 -15.369 -10.064
  590    HG   LEU  77           HG       LEU  77  14.960 -14.872  -7.283
  591   HD11  LEU  77          HD11      LEU  77  14.483 -16.913  -6.474
  592   HD12  LEU  77          HD12      LEU  77  14.664 -17.695  -8.044
  593   HD13  LEU  77          HD13      LEU  77  13.163 -16.860  -7.643
  594   HD21  LEU  77          HD21      LEU  77  16.173 -16.832  -9.138
  595   HD22  LEU  77          HD22      LEU  77  16.936 -15.661  -8.061
  596   HD23  LEU  77          HD23      LEU  77  16.261 -15.133  -9.602
  597    H    GLU  78           H        GLU  78  14.154 -11.100 -10.200
  598    HA   GLU  78           HA       GLU  78  15.361 -10.143 -11.886
  599    HB2  GLU  78           HB2      GLU  78  17.036 -12.087 -11.208
  600    HB3  GLU  78           HB3      GLU  78  16.551 -12.733 -12.770
  601    HG2  GLU  78           HG2      GLU  78  17.157 -10.460 -13.725
  602    HG3  GLU  78           HG3      GLU  78  17.935 -10.140 -12.175
  603    H    HIS  79           H        HIS  79  12.979 -10.246 -12.562
  604    HA   HIS  79           HA       HIS  79  12.917 -11.253 -15.294
  605    HB2  HIS  79           HB2      HIS  79  11.768 -12.807 -13.402
  606    HB3  HIS  79           HB3      HIS  79  10.417 -11.745 -13.788
  607    HD1  HIS  79           HD1      HIS  79  12.904 -13.920 -15.682
  608    HD2  HIS  79           HD2      HIS  79   8.963 -12.621 -15.891
  609    HE1  HIS  79           HE1      HIS  79  11.913 -15.098 -17.670
  610    HE2  HIS  79           HE2      HIS  79   9.504 -14.362 -17.726
  611    H    HIS  80           H        HIS  80  13.122  -8.627 -14.112
  612    HA   HIS  80           HA       HIS  80  10.654  -7.449 -15.202
  613    HB2  HIS  80           HB2      HIS  80  10.862  -5.634 -13.516
  614    HB3  HIS  80           HB3      HIS  80  10.549  -7.209 -12.795
  615    HD1  HIS  80           HD1      HIS  80  12.026  -7.799 -10.901
  616    HD2  HIS  80           HD2      HIS  80  13.774  -4.982 -13.406
  617    HE1  HIS  80           HE1      HIS  80  14.200  -7.177  -9.800
  618    HE2  HIS  80           HE2      HIS  80  15.281  -5.539 -11.379
  619    H    HIS  81           H        HIS  81  11.035  -5.014 -15.642
  620    HA   HIS  81           HA       HIS  81  13.262  -4.842 -17.450
  621    HB2  HIS  81           HB2      HIS  81  11.196  -2.769 -16.681
  622    HB3  HIS  81           HB3      HIS  81  12.343  -2.621 -18.009
  623    HD1  HIS  81           HD1      HIS  81   8.963  -3.514 -17.401
  624    HD2  HIS  81           HD2      HIS  81  11.944  -4.952 -19.913
  625    HE1  HIS  81           HE1      HIS  81   7.764  -4.797 -19.201
  626    HE2  HIS  81           HE2      HIS  81   9.593  -5.729 -20.661
  627    H    HIS  82           H        HIS  82  12.197  -2.757 -14.756
  628    HA   HIS  82           HA       HIS  82  15.022  -2.317 -14.082
  629    HB2  HIS  82           HB2      HIS  82  12.918  -0.147 -14.238
  630    HB3  HIS  82           HB3      HIS  82  14.579   0.069 -13.698
  631    HD1  HIS  82           HD1      HIS  82  16.315  -0.990 -15.757
  632    HD2  HIS  82           HD2      HIS  82  12.679   0.754 -16.762
  633    HE1  HIS  82           HE1      HIS  82  16.535  -0.318 -18.170
  634    HE2  HIS  82           HE2      HIS  82  14.357   0.818 -18.729
  635    H    HIS  83           H        HIS  83  15.421  -1.759 -11.888
  636    HA   HIS  83           HA       HIS  83  13.265  -2.623 -10.090
  637    HB2  HIS  83           HB2      HIS  83  15.389  -3.935 -10.076
  638    HB3  HIS  83           HB3      HIS  83  16.231  -2.492  -9.520
  639    HD1  HIS  83           HD1      HIS  83  16.611  -2.538  -7.089
  640    HD2  HIS  83           HD2      HIS  83  13.080  -4.469  -8.122
  641    HE1  HIS  83           HE1      HIS  83  15.638  -3.363  -4.922
  642    HE2  HIS  83           HE2      HIS  83  13.454  -4.445  -5.563
  643    H    HIS  84           H        HIS  84  15.303   0.032 -10.909
  644    HA   HIS  84           HA       HIS  84  14.770   1.465  -8.441
  645    HB2  HIS  84           HB2      HIS  84  16.213   2.334 -10.954
  646    HB3  HIS  84           HB3      HIS  84  16.123   3.262  -9.461
  647    HD1  HIS  84           HD1      HIS  84  17.618   2.514  -7.508
  648    HD2  HIS  84           HD2      HIS  84  17.961   0.131 -10.894
  649    HE1  HIS  84           HE1      HIS  84  19.647   1.082  -7.118
  650    HE2  HIS  84           HE2      HIS  84  19.884  -0.292  -9.217
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  10.138  10.875 -13.922
    2    H2   MET   1           H2       MET   1   9.878   9.498 -14.908
    3    H3   MET   1           H3       MET   1   9.683  11.071 -15.565
    4    HA   MET   1           HA       MET   1   7.795  11.483 -14.324
    5    HB2  MET   1           HB2      MET   1   8.017   8.860 -15.723
    6    HB3  MET   1           HB3      MET   1   6.523   9.203 -14.862
    7    HG2  MET   1           HG2      MET   1   5.994   9.999 -16.924
    8    HG3  MET   1           HG3      MET   1   6.649  11.461 -16.188
    9    HE1  MET   1           HE1      MET   1   7.101   8.528 -18.513
   10    HE2  MET   1           HE2      MET   1   8.685   8.274 -17.780
   11    HE3  MET   1           HE3      MET   1   8.564   8.866 -19.437
   12    H    GLU   2           H        GLU   2   6.044  10.384 -12.932
   13    HA   GLU   2           HA       GLU   2   7.279   8.818 -10.771
   14    HB2  GLU   2           HB2      GLU   2   6.879  11.413 -10.402
   15    HB3  GLU   2           HB3      GLU   2   5.235  10.880 -10.081
   16    HG2  GLU   2           HG2      GLU   2   6.282   9.229  -8.438
   17    HG3  GLU   2           HG3      GLU   2   7.745  10.200  -8.596
   18    H    ASN   3           H        ASN   3   6.255   6.977 -11.678
   19    HA   ASN   3           HA       ASN   3   3.718   6.402 -10.588
   20    HB2  ASN   3           HB2      ASN   3   3.052   7.857 -12.538
   21    HB3  ASN   3           HB3      ASN   3   3.716   6.621 -13.602
   22   HD21  ASN   3          HD21      ASN   3   1.473   6.959 -10.878
   23   HD22  ASN   3          HD22      ASN   3   0.309   5.830 -11.474
   24    H    ASP   4           H        ASP   4   3.644   4.275 -10.248
   25    HA   ASP   4           HA       ASP   4   4.670   2.383 -12.159
   26    HB2  ASP   4           HB2      ASP   4   6.252   3.182  -9.806
   27    HB3  ASP   4           HB3      ASP   4   6.054   1.443  -9.998
   28    HA   PRO   5           HA       PRO   5   1.681  -0.195 -10.192
   29    HB2  PRO   5           HB2      PRO   5   2.636  -2.673 -10.635
   30    HB3  PRO   5           HB3      PRO   5   2.042  -1.648 -11.948
   31    HG2  PRO   5           HG2      PRO   5   4.859  -2.177 -11.084
   32    HG3  PRO   5           HG3      PRO   5   4.188  -2.102 -12.723
   33    HD2  PRO   5           HD2      PRO   5   5.540  -0.037 -11.558
   34    HD3  PRO   5           HD3      PRO   5   4.284   0.191 -12.790
   35    H    THR   6           H        THR   6   4.975  -0.362  -9.120
   36    HA   THR   6           HA       THR   6   4.317  -1.975  -6.790
   37    HB   THR   6           HB       THR   6   6.684  -1.949  -6.309
   38    HG1  THR   6           HG1      THR   6   8.005  -0.506  -7.105
   39   HG21  THR   6          HG21      THR   6   6.267  -2.270  -9.271
   40   HG22  THR   6          HG22      THR   6   6.056  -3.519  -8.043
   41   HG23  THR   6          HG23      THR   6   7.658  -2.850  -8.355
   42    H    VAL   7           H        VAL   7   2.882   0.359  -6.786
   43    HA   VAL   7           HA       VAL   7   3.983   1.693  -4.445
   44    HB   VAL   7           HB       VAL   7   3.473   3.914  -5.259
   45   HG11  VAL   7          HG11      VAL   7   5.432   4.179  -6.370
   46   HG12  VAL   7          HG12      VAL   7   5.090   2.875  -7.506
   47   HG13  VAL   7          HG13      VAL   7   5.663   2.501  -5.881
   48   HG21  VAL   7          HG21      VAL   7   2.185   2.375  -7.346
   49   HG22  VAL   7          HG22      VAL   7   3.173   3.692  -7.976
   50   HG23  VAL   7          HG23      VAL   7   1.889   4.027  -6.815
   51    H    LEU   8           H        LEU   8   2.153   3.528  -3.864
   52    HA   LEU   8           HA       LEU   8  -0.510   2.400  -4.183
   53    HB2  LEU   8           HB2      LEU   8   1.012   1.758  -1.950
   54    HB3  LEU   8           HB3      LEU   8  -0.023   3.060  -1.392
   55    HG   LEU   8           HG       LEU   8  -1.111   0.645  -2.810
   56   HD11  LEU   8          HD11      LEU   8   0.139  -0.055  -0.799
   57   HD12  LEU   8          HD12      LEU   8  -1.597  -0.342  -0.670
   58   HD13  LEU   8          HD13      LEU   8  -0.864   1.028   0.166
   59   HD21  LEU   8          HD21      LEU   8  -2.323   2.772  -1.058
   60   HD22  LEU   8          HD22      LEU   8  -3.174   1.323  -1.597
   61   HD23  LEU   8          HD23      LEU   8  -2.611   2.506  -2.778
   62    H    ARG   9           H        ARG   9  -2.108   3.902  -4.083
   63    HA   ARG   9           HA       ARG   9  -1.577   6.540  -2.986
   64    HB2  ARG   9           HB2      ARG   9  -2.471   6.265  -5.854
   65    HB3  ARG   9           HB3      ARG   9  -2.051   7.743  -5.000
   66    HG2  ARG   9           HG2      ARG   9   0.281   6.721  -4.758
   67    HG3  ARG   9           HG3      ARG   9  -0.239   5.576  -5.996
   68    HD2  ARG   9           HD2      ARG   9  -0.864   7.579  -7.404
   69    HD3  ARG   9           HD3      ARG   9  -0.020   8.570  -6.215
   70    HE   ARG   9           HE       ARG   9   1.567   6.409  -7.248
   71   HH11  ARG   9          HH11      ARG   9   0.534   9.702  -7.770
   72   HH12  ARG   9          HH12      ARG   9   1.907  10.110  -8.743
   73   HH21  ARG   9          HH21      ARG   9   3.374   6.945  -8.527
   74   HH22  ARG   9          HH22      ARG   9   3.519   8.546  -9.173
   75    H    SER  10           H        SER  10  -3.394   7.581  -2.301
   76    HA   SER  10           HA       SER  10  -5.748   6.041  -1.956
   77    HB2  SER  10           HB2      SER  10  -4.867   8.792  -1.242
   78    HB3  SER  10           HB3      SER  10  -6.603   8.482  -1.260
   79    HG   SER  10           HG       SER  10  -6.242   6.770   0.200
   80    HA   PRO  11           HA       PRO  11  -7.944   7.065  -5.656
   81    HB2  PRO  11           HB2      PRO  11 -10.472   6.537  -4.875
   82    HB3  PRO  11           HB3      PRO  11  -9.279   5.258  -5.135
   83    HG2  PRO  11           HG2      PRO  11 -10.180   6.515  -2.571
   84    HG3  PRO  11           HG3      PRO  11  -9.894   4.804  -2.938
   85    HD2  PRO  11           HD2      PRO  11  -8.094   6.365  -1.621
   86    HD3  PRO  11           HD3      PRO  11  -7.623   4.992  -2.643
   87    H    SER  12           H        SER  12  -8.750   8.595  -2.618
   88    HA   SER  12           HA       SER  12  -9.371  11.059  -4.004
   89    HB2  SER  12           HB2      SER  12 -11.403   9.838  -2.121
   90    HB3  SER  12           HB3      SER  12 -11.541  11.387  -2.953
   91    HG   SER  12           HG       SER  12 -12.676   9.887  -4.133
   92    H    ALA  13           H        ALA  13 -10.039  12.763  -2.213
   93    HA   ALA  13           HA       ALA  13  -7.830  12.847  -0.390
   94    HB1  ALA  13           HB1      ALA  13  -8.656  14.857  -1.536
   95    HB2  ALA  13           HB2      ALA  13  -8.658  15.045   0.218
   96    HB3  ALA  13           HB3      ALA  13 -10.169  14.735  -0.637
   97    H    GLY  14           H        GLY  14  -7.789  11.925   1.545
   98    HA2  GLY  14           HA2      GLY  14 -10.251  11.908   3.153
   99    HA3  GLY  14           HA3      GLY  14  -9.374  10.405   2.914
  100    H    LYS  15           H        LYS  15  -8.590   9.960   4.890
  101    HA   LYS  15           HA       LYS  15  -6.452  11.572   5.908
  102    HB2  LYS  15           HB2      LYS  15  -8.497  12.722   6.803
  103    HB3  LYS  15           HB3      LYS  15  -8.881  11.243   7.674
  104    HG2  LYS  15           HG2      LYS  15  -6.169  12.303   8.099
  105    HG3  LYS  15           HG3      LYS  15  -7.492  13.290   8.723
  106    HD2  LYS  15           HD2      LYS  15  -7.547  10.368   9.269
  107    HD3  LYS  15           HD3      LYS  15  -6.390  11.358  10.162
  108    HE2  LYS  15           HE2      LYS  15  -8.188  11.500  11.563
  109    HE3  LYS  15           HE3      LYS  15  -8.506  12.889  10.524
  110    HZ1  LYS  15           HZ1      LYS  15 -10.469  11.474  10.892
  111    HZ2  LYS  15           HZ2      LYS  15  -9.679  10.191  10.124
  112    HZ3  LYS  15           HZ3      LYS  15 -10.053  11.593   9.256
  113    H    LEU  16           H        LEU  16  -5.018  10.335   6.981
  114    HA   LEU  16           HA       LEU  16  -5.381   7.525   7.062
  115    HB2  LEU  16           HB2      LEU  16  -3.222   9.157   7.032
  116    HB3  LEU  16           HB3      LEU  16  -3.249   8.712   8.726
  117    HG   LEU  16           HG       LEU  16  -3.051   6.369   8.179
  118   HD11  LEU  16          HD11      LEU  16  -4.295   6.068   6.227
  119   HD12  LEU  16          HD12      LEU  16  -2.628   5.794   5.720
  120   HD13  LEU  16          HD13      LEU  16  -3.418   7.330   5.363
  121   HD21  LEU  16          HD21      LEU  16  -0.932   7.257   8.371
  122   HD22  LEU  16          HD22      LEU  16  -1.111   8.271   6.939
  123   HD23  LEU  16          HD23      LEU  16  -0.873   6.532   6.764
  124    H    THR  17           H        THR  17  -6.999   6.840   8.385
  125    HA   THR  17           HA       THR  17  -7.377   7.881  11.026
  126    HB   THR  17           HB       THR  17  -9.228   6.985   9.617
  127    HG1  THR  17           HG1      THR  17 -10.248   6.550  11.393
  128   HG21  THR  17          HG21      THR  17  -8.343   4.236  10.393
  129   HG22  THR  17          HG22      THR  17  -7.890   4.953   8.848
  130   HG23  THR  17          HG23      THR  17  -9.591   4.722   9.247
  131    H    GLN  18           H        GLN  18  -6.125   4.825   9.708
  132    HA   GLN  18           HA       GLN  18  -4.306   4.505  11.878
  133    HB2  GLN  18           HB2      GLN  18  -6.820   3.664  12.512
  134    HB3  GLN  18           HB3      GLN  18  -6.129   2.187  11.854
  135    HG2  GLN  18           HG2      GLN  18  -4.702   1.920  13.580
  136    HG3  GLN  18           HG3      GLN  18  -4.464   3.653  13.796
  137   HE21  GLN  18          HE21      GLN  18  -7.006   1.199  14.123
  138   HE22  GLN  18          HE22      GLN  18  -7.661   1.826  15.593
  139    H    TYR  19           H        TYR  19  -3.979   1.706  11.740
  140    HA   TYR  19           HA       TYR  19  -3.653   1.022   8.937
  141    HB2  TYR  19           HB2      TYR  19  -1.219   0.497   9.280
  142    HB3  TYR  19           HB3      TYR  19  -1.604   2.214   9.281
  143    HD1  TYR  19           HD2      TYR  19  -0.527  -0.629  11.328
  144    HD2  TYR  19           HD1      TYR  19  -1.402   3.534  11.305
  145    HE1  TYR  19           HE2      TYR  19   0.577  -0.391  13.512
  146    HE2  TYR  19           HE1      TYR  19  -0.299   3.784  13.488
  147    HH   TYR  19           HH       TYR  19   0.161   1.864  15.548
  148    H    THR  20           H        THR  20  -3.644  -1.149   8.573
  149    HA   THR  20           HA       THR  20  -4.126  -2.842  10.905
  150    HB   THR  20           HB       THR  20  -5.216  -4.355   9.460
  151    HG1  THR  20           HG1      THR  20  -3.828  -3.028   7.390
  152   HG21  THR  20          HG21      THR  20  -6.672  -2.933   7.965
  153   HG22  THR  20          HG22      THR  20  -5.748  -1.548   8.548
  154   HG23  THR  20          HG23      THR  20  -6.675  -2.531   9.682
  155    H    VAL  21           H        VAL  21  -1.532  -2.015   9.000
  156    HA   VAL  21           HA       VAL  21  -0.068  -4.372   9.866
  157    HB   VAL  21           HB       VAL  21   0.938  -4.750   7.648
  158   HG11  VAL  21          HG11      VAL  21  -0.852  -6.031   6.745
  159   HG12  VAL  21          HG12      VAL  21  -2.059  -4.999   7.512
  160   HG13  VAL  21          HG13      VAL  21  -1.036  -6.044   8.498
  161   HG21  VAL  21          HG21      VAL  21   0.243  -2.367   6.884
  162   HG22  VAL  21          HG22      VAL  21  -1.264  -3.149   6.408
  163   HG23  VAL  21          HG23      VAL  21   0.265  -3.680   5.708
  164    H    GLU  22           H        GLU  22   2.096  -4.018  10.183
  165    HA   GLU  22           HA       GLU  22   2.938  -1.331  10.520
  166    HB2  GLU  22           HB2      GLU  22   5.064  -2.281  11.222
  167    HB3  GLU  22           HB3      GLU  22   3.734  -3.178  11.942
  168    HG2  GLU  22           HG2      GLU  22   4.323  -4.467   9.521
  169    HG3  GLU  22           HG3      GLU  22   5.872  -4.114  10.286
  170    H    ASP  23           H        ASP  23   5.419  -0.980   9.703
  171    HA   ASP  23           HA       ASP  23   5.202  -0.306   6.994
  172    HB2  ASP  23           HB2      ASP  23   6.750   0.802   8.571
  173    HB3  ASP  23           HB3      ASP  23   7.727  -0.663   8.626
  174    H    GLY  24           H        GLY  24   5.950  -1.235   5.119
  175    HA2  GLY  24           HA2      GLY  24   6.534  -2.929   3.684
  176    HA3  GLY  24           HA3      GLY  24   7.668  -3.438   4.927
  177    H    GLY  25           H        GLY  25   4.245  -3.288   5.569
  178    HA2  GLY  25           HA2      GLY  25   4.137  -5.971   6.444
  179    HA3  GLY  25           HA3      GLY  25   2.752  -4.928   6.166
  180    H    HIS  26           H        HIS  26   4.348  -7.680   5.166
  181    HA   HIS  26           HA       HIS  26   3.836  -7.709   2.399
  182    HB2  HIS  26           HB2      HIS  26   5.345  -9.286   3.675
  183    HB3  HIS  26           HB3      HIS  26   3.893 -10.126   4.209
  184    HD1  HIS  26           HD1      HIS  26   6.401 -10.379   1.740
  185    HD2  HIS  26           HD2      HIS  26   2.276 -10.881   1.722
  186    HE1  HIS  26           HE1      HIS  26   5.903 -11.771  -0.294
  187    HE2  HIS  26           HE2      HIS  26   3.410 -12.133  -0.237
  188    H    VAL  27           H        VAL  27   1.982  -7.747   1.344
  189    HA   VAL  27           HA       VAL  27  -0.258  -9.294   2.387
  190    HB   VAL  27           HB       VAL  27  -1.871  -7.488   2.108
  191   HG11  VAL  27          HG11      VAL  27  -0.850  -7.855   4.310
  192   HG12  VAL  27          HG12      VAL  27  -1.284  -6.164   4.058
  193   HG13  VAL  27          HG13      VAL  27   0.399  -6.673   3.919
  194   HG21  VAL  27          HG21      VAL  27  -0.729  -6.194   0.396
  195   HG22  VAL  27          HG22      VAL  27   0.530  -5.749   1.548
  196   HG23  VAL  27          HG23      VAL  27  -1.121  -5.171   1.778
  197    H    GLU  28           H        GLU  28  -1.613 -10.087   0.821
  198    HA   GLU  28           HA       GLU  28  -0.643  -9.900  -1.903
  199    HB2  GLU  28           HB2      GLU  28  -2.081 -11.741  -2.387
  200    HB3  GLU  28           HB3      GLU  28  -1.335 -12.068  -0.829
  201    HG2  GLU  28           HG2      GLU  28  -3.725 -10.696  -0.289
  202    HG3  GLU  28           HG3      GLU  28  -4.105 -11.901  -1.519
  203    H    ALA  29           H        ALA  29  -2.130  -9.527  -3.713
  204    HA   ALA  29           HA       ALA  29  -3.363  -7.081  -3.672
  205    HB1  ALA  29           HB1      ALA  29  -4.022  -7.493  -5.819
  206    HB2  ALA  29           HB2      ALA  29  -4.527  -9.146  -5.466
  207    HB3  ALA  29           HB3      ALA  29  -2.813  -8.763  -5.628
  208    H    GLY  30           H        GLY  30  -5.261  -6.263  -3.014
  209    HA2  GLY  30           HA2      GLY  30  -7.592  -6.323  -2.599
  210    HA3  GLY  30           HA3      GLY  30  -7.503  -8.075  -2.492
  211    H    SER  31           H        SER  31  -5.100  -7.810  -0.694
  212    HA   SER  31           HA       SER  31  -6.533  -7.850   1.769
  213    HB2  SER  31           HB2      SER  31  -4.629  -9.304   1.520
  214    HB3  SER  31           HB3      SER  31  -3.572  -7.941   1.157
  215    HG   SER  31           HG       SER  31  -3.595  -8.836   3.398
  216    H    SER  32           H        SER  32  -6.977  -6.234   3.109
  217    HA   SER  32           HA       SER  32  -6.297  -3.556   2.496
  218    HB2  SER  32           HB2      SER  32  -7.158  -4.161   5.263
  219    HB3  SER  32           HB3      SER  32  -7.801  -2.992   4.111
  220    HG   SER  32           HG       SER  32  -8.606  -5.543   4.635
  221    H    TYR  33           H        TYR  33  -4.772  -2.205   3.305
  222    HA   TYR  33           HA       TYR  33  -2.784  -3.400   5.121
  223    HB2  TYR  33           HB2      TYR  33  -1.082  -2.107   4.047
  224    HB3  TYR  33           HB3      TYR  33  -2.017  -2.892   2.779
  225    HD1  TYR  33           HD1      TYR  33  -1.239   0.309   4.401
  226    HD2  TYR  33           HD2      TYR  33  -3.369  -1.598   1.251
  227    HE1  TYR  33           HE1      TYR  33  -1.614   2.495   3.341
  228    HE2  TYR  33           HE2      TYR  33  -3.750   0.583   0.181
  229    HH   TYR  33           HH       TYR  33  -3.734   2.874   0.601
  230    H    ALA  34           H        ALA  34  -5.093  -0.934   4.783
  231    HA   ALA  34           HA       ALA  34  -4.634   0.072   7.387
  232    HB1  ALA  34           HB1      ALA  34  -4.241   2.345   5.585
  233    HB2  ALA  34           HB2      ALA  34  -2.909   1.189   5.591
  234    HB3  ALA  34           HB3      ALA  34  -3.431   1.941   7.099
  235    H    GLU  35           H        GLU  35  -5.806   2.539   7.266
  236    HA   GLU  35           HA       GLU  35  -8.280   2.248   5.737
  237    HB2  GLU  35           HB2      GLU  35  -8.177   2.579   8.741
  238    HB3  GLU  35           HB3      GLU  35  -9.631   2.756   7.770
  239    HG2  GLU  35           HG2      GLU  35  -9.985   0.573   7.770
  240    HG3  GLU  35           HG3      GLU  35  -8.346   0.246   7.213
  241    H    MET  36           H        MET  36  -9.666   4.245   5.962
  242    HA   MET  36           HA       MET  36  -8.263   6.654   6.748
  243    HB2  MET  36           HB2      MET  36  -8.355   7.723   4.591
  244    HB3  MET  36           HB3      MET  36  -7.481   6.206   4.430
  245    HG2  MET  36           HG2      MET  36  -9.925   5.342   3.810
  246    HG3  MET  36           HG3      MET  36 -10.090   7.025   3.313
  247    HE1  MET  36           HE1      MET  36  -9.950   7.072   0.500
  248    HE2  MET  36           HE2      MET  36 -10.768   5.678   1.205
  249    HE3  MET  36           HE3      MET  36  -9.617   5.451  -0.111
  250    H    GLU  37           H        GLU  37  -9.679   7.926   7.727
  251    HA   GLU  37           HA       GLU  37 -12.526   7.477   7.328
  252    HB2  GLU  37           HB2      GLU  37 -11.322   7.747   9.606
  253    HB3  GLU  37           HB3      GLU  37 -11.342   9.467   9.243
  254    HG2  GLU  37           HG2      GLU  37 -13.851   9.199   8.909
  255    HG3  GLU  37           HG3      GLU  37 -13.666   7.625   9.680
  256    H    VAL  38           H        VAL  38 -13.357   8.496   5.617
  257    HA   VAL  38           HA       VAL  38 -12.426  11.164   4.895
  258    HB   VAL  38           HB       VAL  38 -14.646   9.819   3.420
  259   HG11  VAL  38          HG11      VAL  38 -13.003  10.747   1.545
  260   HG12  VAL  38          HG12      VAL  38 -12.493  11.783   2.879
  261   HG13  VAL  38          HG13      VAL  38 -14.180  11.776   2.363
  262   HG21  VAL  38          HG21      VAL  38 -12.939   8.585   2.060
  263   HG22  VAL  38          HG22      VAL  38 -13.175   7.960   3.692
  264   HG23  VAL  38          HG23      VAL  38 -11.762   8.949   3.323
  265    H    MET  39           H        MET  39 -14.263  12.698   4.136
  266    HA   MET  39           HA       MET  39 -15.743  13.472   6.372
  267    HB2  MET  39           HB2      MET  39 -16.469  14.188   3.535
  268    HB3  MET  39           HB3      MET  39 -16.728  15.140   4.991
  269    HG2  MET  39           HG2      MET  39 -13.940  14.579   4.703
  270    HG3  MET  39           HG3      MET  39 -14.567  15.252   3.199
  271    HE1  MET  39           HE1      MET  39 -14.016  17.362   7.205
  272    HE2  MET  39           HE2      MET  39 -13.020  16.081   6.515
  273    HE3  MET  39           HE3      MET  39 -14.644  15.718   7.097
  274    H    LYS  40           H        LYS  40 -16.517  11.311   3.753
  275    HA   LYS  40           HA       LYS  40 -19.337  11.235   4.294
  276    HB2  LYS  40           HB2      LYS  40 -17.474   9.677   2.534
  277    HB3  LYS  40           HB3      LYS  40 -19.109   9.096   2.815
  278    HG2  LYS  40           HG2      LYS  40 -18.521  11.866   1.813
  279    HG3  LYS  40           HG3      LYS  40 -18.751  10.483   0.741
  280    HD2  LYS  40           HD2      LYS  40 -20.984  10.152   1.541
  281    HD3  LYS  40           HD3      LYS  40 -20.762  11.357   2.810
  282    HE2  LYS  40           HE2      LYS  40 -20.590  13.117   1.173
  283    HE3  LYS  40           HE3      LYS  40 -20.638  11.946  -0.144
  284    HZ1  LYS  40           HZ1      LYS  40 -22.838  12.489   1.776
  285    HZ2  LYS  40           HZ2      LYS  40 -22.886  11.347   0.530
  286    HZ3  LYS  40           HZ3      LYS  40 -22.783  12.994   0.162
  287    H    MET  41           H        MET  41 -17.031   8.525   4.338
  288    HA   MET  41           HA       MET  41 -17.833   7.801   7.029
  289    HB2  MET  41           HB2      MET  41 -18.663   6.285   4.595
  290    HB3  MET  41           HB3      MET  41 -18.235   5.378   6.039
  291    HG2  MET  41           HG2      MET  41 -19.888   6.956   7.238
  292    HG3  MET  41           HG3      MET  41 -20.485   7.295   5.615
  293    HE1  MET  41           HE1      MET  41 -23.340   4.933   6.047
  294    HE2  MET  41           HE2      MET  41 -22.650   6.201   5.035
  295    HE3  MET  41           HE3      MET  41 -22.840   6.464   6.768
  296    H    ILE  42           H        ILE  42 -16.788   5.415   7.391
  297    HA   ILE  42           HA       ILE  42 -13.957   5.856   7.025
  298    HB   ILE  42           HB       ILE  42 -14.753   5.037   9.175
  299   HG12  ILE  42          HG12      ILE  42 -13.236   3.115   9.449
  300   HG13  ILE  42          HG13      ILE  42 -13.155   2.929   7.700
  301   HG21  ILE  42          HG21      ILE  42 -16.697   3.823   8.626
  302   HG22  ILE  42          HG22      ILE  42 -15.571   2.645   9.299
  303   HG23  ILE  42          HG23      ILE  42 -15.811   2.738   7.555
  304   HD11  ILE  42          HD11      ILE  42 -12.462   5.598   8.282
  305   HD12  ILE  42          HD12      ILE  42 -11.433   4.306   7.664
  306   HD13  ILE  42          HD13      ILE  42 -11.576   4.564   9.403
  307    H    MET  43           H        MET  43 -12.507   4.401   6.019
  308    HA   MET  43           HA       MET  43 -13.648   2.304   4.344
  309    HB2  MET  43           HB2      MET  43 -12.307   4.780   3.343
  310    HB3  MET  43           HB3      MET  43 -12.068   3.273   2.470
  311    HG2  MET  43           HG2      MET  43 -14.815   4.241   3.150
  312    HG3  MET  43           HG3      MET  43 -13.957   4.846   1.734
  313    HE1  MET  43           HE1      MET  43 -14.159   3.614  -0.611
  314    HE2  MET  43           HE2      MET  43 -13.717   1.907  -0.640
  315    HE3  MET  43           HE3      MET  43 -12.665   3.076   0.156
  316    H    THR  44           H        THR  44 -11.927   0.987   3.279
  317    HA   THR  44           HA       THR  44  -9.504   0.894   4.955
  318    HB   THR  44           HB       THR  44 -10.236  -1.635   3.692
  319    HG1  THR  44           HG1      THR  44 -12.338  -0.922   4.092
  320   HG21  THR  44          HG21      THR  44  -8.590  -1.271   5.573
  321   HG22  THR  44          HG22      THR  44  -9.748  -2.585   5.776
  322   HG23  THR  44          HG23      THR  44  -9.991  -1.058   6.622
  323    H    LEU  45           H        LEU  45  -7.604   0.959   3.927
  324    HA   LEU  45           HA       LEU  45  -7.617   1.017   1.011
  325    HB2  LEU  45           HB2      LEU  45  -5.374   1.622   2.938
  326    HB3  LEU  45           HB3      LEU  45  -5.355   1.909   1.209
  327    HG   LEU  45           HG       LEU  45  -7.521   3.361   1.861
  328   HD11  LEU  45          HD11      LEU  45  -6.056   2.901   4.358
  329   HD12  LEU  45          HD12      LEU  45  -7.718   3.429   4.093
  330   HD13  LEU  45          HD13      LEU  45  -6.398   4.594   4.004
  331   HD21  LEU  45          HD21      LEU  45  -5.785   4.306   0.586
  332   HD22  LEU  45          HD22      LEU  45  -4.613   4.118   1.890
  333   HD23  LEU  45          HD23      LEU  45  -5.901   5.314   2.028
  334    H    ASN  46           H        ASN  46  -6.660  -0.472  -0.269
  335    HA   ASN  46           HA       ASN  46  -5.084  -2.597   1.008
  336    HB2  ASN  46           HB2      ASN  46  -6.238  -4.278  -0.392
  337    HB3  ASN  46           HB3      ASN  46  -7.336  -3.481   0.731
  338   HD21  ASN  46          HD21      ASN  46  -8.530  -1.596  -0.174
  339   HD22  ASN  46          HD22      ASN  46  -9.099  -1.721  -1.801
  340    H    VAL  47           H        VAL  47  -4.125  -4.054  -0.829
  341    HA   VAL  47           HA       VAL  47  -2.734  -2.233  -2.636
  342    HB   VAL  47           HB       VAL  47  -1.229  -4.157  -3.065
  343   HG11  VAL  47          HG11      VAL  47  -1.448  -3.874  -0.099
  344   HG12  VAL  47          HG12      VAL  47  -1.064  -2.469  -1.093
  345   HG13  VAL  47          HG13      VAL  47  -0.012  -3.885  -1.122
  346   HG21  VAL  47          HG21      VAL  47  -1.618  -6.252  -2.348
  347   HG22  VAL  47          HG22      VAL  47  -3.293  -5.713  -2.223
  348   HG23  VAL  47          HG23      VAL  47  -2.256  -5.710  -0.796
  349    H    GLN  48           H        GLN  48  -2.550  -2.614  -4.878
  350    HA   GLN  48           HA       GLN  48  -4.906  -3.843  -6.032
  351    HB2  GLN  48           HB2      GLN  48  -4.333  -2.742  -8.055
  352    HB3  GLN  48           HB3      GLN  48  -4.000  -1.604  -6.759
  353    HG2  GLN  48           HG2      GLN  48  -1.833  -3.335  -7.887
  354    HG3  GLN  48           HG3      GLN  48  -2.307  -1.831  -8.672
  355   HE21  GLN  48          HE21      GLN  48  -0.523  -3.269  -6.166
  356   HE22  GLN  48          HE22      GLN  48   0.048  -1.819  -5.419
  357    H    GLU  49           H        GLU  49  -1.742  -4.814  -5.337
  358    HA   GLU  49           HA       GLU  49  -2.132  -7.278  -6.801
  359    HB2  GLU  49           HB2      GLU  49  -0.110  -5.238  -7.581
  360    HB3  GLU  49           HB3      GLU  49   0.386  -6.925  -7.615
  361    HG2  GLU  49           HG2      GLU  49  -1.551  -7.412  -9.081
  362    HG3  GLU  49           HG3      GLU  49  -1.905  -5.686  -9.121
  363    H    ARG  50           H        ARG  50  -0.233  -8.799  -6.378
  364    HA   ARG  50           HA       ARG  50   0.139  -8.990  -3.573
  365    HB2  ARG  50           HB2      ARG  50   1.051 -10.544  -5.952
  366    HB3  ARG  50           HB3      ARG  50   1.862 -10.816  -4.416
  367    HG2  ARG  50           HG2      ARG  50   0.226 -12.412  -4.340
  368    HG3  ARG  50           HG3      ARG  50  -0.575 -11.076  -3.511
  369    HD2  ARG  50           HD2      ARG  50  -2.230 -11.608  -4.972
  370    HD3  ARG  50           HD3      ARG  50  -1.319 -10.501  -5.999
  371    HE   ARG  50           HE       ARG  50  -0.854 -12.255  -7.375
  372   HH11  ARG  50          HH11      ARG  50  -1.721 -13.526  -4.243
  373   HH12  ARG  50          HH12      ARG  50  -1.683 -15.177  -4.764
  374   HH21  ARG  50          HH21      ARG  50  -0.803 -14.426  -8.062
  375   HH22  ARG  50          HH22      ARG  50  -1.162 -15.688  -6.931
  376    H    GLY  51           H        GLY  51   1.722  -8.252  -2.300
  377    HA2  GLY  51           HA2      GLY  51   4.405  -8.035  -2.831
  378    HA3  GLY  51           HA3      GLY  51   3.724  -6.513  -3.384
  379    H    ARG  52           H        ARG  52   5.487  -6.146  -1.520
  380    HA   ARG  52           HA       ARG  52   4.220  -6.221   1.102
  381    HB2  ARG  52           HB2      ARG  52   6.994  -5.701   0.111
  382    HB3  ARG  52           HB3      ARG  52   6.524  -5.139   1.711
  383    HG2  ARG  52           HG2      ARG  52   5.668  -7.615   1.951
  384    HG3  ARG  52           HG3      ARG  52   6.876  -7.905   0.698
  385    HD2  ARG  52           HD2      ARG  52   8.308  -6.372   2.361
  386    HD3  ARG  52           HD3      ARG  52   7.210  -7.115   3.523
  387    HE   ARG  52           HE       ARG  52   8.207  -9.152   1.923
  388   HH11  ARG  52          HH11      ARG  52   9.438  -6.821   4.210
  389   HH12  ARG  52          HH12      ARG  52  10.750  -7.829   4.721
  390   HH21  ARG  52          HH21      ARG  52   9.932 -10.479   2.593
  391   HH22  ARG  52          HH22      ARG  52  11.032  -9.905   3.803
  392    H    VAL  53           H        VAL  53   3.321  -4.533   2.062
  393    HA   VAL  53           HA       VAL  53   3.128  -2.032   0.619
  394    HB   VAL  53           HB       VAL  53   1.932  -2.751   3.298
  395   HG11  VAL  53          HG11      VAL  53   1.816  -0.435   3.143
  396   HG12  VAL  53          HG12      VAL  53   0.263  -0.953   2.486
  397   HG13  VAL  53          HG13      VAL  53   1.562  -0.465   1.398
  398   HG21  VAL  53          HG21      VAL  53   0.216  -3.793   2.285
  399   HG22  VAL  53          HG22      VAL  53   1.368  -4.016   0.968
  400   HG23  VAL  53          HG23      VAL  53   0.215  -2.683   0.915
  401    H    LYS  54           H        LYS  54   4.430  -0.361   0.910
  402    HA   LYS  54           HA       LYS  54   5.911  -0.154   3.449
  403    HB2  LYS  54           HB2      LYS  54   6.684   0.426   0.618
  404    HB3  LYS  54           HB3      LYS  54   7.432   1.353   1.912
  405    HG2  LYS  54           HG2      LYS  54   8.142  -0.782   2.957
  406    HG3  LYS  54           HG3      LYS  54   7.507  -1.633   1.547
  407    HD2  LYS  54           HD2      LYS  54   9.030  -0.236   0.130
  408    HD3  LYS  54           HD3      LYS  54   9.752   0.379   1.619
  409    HE2  LYS  54           HE2      LYS  54  11.182  -1.348   1.133
  410    HE3  LYS  54           HE3      LYS  54  10.019  -2.168   2.175
  411    HZ1  LYS  54           HZ1      LYS  54  10.567  -3.410   0.132
  412    HZ2  LYS  54           HZ2      LYS  54   9.891  -2.164  -0.791
  413    HZ3  LYS  54           HZ3      LYS  54   8.917  -3.058   0.265
  414    H    TYR  55           H        TYR  55   4.808   1.247   4.672
  415    HA   TYR  55           HA       TYR  55   3.153   3.302   3.794
  416    HB2  TYR  55           HB2      TYR  55   4.512   2.672   6.375
  417    HB3  TYR  55           HB3      TYR  55   3.753   4.250   6.189
  418    HD1  TYR  55           HD2      TYR  55   2.659   0.932   4.900
  419    HD2  TYR  55           HD1      TYR  55   1.857   4.170   7.539
  420    HE1  TYR  55           HE2      TYR  55   0.476  -0.061   5.445
  421    HE2  TYR  55           HE1      TYR  55  -0.328   3.187   8.092
  422    HH   TYR  55           HH       TYR  55  -1.164   0.025   7.339
  423    H    ILE  56           H        ILE  56   3.442   5.345   3.165
  424    HA   ILE  56           HA       ILE  56   6.192   6.382   3.104
  425    HB   ILE  56           HB       ILE  56   3.890   6.638   1.239
  426   HG12  ILE  56          HG12      ILE  56   5.633   6.443  -0.440
  427   HG13  ILE  56          HG13      ILE  56   6.880   6.637   0.787
  428   HG21  ILE  56          HG21      ILE  56   5.020   8.679   0.224
  429   HG22  ILE  56          HG22      ILE  56   5.838   8.861   1.776
  430   HG23  ILE  56          HG23      ILE  56   4.078   8.937   1.692
  431   HD11  ILE  56          HD11      ILE  56   4.971   4.328   0.526
  432   HD12  ILE  56          HD12      ILE  56   6.159   4.527   1.815
  433   HD13  ILE  56          HD13      ILE  56   6.693   4.326   0.147
  434    H    LYS  57           H        LYS  57   2.864   7.607   3.314
  435    HA   LYS  57           HA       LYS  57   3.644  10.047   4.559
  436    HB2  LYS  57           HB2      LYS  57   1.194   8.769   3.633
  437    HB3  LYS  57           HB3      LYS  57   0.950   9.712   5.099
  438    HG2  LYS  57           HG2      LYS  57   2.161  10.726   2.533
  439    HG3  LYS  57           HG3      LYS  57   0.514  11.027   3.091
  440    HD2  LYS  57           HD2      LYS  57   1.170  12.578   4.598
  441    HD3  LYS  57           HD3      LYS  57   2.654  11.712   4.999
  442    HE2  LYS  57           HE2      LYS  57   3.090  13.875   3.904
  443    HE3  LYS  57           HE3      LYS  57   3.711  12.510   2.976
  444    HZ1  LYS  57           HZ1      LYS  57   1.592  12.642   1.665
  445    HZ2  LYS  57           HZ2      LYS  57   2.654  13.941   1.453
  446    HZ3  LYS  57           HZ3      LYS  57   1.284  14.120   2.430
  447    H    ARG  58           H        ARG  58   2.808  10.737   6.707
  448    HA   ARG  58           HA       ARG  58   3.372   8.659   8.673
  449    HB2  ARG  58           HB2      ARG  58   3.464  11.624   8.631
  450    HB3  ARG  58           HB3      ARG  58   3.073  10.872  10.171
  451    HG2  ARG  58           HG2      ARG  58   5.377  11.118  10.247
  452    HG3  ARG  58           HG3      ARG  58   5.158   9.432   9.772
  453    HD2  ARG  58           HD2      ARG  58   6.893  10.492   8.431
  454    HD3  ARG  58           HD3      ARG  58   5.511  10.046   7.431
  455    HE   ARG  58           HE       ARG  58   5.428  12.757   8.388
  456   HH11  ARG  58          HH11      ARG  58   6.596  10.642   5.869
  457   HH12  ARG  58          HH12      ARG  58   6.726  11.908   4.695
  458   HH21  ARG  58          HH21      ARG  58   5.598  14.422   6.845
  459   HH22  ARG  58          HH22      ARG  58   6.160  14.054   5.249
  460    HA   PRO  59           HA       PRO  59  -0.732   8.113  10.167
  461    HB2  PRO  59           HB2      PRO  59  -0.462   8.316  12.881
  462    HB3  PRO  59           HB3      PRO  59   0.043   6.901  11.950
  463    HG2  PRO  59           HG2      PRO  59   1.687   9.182  12.976
  464    HG3  PRO  59           HG3      PRO  59   2.057   7.447  12.971
  465    HD2  PRO  59           HD2      PRO  59   3.109   9.137  11.155
  466    HD3  PRO  59           HD3      PRO  59   2.689   7.460  10.747
  467    H    GLY  60           H        GLY  60  -2.508   9.347  10.369
  468    HA2  GLY  60           HA2      GLY  60  -3.836  11.082  11.250
  469    HA3  GLY  60           HA3      GLY  60  -2.380  11.865  11.843
  470    H    ALA  61           H        ALA  61  -1.118  11.464   9.127
  471    HA   ALA  61           HA       ALA  61  -1.594  13.990   8.069
  472    HB1  ALA  61           HB1      ALA  61   0.410  12.637   7.605
  473    HB2  ALA  61           HB2      ALA  61  -0.334  13.266   6.135
  474    HB3  ALA  61           HB3      ALA  61  -0.563  11.576   6.585
  475    H    VAL  62           H        VAL  62  -2.887  14.798   6.477
  476    HA   VAL  62           HA       VAL  62  -5.296  13.341   5.890
  477    HB   VAL  62           HB       VAL  62  -4.445  16.003   4.750
  478   HG11  VAL  62          HG11      VAL  62  -7.198  14.863   5.201
  479   HG12  VAL  62          HG12      VAL  62  -6.347  14.839   3.657
  480   HG13  VAL  62          HG13      VAL  62  -6.792  16.378   4.395
  481   HG21  VAL  62          HG21      VAL  62  -4.322  16.098   7.179
  482   HG22  VAL  62          HG22      VAL  62  -5.950  15.432   7.302
  483   HG23  VAL  62          HG23      VAL  62  -5.701  17.027   6.593
  484    H    LEU  63           H        LEU  63  -5.699  12.134   4.154
  485    HA   LEU  63           HA       LEU  63  -3.684  11.872   2.099
  486    HB2  LEU  63           HB2      LEU  63  -6.353  10.503   2.073
  487    HB3  LEU  63           HB3      LEU  63  -4.831   9.952   1.398
  488    HG   LEU  63           HG       LEU  63  -5.461  10.135   4.346
  489   HD11  LEU  63          HD11      LEU  63  -5.337   7.632   4.188
  490   HD12  LEU  63          HD12      LEU  63  -5.399   7.813   2.435
  491   HD13  LEU  63          HD13      LEU  63  -6.748   8.367   3.426
  492   HD21  LEU  63          HD21      LEU  63  -3.032  10.406   3.446
  493   HD22  LEU  63          HD22      LEU  63  -3.144   8.669   3.164
  494   HD23  LEU  63          HD23      LEU  63  -3.353   9.314   4.792
  495    H    GLU  64           H        GLU  64  -3.865  12.429  -0.035
  496    HA   GLU  64           HA       GLU  64  -6.242  13.996  -0.784
  497    HB2  GLU  64           HB2      GLU  64  -4.635  15.647  -0.684
  498    HB3  GLU  64           HB3      GLU  64  -3.330  14.555  -1.122
  499    HG2  GLU  64           HG2      GLU  64  -3.912  14.630  -3.411
  500    HG3  GLU  64           HG3      GLU  64  -5.442  15.435  -3.066
  501    H    ALA  65           H        ALA  65  -6.802  13.974  -3.042
  502    HA   ALA  65           HA       ALA  65  -6.783  11.404  -4.175
  503    HB1  ALA  65           HB1      ALA  65  -7.307  13.905  -5.750
  504    HB2  ALA  65           HB2      ALA  65  -8.449  13.304  -4.548
  505    HB3  ALA  65           HB3      ALA  65  -8.028  12.308  -5.941
  506    H    GLY  66           H        GLY  66  -5.012  10.420  -4.917
  507    HA2  GLY  66           HA2      GLY  66  -3.508  10.149  -6.771
  508    HA3  GLY  66           HA3      GLY  66  -3.330  11.896  -6.830
  509    H    CYS  67           H        CYS  67  -3.125  11.778  -3.762
  510    HA   CYS  67           HA       CYS  67  -0.312  11.866  -3.629
  511    HB2  CYS  67           HB2      CYS  67  -2.145  12.922  -2.078
  512    HB3  CYS  67           HB3      CYS  67  -1.987  11.412  -1.186
  513    HG   CYS  67           HG       CYS  67   0.232  13.560  -1.439
  514    H    VAL  68           H        VAL  68   1.174  10.474  -2.650
  515    HA   VAL  68           HA       VAL  68   0.532   7.675  -2.923
  516    HB   VAL  68           HB       VAL  68   3.120   8.882  -1.947
  517   HG11  VAL  68          HG11      VAL  68   4.109   6.795  -2.687
  518   HG12  VAL  68          HG12      VAL  68   2.537   6.223  -3.247
  519   HG13  VAL  68          HG13      VAL  68   2.821   6.477  -1.525
  520   HG21  VAL  68          HG21      VAL  68   3.778   8.419  -4.409
  521   HG22  VAL  68          HG22      VAL  68   2.879   9.887  -4.024
  522   HG23  VAL  68          HG23      VAL  68   2.042   8.495  -4.713
  523    H    VAL  69           H        VAL  69  -0.659   6.833  -1.321
  524    HA   VAL  69           HA       VAL  69  -0.283   7.617   1.431
  525    HB   VAL  69           HB       VAL  69  -2.002   5.787   1.857
  526   HG11  VAL  69          HG11      VAL  69  -3.614   7.343   1.658
  527   HG12  VAL  69          HG12      VAL  69  -3.275   7.626  -0.050
  528   HG13  VAL  69          HG13      VAL  69  -2.278   8.394   1.186
  529   HG21  VAL  69          HG21      VAL  69  -3.187   4.842   0.043
  530   HG22  VAL  69          HG22      VAL  69  -1.477   4.614  -0.324
  531   HG23  VAL  69          HG23      VAL  69  -2.388   5.894  -1.125
  532    H    ALA  70           H        ALA  70   0.823   5.084  -0.662
  533    HA   ALA  70           HA       ALA  70   2.610   4.108   1.350
  534    HB1  ALA  70           HB1      ALA  70   0.904   1.906   0.382
  535    HB2  ALA  70           HB2      ALA  70   0.177   2.994   1.566
  536    HB3  ALA  70           HB3      ALA  70   1.673   2.142   1.952
  537    H    ARG  71           H        ARG  71   3.204   1.625   0.298
  538    HA   ARG  71           HA       ARG  71   3.762   2.062  -2.541
  539    HB2  ARG  71           HB2      ARG  71   5.743   1.906  -0.344
  540    HB3  ARG  71           HB3      ARG  71   6.115   0.968  -1.785
  541    HG2  ARG  71           HG2      ARG  71   5.325   3.836  -2.039
  542    HG3  ARG  71           HG3      ARG  71   6.971   3.405  -1.570
  543    HD2  ARG  71           HD2      ARG  71   5.877   1.945  -3.882
  544    HD3  ARG  71           HD3      ARG  71   6.141   3.670  -4.128
  545    HE   ARG  71           HE       ARG  71   8.125   1.672  -4.041
  546   HH11  ARG  71          HH11      ARG  71   7.516   4.929  -2.943
  547   HH12  ARG  71          HH12      ARG  71   9.191   5.370  -2.929
  548   HH21  ARG  71          HH21      ARG  71  10.327   2.250  -4.022
  549   HH22  ARG  71          HH22      ARG  71  10.787   3.850  -3.542
  550    H    LEU  72           H        LEU  72   5.023  -0.054  -3.334
  551    HA   LEU  72           HA       LEU  72   3.914  -2.425  -2.040
  552    HB2  LEU  72           HB2      LEU  72   2.905  -1.252  -4.457
  553    HB3  LEU  72           HB3      LEU  72   3.587  -2.826  -4.815
  554    HG   LEU  72           HG       LEU  72   1.214  -3.014  -4.361
  555   HD11  LEU  72          HD11      LEU  72   2.626  -4.880  -3.718
  556   HD12  LEU  72          HD12      LEU  72   1.287  -4.700  -2.583
  557   HD13  LEU  72          HD13      LEU  72   2.902  -4.148  -2.137
  558   HD21  LEU  72          HD21      LEU  72   1.434  -2.363  -1.506
  559   HD22  LEU  72          HD22      LEU  72   0.132  -2.039  -2.650
  560   HD23  LEU  72          HD23      LEU  72   1.545  -0.985  -2.601
  561    H    GLU  73           H        GLU  73   4.818  -4.442  -2.908
  562    HA   GLU  73           HA       GLU  73   7.337  -4.153  -4.361
  563    HB2  GLU  73           HB2      GLU  73   7.459  -4.211  -1.674
  564    HB3  GLU  73           HB3      GLU  73   7.431  -5.940  -1.994
  565    HG2  GLU  73           HG2      GLU  73   9.318  -5.357  -3.702
  566    HG3  GLU  73           HG3      GLU  73   9.491  -3.912  -2.708
  567    H    LEU  74           H        LEU  74   6.279  -5.210  -6.069
  568    HA   LEU  74           HA       LEU  74   4.880  -7.632  -5.846
  569    HB2  LEU  74           HB2      LEU  74   6.405  -6.508  -8.195
  570    HB3  LEU  74           HB3      LEU  74   5.279  -7.849  -8.281
  571    HG   LEU  74           HG       LEU  74   4.545  -5.040  -7.451
  572   HD11  LEU  74          HD11      LEU  74   4.082  -6.485 -10.057
  573   HD12  LEU  74          HD12      LEU  74   5.183  -5.131  -9.800
  574   HD13  LEU  74          HD13      LEU  74   3.443  -4.898  -9.628
  575   HD21  LEU  74          HD21      LEU  74   2.240  -6.222  -8.156
  576   HD22  LEU  74          HD22      LEU  74   2.854  -6.199  -6.503
  577   HD23  LEU  74          HD23      LEU  74   3.110  -7.618  -7.518
  578    H    ASP  75           H        ASP  75   5.677  -9.448  -5.049
  579    HA   ASP  75           HA       ASP  75   8.463 -10.086  -5.090
  580    HB2  ASP  75           HB2      ASP  75   6.883 -10.764  -3.266
  581    HB3  ASP  75           HB3      ASP  75   6.146 -11.901  -4.391
  582    H    ASP  76           H        ASP  76   8.382  -9.793  -7.562
  583    HA   ASP  76           HA       ASP  76   7.329 -11.973  -9.096
  584    HB2  ASP  76           HB2      ASP  76   8.639 -10.916 -10.966
  585    HB3  ASP  76           HB3      ASP  76   7.492  -9.839 -10.175
  586    H    LEU  77           H        LEU  77   8.176 -13.937  -9.024
  587    HA   LEU  77           HA       LEU  77  10.962 -14.340  -8.335
  588    HB2  LEU  77           HB2      LEU  77   8.737 -15.746  -7.759
  589    HB3  LEU  77           HB3      LEU  77   9.286 -16.627  -9.171
  590    HG   LEU  77           HG       LEU  77  11.549 -16.793  -7.977
  591   HD11  LEU  77          HD11      LEU  77   9.789 -15.958  -5.680
  592   HD12  LEU  77          HD12      LEU  77  11.236 -15.141  -6.271
  593   HD13  LEU  77          HD13      LEU  77  11.368 -16.722  -5.500
  594   HD21  LEU  77          HD21      LEU  77   9.985 -18.666  -8.286
  595   HD22  LEU  77          HD22      LEU  77   9.174 -18.219  -6.785
  596   HD23  LEU  77          HD23      LEU  77  10.851 -18.765  -6.754
  597    H    GLU  78           H        GLU  78  11.206 -13.034 -10.531
  598    HA   GLU  78           HA       GLU  78  11.031 -14.565 -12.934
  599    HB2  GLU  78           HB2      GLU  78  12.275 -12.715 -13.958
  600    HB3  GLU  78           HB3      GLU  78  10.936 -12.125 -12.983
  601    HG2  GLU  78           HG2      GLU  78  12.467 -11.569 -11.181
  602    HG3  GLU  78           HG3      GLU  78  13.818 -12.208 -12.116
  603    H    HIS  79           H        HIS  79  13.453 -14.093 -10.480
  604    HA   HIS  79           HA       HIS  79  15.676 -15.037 -11.975
  605    HB2  HIS  79           HB2      HIS  79  15.475 -13.760  -9.635
  606    HB3  HIS  79           HB3      HIS  79  15.611 -15.405  -9.024
  607    HD1  HIS  79           HD1      HIS  79  17.942 -15.975  -8.475
  608    HD2  HIS  79           HD2      HIS  79  17.722 -13.359 -11.697
  609    HE1  HIS  79           HE1      HIS  79  20.325 -15.541  -9.153
  610    HE2  HIS  79           HE2      HIS  79  20.170 -13.891 -11.050
  611    H    HIS  80           H        HIS  80  16.914 -17.019 -10.829
  612    HA   HIS  80           HA       HIS  80  15.030 -19.280 -10.952
  613    HB2  HIS  80           HB2      HIS  80  17.978 -19.251 -11.637
  614    HB3  HIS  80           HB3      HIS  80  16.898 -20.635 -11.776
  615    HD1  HIS  80           HD1      HIS  80  18.404 -18.191 -13.815
  616    HD2  HIS  80           HD2      HIS  80  14.587 -19.821 -13.625
  617    HE1  HIS  80           HE1      HIS  80  17.365 -17.734 -16.059
  618    HE2  HIS  80           HE2      HIS  80  15.026 -18.653 -15.890
  619    H    HIS  81           H        HIS  81  15.338 -21.044  -9.540
  620    HA   HIS  81           HA       HIS  81  17.105 -20.524  -7.245
  621    HB2  HIS  81           HB2      HIS  81  15.370 -21.356  -5.731
  622    HB3  HIS  81           HB3      HIS  81  14.792 -19.957  -6.631
  623    HD1  HIS  81           HD1      HIS  81  14.364 -23.689  -6.401
  624    HD2  HIS  81           HD2      HIS  81  12.593 -20.414  -8.246
  625    HE1  HIS  81           HE1      HIS  81  12.210 -24.548  -7.371
  626    HE2  HIS  81           HE2      HIS  81  11.196 -22.569  -8.555
  627    H    HIS  82           H        HIS  82  16.830 -22.719  -5.775
  628    HA   HIS  82           HA       HIS  82  17.174 -25.018  -7.566
  629    HB2  HIS  82           HB2      HIS  82  19.062 -24.454  -5.280
  630    HB3  HIS  82           HB3      HIS  82  19.216 -25.689  -6.525
  631    HD1  HIS  82           HD1      HIS  82  19.776 -22.059  -5.882
  632    HD2  HIS  82           HD2      HIS  82  20.197 -24.776  -8.998
  633    HE1  HIS  82           HE1      HIS  82  21.157 -20.879  -7.620
  634    HE2  HIS  82           HE2      HIS  82  21.472 -22.573  -9.458
  635    H    HIS  83           H        HIS  83  16.806 -27.058  -6.603
  636    HA   HIS  83           HA       HIS  83  15.078 -26.911  -4.250
  637    HB2  HIS  83           HB2      HIS  83  14.252 -28.007  -6.341
  638    HB3  HIS  83           HB3      HIS  83  15.497 -29.235  -6.136
  639    HD1  HIS  83           HD1      HIS  83  15.136 -30.995  -4.289
  640    HD2  HIS  83           HD2      HIS  83  12.073 -28.202  -4.582
  641    HE1  HIS  83           HE1      HIS  83  13.250 -31.918  -2.905
  642    HE2  HIS  83           HE2      HIS  83  11.377 -30.254  -3.170
  643    H    HIS  84           H        HIS  84  18.154 -28.086  -5.268
  644    HA   HIS  84           HA       HIS  84  18.435 -29.705  -2.840
  645    HB2  HIS  84           HB2      HIS  84  19.071 -30.550  -5.200
  646    HB3  HIS  84           HB3      HIS  84  20.483 -29.511  -5.036
  647    HD1  HIS  84           HD1      HIS  84  18.878 -32.544  -3.466
  648    HD2  HIS  84           HD2      HIS  84  22.511 -30.529  -3.479
  649    HE1  HIS  84           HE1      HIS  84  20.481 -34.043  -2.239
  650    HE2  HIS  84           HE2      HIS  84  22.694 -32.842  -2.336
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1   6.285   6.750 -14.115
    2    H2   MET   1           H2       MET   1   6.934   7.369 -15.576
    3    H3   MET   1           H3       MET   1   7.509   7.952 -14.068
    4    HA   MET   1           HA       MET   1   6.121   9.589 -14.823
    5    HB2  MET   1           HB2      MET   1   3.912   9.123 -15.757
    6    HB3  MET   1           HB3      MET   1   5.152   8.245 -16.642
    7    HG2  MET   1           HG2      MET   1   4.533   6.194 -15.698
    8    HG3  MET   1           HG3      MET   1   3.591   6.969 -14.425
    9    HE1  MET   1           HE1      MET   1   1.927   5.160 -18.052
   10    HE2  MET   1           HE2      MET   1   2.667   4.524 -16.583
   11    HE3  MET   1           HE3      MET   1   3.660   5.348 -17.785
   12    H    GLU   2           H        GLU   2   6.641   8.274 -12.301
   13    HA   GLU   2           HA       GLU   2   5.936   8.313 -10.140
   14    HB2  GLU   2           HB2      GLU   2   3.716  10.141 -11.041
   15    HB3  GLU   2           HB3      GLU   2   4.486  10.070  -9.462
   16    HG2  GLU   2           HG2      GLU   2   5.543  11.895 -10.260
   17    HG3  GLU   2           HG3      GLU   2   6.626  10.670 -10.921
   18    H    ASN   3           H        ASN   3   5.152   6.094 -11.387
   19    HA   ASN   3           HA       ASN   3   2.815   5.332  -9.940
   20    HB2  ASN   3           HB2      ASN   3   1.903   6.489 -12.027
   21    HB3  ASN   3           HB3      ASN   3   2.563   5.135 -12.940
   22   HD21  ASN   3          HD21      ASN   3   0.556   5.762 -10.082
   23   HD22  ASN   3          HD22      ASN   3  -0.578   4.495 -10.391
   24    H    ASP   4           H        ASP   4   3.037   3.267  -9.374
   25    HA   ASP   4           HA       ASP   4   4.158   1.304 -11.156
   26    HB2  ASP   4           HB2      ASP   4   5.763   2.504  -8.978
   27    HB3  ASP   4           HB3      ASP   4   5.809   0.747  -9.084
   28    HA   PRO   5           HA       PRO   5   1.574  -1.313  -8.722
   29    HB2  PRO   5           HB2      PRO   5   2.697  -3.733  -9.118
   30    HB3  PRO   5           HB3      PRO   5   1.854  -2.864 -10.406
   31    HG2  PRO   5           HG2      PRO   5   4.792  -3.083  -9.877
   32    HG3  PRO   5           HG3      PRO   5   3.922  -3.189 -11.419
   33    HD2  PRO   5           HD2      PRO   5   5.206  -0.937 -10.583
   34    HD3  PRO   5           HD3      PRO   5   3.778  -0.906 -11.636
   35    H    THR   6           H        THR   6   4.967  -1.128  -8.032
   36    HA   THR   6           HA       THR   6   4.729  -2.637  -5.558
   37    HB   THR   6           HB       THR   6   7.146  -2.212  -5.333
   38    HG1  THR   6           HG1      THR   6   6.935  -0.870  -7.817
   39   HG21  THR   6          HG21      THR   6   7.827  -3.163  -7.670
   40   HG22  THR   6          HG22      THR   6   6.086  -3.379  -7.849
   41   HG23  THR   6          HG23      THR   6   6.938  -4.151  -6.511
   42    H    VAL   7           H        VAL   7   3.089  -0.386  -5.562
   43    HA   VAL   7           HA       VAL   7   4.230   1.079  -3.337
   44    HB   VAL   7           HB       VAL   7   3.632   3.267  -4.211
   45   HG11  VAL   7          HG11      VAL   7   5.542   3.576  -5.465
   46   HG12  VAL   7          HG12      VAL   7   5.343   2.057  -6.338
   47   HG13  VAL   7          HG13      VAL   7   5.899   2.046  -4.665
   48   HG21  VAL   7          HG21      VAL   7   3.398   2.734  -6.967
   49   HG22  VAL   7          HG22      VAL   7   2.193   3.422  -5.879
   50   HG23  VAL   7          HG23      VAL   7   2.268   1.678  -6.123
   51    H    LEU   8           H        LEU   8   2.463   2.793  -2.600
   52    HA   LEU   8           HA       LEU   8  -0.239   1.780  -2.951
   53    HB2  LEU   8           HB2      LEU   8   1.264   0.846  -0.836
   54    HB3  LEU   8           HB3      LEU   8   0.381   2.181  -0.120
   55    HG   LEU   8           HG       LEU   8  -0.879   0.187   0.250
   56   HD11  LEU   8          HD11      LEU   8  -2.927   0.935  -0.419
   57   HD12  LEU   8          HD12      LEU   8  -2.382   1.307  -2.055
   58   HD13  LEU   8          HD13      LEU   8  -1.970   2.385  -0.721
   59   HD21  LEU   8          HD21      LEU   8  -1.275  -0.388  -2.629
   60   HD22  LEU   8          HD22      LEU   8  -1.236  -1.483  -1.247
   61   HD23  LEU   8          HD23      LEU   8   0.269  -0.850  -1.914
   62    H    ARG   9           H        ARG   9  -1.781   3.334  -2.681
   63    HA   ARG   9           HA       ARG   9  -1.103   5.843  -1.379
   64    HB2  ARG   9           HB2      ARG   9  -2.115   5.907  -4.215
   65    HB3  ARG   9           HB3      ARG   9  -1.492   7.241  -3.254
   66    HG2  ARG   9           HG2      ARG   9   0.729   6.000  -3.261
   67    HG3  ARG   9           HG3      ARG   9   0.028   4.991  -4.528
   68    HD2  ARG   9           HD2      ARG   9  -0.523   7.211  -5.702
   69    HD3  ARG   9           HD3      ARG   9   0.628   7.931  -4.576
   70    HE   ARG   9           HE       ARG   9   1.663   5.651  -5.987
   71   HH11  ARG   9          HH11      ARG   9   1.174   9.104  -6.100
   72   HH12  ARG   9          HH12      ARG   9   2.464   9.376  -7.223
   73   HH21  ARG   9          HH21      ARG   9   3.360   6.006  -7.465
   74   HH22  ARG   9          HH22      ARG   9   3.704   7.617  -7.999
   75    H    SER  10           H        SER  10  -2.878   7.033  -0.718
   76    HA   SER  10           HA       SER  10  -5.270   5.569  -0.296
   77    HB2  SER  10           HB2      SER  10  -4.311   8.321   0.339
   78    HB3  SER  10           HB3      SER  10  -6.047   8.018   0.409
   79    HG   SER  10           HG       SER  10  -5.548   7.333   2.345
   80    HA   PRO  11           HA       PRO  11  -7.516   6.598  -3.965
   81    HB2  PRO  11           HB2      PRO  11 -10.046   6.199  -3.103
   82    HB3  PRO  11           HB3      PRO  11  -8.920   4.865  -3.385
   83    HG2  PRO  11           HG2      PRO  11  -9.682   6.188  -0.810
   84    HG3  PRO  11           HG3      PRO  11  -9.485   4.462  -1.165
   85    HD2  PRO  11           HD2      PRO  11  -7.576   5.941   0.081
   86    HD3  PRO  11           HD3      PRO  11  -7.196   4.552  -0.957
   87    H    SER  12           H        SER  12  -8.231   8.197  -0.932
   88    HA   SER  12           HA       SER  12  -8.735  10.677  -2.336
   89    HB2  SER  12           HB2      SER  12 -10.877   9.139  -0.969
   90    HB3  SER  12           HB3      SER  12 -10.845  10.879  -0.684
   91    HG   SER  12           HG       SER  12 -11.649  11.132  -2.596
   92    H    ALA  13           H        ALA  13  -9.369  12.407  -0.537
   93    HA   ALA  13           HA       ALA  13  -7.157  12.423   1.285
   94    HB1  ALA  13           HB1      ALA  13  -7.628  14.522   0.406
   95    HB2  ALA  13           HB2      ALA  13  -8.303  14.611   2.033
   96    HB3  ALA  13           HB3      ALA  13  -9.365  14.344   0.651
   97    H    GLY  14           H        GLY  14  -7.191  11.294   3.116
   98    HA2  GLY  14           HA2      GLY  14  -9.627  11.426   4.772
   99    HA3  GLY  14           HA3      GLY  14  -8.826   9.887   4.495
  100    H    LYS  15           H        LYS  15  -8.008   9.341   6.423
  101    HA   LYS  15           HA       LYS  15  -5.819  10.859   7.480
  102    HB2  LYS  15           HB2      LYS  15  -7.693  12.085   8.482
  103    HB3  LYS  15           HB3      LYS  15  -8.324  10.586   9.152
  104    HG2  LYS  15           HG2      LYS  15  -5.550  11.111   9.887
  105    HG3  LYS  15           HG3      LYS  15  -6.680  12.346  10.444
  106    HD2  LYS  15           HD2      LYS  15  -7.253   9.429  10.843
  107    HD3  LYS  15           HD3      LYS  15  -6.221  10.316  11.967
  108    HE2  LYS  15           HE2      LYS  15  -8.213  12.022  11.958
  109    HE3  LYS  15           HE3      LYS  15  -9.137  10.622  11.413
  110    HZ1  LYS  15           HZ1      LYS  15  -9.125  10.950  13.856
  111    HZ2  LYS  15           HZ2      LYS  15  -7.462  10.644  13.862
  112    HZ3  LYS  15           HZ3      LYS  15  -8.541   9.437  13.375
  113    H    LEU  16           H        LEU  16  -4.421   9.572   8.560
  114    HA   LEU  16           HA       LEU  16  -4.809   6.763   8.493
  115    HB2  LEU  16           HB2      LEU  16  -2.627   8.271   8.488
  116    HB3  LEU  16           HB3      LEU  16  -2.708   7.989  10.214
  117    HG   LEU  16           HG       LEU  16  -2.525   5.604   9.898
  118   HD11  LEU  16          HD11      LEU  16  -3.743   5.159   7.945
  119   HD12  LEU  16          HD12      LEU  16  -2.073   4.767   7.535
  120   HD13  LEU  16          HD13      LEU  16  -2.782   6.286   6.986
  121   HD21  LEU  16          HD21      LEU  16  -0.294   5.570   9.474
  122   HD22  LEU  16          HD22      LEU  16  -0.510   7.315   9.612
  123   HD23  LEU  16          HD23      LEU  16  -0.441   6.558   8.020
  124    H    THR  17           H        THR  17  -6.434   6.000   9.755
  125    HA   THR  17           HA       THR  17  -6.885   6.938  12.422
  126    HB   THR  17           HB       THR  17  -8.704   6.097  10.962
  127    HG1  THR  17           HG1      THR  17  -9.710   5.613  12.723
  128   HG21  THR  17          HG21      THR  17  -7.868   3.304  11.580
  129   HG22  THR  17          HG22      THR  17  -7.276   4.113  10.130
  130   HG23  THR  17          HG23      THR  17  -9.009   3.896  10.374
  131    H    GLN  18           H        GLN  18  -5.510   3.975  11.016
  132    HA   GLN  18           HA       GLN  18  -3.799   3.591  13.262
  133    HB2  GLN  18           HB2      GLN  18  -6.309   2.662  13.732
  134    HB3  GLN  18           HB3      GLN  18  -5.565   1.238  13.017
  135    HG2  GLN  18           HG2      GLN  18  -3.649   1.849  14.751
  136    HG3  GLN  18           HG3      GLN  18  -5.013   2.580  15.595
  137   HE21  GLN  18          HE21      GLN  18  -3.263   0.111  15.984
  138   HE22  GLN  18          HE22      GLN  18  -4.402  -1.151  16.292
  139    H    TYR  19           H        TYR  19  -3.404   0.801  13.000
  140    HA   TYR  19           HA       TYR  19  -2.881   0.289  10.189
  141    HB2  TYR  19           HB2      TYR  19  -0.468  -0.237  10.682
  142    HB3  TYR  19           HB3      TYR  19  -0.878   1.474  10.740
  143    HD1  TYR  19           HD1      TYR  19  -0.360  -1.507  12.903
  144    HD2  TYR  19           HD2      TYR  19  -0.396   2.740  12.648
  145    HE1  TYR  19           HE1      TYR  19   0.578  -1.368  15.172
  146    HE2  TYR  19           HE2      TYR  19   0.543   2.890  14.916
  147    HH   TYR  19           HH       TYR  19   0.435   0.775  17.096
  148    H    THR  20           H        THR  20  -2.801  -1.858   9.697
  149    HA   THR  20           HA       THR  20  -3.442  -3.693  11.877
  150    HB   THR  20           HB       THR  20  -4.367  -5.138  10.249
  151    HG1  THR  20           HG1      THR  20  -3.497  -5.315   8.366
  152   HG21  THR  20          HG21      THR  20  -5.728  -3.618   8.737
  153   HG22  THR  20          HG22      THR  20  -4.915  -2.279   9.547
  154   HG23  THR  20          HG23      THR  20  -5.909  -3.400  10.477
  155    H    VAL  21           H        VAL  21  -0.767  -2.787  10.021
  156    HA   VAL  21           HA       VAL  21   0.730  -5.075  11.013
  157    HB   VAL  21           HB       VAL  21   1.790  -5.517   8.836
  158   HG11  VAL  21          HG11      VAL  21  -0.016  -6.794   7.875
  159   HG12  VAL  21          HG12      VAL  21  -1.208  -5.809   8.723
  160   HG13  VAL  21          HG13      VAL  21  -0.125  -6.861   9.634
  161   HG21  VAL  21          HG21      VAL  21   1.208  -3.219   7.918
  162   HG22  VAL  21          HG22      VAL  21  -0.391  -3.878   7.573
  163   HG23  VAL  21          HG23      VAL  21   1.035  -4.580   6.809
  164    H    GLU  22           H        GLU  22   2.862  -4.645  11.397
  165    HA   GLU  22           HA       GLU  22   3.636  -1.928  11.631
  166    HB2  GLU  22           HB2      GLU  22   5.764  -2.800  12.436
  167    HB3  GLU  22           HB3      GLU  22   4.428  -3.678  13.167
  168    HG2  GLU  22           HG2      GLU  22   5.061  -5.114  10.865
  169    HG3  GLU  22           HG3      GLU  22   6.612  -4.651  11.564
  170    H    ASP  23           H        ASP  23   6.105  -1.512  10.872
  171    HA   ASP  23           HA       ASP  23   5.966  -1.004   8.123
  172    HB2  ASP  23           HB2      ASP  23   7.402   0.260   9.687
  173    HB3  ASP  23           HB3      ASP  23   8.437  -1.154   9.865
  174    H    GLY  24           H        GLY  24   6.226  -2.294   6.427
  175    HA2  GLY  24           HA2      GLY  24   7.134  -3.944   5.080
  176    HA3  GLY  24           HA3      GLY  24   8.252  -4.338   6.378
  177    H    GLY  25           H        GLY  25   4.827  -4.235   6.976
  178    HA2  GLY  25           HA2      GLY  25   4.794  -6.899   7.954
  179    HA3  GLY  25           HA3      GLY  25   3.389  -5.874   7.705
  180    H    HIS  26           H        HIS  26   4.888  -8.672   6.749
  181    HA   HIS  26           HA       HIS  26   4.379  -8.776   3.990
  182    HB2  HIS  26           HB2      HIS  26   5.797 -10.392   5.269
  183    HB3  HIS  26           HB3      HIS  26   4.325 -11.094   5.931
  184    HD1  HIS  26           HD1      HIS  26   6.652 -11.511   3.242
  185    HD2  HIS  26           HD2      HIS  26   2.564 -12.084   3.715
  186    HE1  HIS  26           HE1      HIS  26   5.969 -13.049   1.374
  187    HE2  HIS  26           HE2      HIS  26   3.477 -13.317   1.632
  188    H    VAL  27           H        VAL  27   2.518  -8.711   2.938
  189    HA   VAL  27           HA       VAL  27   0.185 -10.090   4.021
  190    HB   VAL  27           HB       VAL  27  -1.297  -8.168   3.552
  191   HG11  VAL  27          HG11      VAL  27  -0.332  -8.662   5.826
  192   HG12  VAL  27          HG12      VAL  27  -0.878  -7.004   5.575
  193   HG13  VAL  27          HG13      VAL  27   0.843  -7.384   5.517
  194   HG21  VAL  27          HG21      VAL  27  -0.362  -6.698   2.102
  195   HG22  VAL  27          HG22      VAL  27   1.269  -6.957   2.720
  196   HG23  VAL  27          HG23      VAL  27   0.149  -5.915   3.598
  197    H    GLU  28           H        GLU  28  -1.042 -11.030   2.477
  198    HA   GLU  28           HA       GLU  28  -0.093 -10.893  -0.252
  199    HB2  GLU  28           HB2      GLU  28  -1.507 -12.781  -0.674
  200    HB3  GLU  28           HB3      GLU  28  -0.701 -13.047   0.866
  201    HG2  GLU  28           HG2      GLU  28  -3.139 -11.722   1.405
  202    HG3  GLU  28           HG3      GLU  28  -3.482 -13.034   0.278
  203    H    ALA  29           H        ALA  29  -1.639 -10.702  -2.066
  204    HA   ALA  29           HA       ALA  29  -2.913  -8.281  -2.169
  205    HB1  ALA  29           HB1      ALA  29  -2.420 -10.207  -3.976
  206    HB2  ALA  29           HB2      ALA  29  -3.488  -8.836  -4.280
  207    HB3  ALA  29           HB3      ALA  29  -4.166 -10.393  -3.802
  208    H    GLY  30           H        GLY  30  -4.779  -7.444  -1.467
  209    HA2  GLY  30           HA2      GLY  30  -7.097  -7.487  -0.987
  210    HA3  GLY  30           HA3      GLY  30  -7.003  -9.232  -0.812
  211    H    SER  31           H        SER  31  -4.550  -8.888   0.909
  212    HA   SER  31           HA       SER  31  -5.916  -8.836   3.409
  213    HB2  SER  31           HB2      SER  31  -2.974  -8.940   2.716
  214    HB3  SER  31           HB3      SER  31  -3.593  -9.048   4.363
  215    HG   SER  31           HG       SER  31  -3.532 -11.115   3.804
  216    H    SER  32           H        SER  32  -6.279  -7.190   4.749
  217    HA   SER  32           HA       SER  32  -5.694  -4.526   3.995
  218    HB2  SER  32           HB2      SER  32  -6.536  -4.013   6.358
  219    HB3  SER  32           HB3      SER  32  -7.657  -4.850   5.284
  220    HG   SER  32           HG       SER  32  -7.295  -5.674   7.548
  221    H    TYR  33           H        TYR  33  -4.124  -3.137   4.617
  222    HA   TYR  33           HA       TYR  33  -2.026  -4.212   6.384
  223    HB2  TYR  33           HB2      TYR  33  -0.395  -2.962   5.130
  224    HB3  TYR  33           HB3      TYR  33  -1.360  -3.901   3.998
  225    HD1  TYR  33           HD2      TYR  33  -0.561  -0.536   5.203
  226    HD2  TYR  33           HD1      TYR  33  -2.872  -2.805   2.443
  227    HE1  TYR  33           HE2      TYR  33  -1.054   1.515   3.940
  228    HE2  TYR  33           HE1      TYR  33  -3.370  -0.760   1.172
  229    HH   TYR  33           HH       TYR  33  -1.710   1.987   1.381
  230    H    ALA  34           H        ALA  34  -4.375  -1.802   6.056
  231    HA   ALA  34           HA       ALA  34  -3.723  -0.601   8.530
  232    HB1  ALA  34           HB1      ALA  34  -3.430   1.408   6.356
  233    HB2  ALA  34           HB2      ALA  34  -2.051   0.382   6.748
  234    HB3  ALA  34           HB3      ALA  34  -2.770   1.406   7.991
  235    H    GLU  35           H        GLU  35  -4.933   1.820   8.367
  236    HA   GLU  35           HA       GLU  35  -7.493   1.478   7.018
  237    HB2  GLU  35           HB2      GLU  35  -7.301   1.903  10.006
  238    HB3  GLU  35           HB3      GLU  35  -8.783   1.836   9.061
  239    HG2  GLU  35           HG2      GLU  35  -7.811  -0.528   8.389
  240    HG3  GLU  35           HG3      GLU  35  -6.979  -0.348   9.932
  241    H    MET  36           H        MET  36  -8.866   3.451   7.243
  242    HA   MET  36           HA       MET  36  -7.491   5.878   8.023
  243    HB2  MET  36           HB2      MET  36  -7.647   6.952   5.862
  244    HB3  MET  36           HB3      MET  36  -6.713   5.471   5.707
  245    HG2  MET  36           HG2      MET  36  -9.181   4.553   5.128
  246    HG3  MET  36           HG3      MET  36  -9.305   6.209   4.537
  247    HE1  MET  36           HE1      MET  36  -9.842   4.990   2.195
  248    HE2  MET  36           HE2      MET  36  -9.444   3.372   2.775
  249    HE3  MET  36           HE3      MET  36  -8.677   3.999   1.316
  250    H    GLU  37           H        GLU  37  -8.932   7.034   9.096
  251    HA   GLU  37           HA       GLU  37 -11.771   6.590   8.657
  252    HB2  GLU  37           HB2      GLU  37 -10.592   6.753  10.951
  253    HB3  GLU  37           HB3      GLU  37 -10.597   8.489  10.670
  254    HG2  GLU  37           HG2      GLU  37 -13.157   8.043  10.200
  255    HG3  GLU  37           HG3      GLU  37 -12.851   6.647  11.233
  256    H    VAL  38           H        VAL  38 -12.517   7.657   6.923
  257    HA   VAL  38           HA       VAL  38 -11.660  10.393   6.400
  258    HB   VAL  38           HB       VAL  38 -11.818   8.781   4.527
  259   HG11  VAL  38          HG11      VAL  38 -14.711   8.733   5.318
  260   HG12  VAL  38          HG12      VAL  38 -13.609   7.378   5.075
  261   HG13  VAL  38          HG13      VAL  38 -14.181   8.310   3.691
  262   HG21  VAL  38          HG21      VAL  38 -13.877  10.937   4.151
  263   HG22  VAL  38          HG22      VAL  38 -12.751  10.274   2.966
  264   HG23  VAL  38          HG23      VAL  38 -12.152  11.285   4.282
  265    H    MET  39           H        MET  39 -13.420  11.994   5.787
  266    HA   MET  39           HA       MET  39 -15.063  12.505   7.961
  267    HB2  MET  39           HB2      MET  39 -15.658  13.484   5.174
  268    HB3  MET  39           HB3      MET  39 -15.995  14.290   6.701
  269    HG2  MET  39           HG2      MET  39 -13.337  14.097   6.894
  270    HG3  MET  39           HG3      MET  39 -13.496  14.142   5.139
  271    HE1  MET  39           HE1      MET  39 -15.149  17.484   4.394
  272    HE2  MET  39           HE2      MET  39 -15.247  15.755   4.061
  273    HE3  MET  39           HE3      MET  39 -13.720  16.610   3.840
  274    H    LYS  40           H        LYS  40 -15.631  10.481   5.208
  275    HA   LYS  40           HA       LYS  40 -18.486  10.396   5.496
  276    HB2  LYS  40           HB2      LYS  40 -16.517   8.724   3.938
  277    HB3  LYS  40           HB3      LYS  40 -18.243   8.385   3.950
  278    HG2  LYS  40           HG2      LYS  40 -17.408  11.147   3.284
  279    HG3  LYS  40           HG3      LYS  40 -17.091   9.886   2.090
  280    HD2  LYS  40           HD2      LYS  40 -19.789  10.244   3.369
  281    HD3  LYS  40           HD3      LYS  40 -19.314  11.122   1.913
  282    HE2  LYS  40           HE2      LYS  40 -19.151   8.127   2.127
  283    HE3  LYS  40           HE3      LYS  40 -20.605   8.959   1.578
  284    HZ1  LYS  40           HZ1      LYS  40 -19.378   8.373  -0.335
  285    HZ2  LYS  40           HZ2      LYS  40 -17.929   8.968   0.304
  286    HZ3  LYS  40           HZ3      LYS  40 -19.161  10.040  -0.137
  287    H    MET  41           H        MET  41 -16.251   7.642   5.642
  288    HA   MET  41           HA       MET  41 -17.209   6.893   8.272
  289    HB2  MET  41           HB2      MET  41 -18.046   5.526   5.777
  290    HB3  MET  41           HB3      MET  41 -17.573   4.487   7.115
  291    HG2  MET  41           HG2      MET  41 -19.691   6.623   7.209
  292    HG3  MET  41           HG3      MET  41 -19.974   4.887   7.085
  293    HE1  MET  41           HE1      MET  41 -19.404   3.159   8.963
  294    HE2  MET  41           HE2      MET  41 -21.004   3.880   9.140
  295    HE3  MET  41           HE3      MET  41 -19.983   3.639  10.558
  296    H    ILE  42           H        ILE  42 -16.248   4.456   8.619
  297    HA   ILE  42           HA       ILE  42 -13.392   4.837   8.407
  298    HB   ILE  42           HB       ILE  42 -14.341   3.971  10.489
  299   HG12  ILE  42          HG12      ILE  42 -12.821   2.074  10.813
  300   HG13  ILE  42          HG13      ILE  42 -12.655   1.894   9.070
  301   HG21  ILE  42          HG21      ILE  42 -16.012   2.513   8.908
  302   HG22  ILE  42          HG22      ILE  42 -15.777   2.259  10.637
  303   HG23  ILE  42          HG23      ILE  42 -14.885   1.280   9.473
  304   HD11  ILE  42          HD11      ILE  42 -12.005   4.572   9.779
  305   HD12  ILE  42          HD12      ILE  42 -10.977   3.327   9.069
  306   HD13  ILE  42          HD13      ILE  42 -11.113   3.465  10.822
  307    H    MET  43           H        MET  43 -11.932   3.464   7.361
  308    HA   MET  43           HA       MET  43 -13.005   1.374   5.632
  309    HB2  MET  43           HB2      MET  43 -11.554   3.826   4.659
  310    HB3  MET  43           HB3      MET  43 -11.574   2.333   3.731
  311    HG2  MET  43           HG2      MET  43 -14.141   3.531   4.659
  312    HG3  MET  43           HG3      MET  43 -13.315   4.200   3.254
  313    HE1  MET  43           HE1      MET  43 -16.026   3.487   2.775
  314    HE2  MET  43           HE2      MET  43 -16.289   2.133   3.874
  315    HE3  MET  43           HE3      MET  43 -16.430   1.895   2.132
  316    H    THR  44           H        THR  44 -11.300   0.042   4.650
  317    HA   THR  44           HA       THR  44  -8.844   0.045   6.281
  318    HB   THR  44           HB       THR  44  -9.579  -2.539   5.125
  319    HG1  THR  44           HG1      THR  44 -11.674  -1.851   5.569
  320   HG21  THR  44          HG21      THR  44  -7.880  -2.055   6.954
  321   HG22  THR  44          HG22      THR  44  -8.975  -3.416   7.194
  322   HG23  THR  44          HG23      THR  44  -9.268  -1.891   8.030
  323    H    LEU  45           H        LEU  45  -6.947   0.006   5.231
  324    HA   LEU  45           HA       LEU  45  -7.010   0.022   2.316
  325    HB2  LEU  45           HB2      LEU  45  -4.730   0.605   4.209
  326    HB3  LEU  45           HB3      LEU  45  -4.712   0.847   2.472
  327    HG   LEU  45           HG       LEU  45  -6.816   2.385   3.060
  328   HD11  LEU  45          HD11      LEU  45  -5.385   1.968   5.606
  329   HD12  LEU  45          HD12      LEU  45  -7.067   2.403   5.302
  330   HD13  LEU  45          HD13      LEU  45  -5.807   3.633   5.208
  331   HD21  LEU  45          HD21      LEU  45  -5.150   3.408   1.862
  332   HD22  LEU  45          HD22      LEU  45  -3.889   2.936   3.001
  333   HD23  LEU  45          HD23      LEU  45  -4.998   4.246   3.406
  334    H    ASN  46           H        ASN  46  -6.161  -1.540   1.052
  335    HA   ASN  46           HA       ASN  46  -4.654  -3.703   2.361
  336    HB2  ASN  46           HB2      ASN  46  -5.840  -5.322   0.886
  337    HB3  ASN  46           HB3      ASN  46  -6.905  -4.525   2.040
  338   HD21  ASN  46          HD21      ASN  46  -8.139  -2.676   1.242
  339   HD22  ASN  46          HD22      ASN  46  -8.682  -2.688  -0.398
  340    H    VAL  47           H        VAL  47  -3.639  -5.175   0.621
  341    HA   VAL  47           HA       VAL  47  -2.183  -3.427  -1.206
  342    HB   VAL  47           HB       VAL  47  -0.664  -5.359  -1.506
  343   HG11  VAL  47          HG11      VAL  47  -1.088  -4.849   1.426
  344   HG12  VAL  47          HG12      VAL  47  -0.437  -3.626   0.335
  345   HG13  VAL  47          HG13      VAL  47   0.426  -5.146   0.572
  346   HG21  VAL  47          HG21      VAL  47  -2.738  -6.906  -0.742
  347   HG22  VAL  47          HG22      VAL  47  -1.831  -6.825   0.768
  348   HG23  VAL  47          HG23      VAL  47  -1.055  -7.429  -0.696
  349    H    GLN  48           H        GLN  48  -1.899  -3.909  -3.417
  350    HA   GLN  48           HA       GLN  48  -4.218  -5.169  -4.618
  351    HB2  GLN  48           HB2      GLN  48  -3.072  -4.364  -6.776
  352    HB3  GLN  48           HB3      GLN  48  -3.708  -3.151  -5.675
  353    HG2  GLN  48           HG2      GLN  48  -1.501  -2.575  -6.599
  354    HG3  GLN  48           HG3      GLN  48  -1.511  -2.674  -4.840
  355   HE21  GLN  48          HE21      GLN  48   0.047  -3.808  -3.929
  356   HE22  GLN  48          HE22      GLN  48   1.032  -4.993  -4.711
  357    H    GLU  49           H        GLU  49  -1.041  -6.071  -3.812
  358    HA   GLU  49           HA       GLU  49  -1.393  -8.621  -5.128
  359    HB2  GLU  49           HB2      GLU  49   0.756  -6.680  -5.924
  360    HB3  GLU  49           HB3      GLU  49   1.015  -8.413  -6.066
  361    HG2  GLU  49           HG2      GLU  49  -0.957  -8.576  -7.515
  362    HG3  GLU  49           HG3      GLU  49  -1.172  -6.830  -7.396
  363    H    ARG  50           H        ARG  50   0.521 -10.094  -4.606
  364    HA   ARG  50           HA       ARG  50   0.892 -10.099  -1.794
  365    HB2  ARG  50           HB2      ARG  50   1.923 -11.780  -4.054
  366    HB3  ARG  50           HB3      ARG  50   2.574 -11.986  -2.433
  367    HG2  ARG  50           HG2      ARG  50   0.915 -13.560  -2.446
  368    HG3  ARG  50           HG3      ARG  50   0.058 -12.177  -1.761
  369    HD2  ARG  50           HD2      ARG  50  -1.387 -13.058  -3.394
  370    HD3  ARG  50           HD3      ARG  50  -0.659 -11.634  -4.135
  371    HE   ARG  50           HE       ARG  50   0.854 -13.932  -4.768
  372   HH11  ARG  50          HH11      ARG  50  -2.184 -12.386  -5.517
  373   HH12  ARG  50          HH12      ARG  50  -2.285 -13.073  -7.104
  374   HH21  ARG  50          HH21      ARG  50   0.723 -14.836  -6.854
  375   HH22  ARG  50          HH22      ARG  50  -0.635 -14.464  -7.863
  376    H    GLY  51           H        GLY  51   2.564  -9.449  -0.549
  377    HA2  GLY  51           HA2      GLY  51   5.208  -9.181  -1.106
  378    HA3  GLY  51           HA3      GLY  51   4.519  -7.695  -1.742
  379    H    ARG  52           H        ARG  52   6.299  -7.251   0.101
  380    HA   ARG  52           HA       ARG  52   5.006  -7.125   2.717
  381    HB2  ARG  52           HB2      ARG  52   7.789  -7.002   1.728
  382    HB3  ARG  52           HB3      ARG  52   7.429  -5.978   3.111
  383    HG2  ARG  52           HG2      ARG  52   7.548  -7.714   4.475
  384    HG3  ARG  52           HG3      ARG  52   6.308  -8.565   3.553
  385    HD2  ARG  52           HD2      ARG  52   8.267  -9.933   3.597
  386    HD3  ARG  52           HD3      ARG  52   8.086  -9.291   1.965
  387    HE   ARG  52           HE       ARG  52   9.742  -7.525   3.251
  388   HH11  ARG  52          HH11      ARG  52   9.798 -10.946   2.565
  389   HH12  ARG  52          HH12      ARG  52  11.527 -11.031   2.495
  390   HH21  ARG  52          HH21      ARG  52  12.015  -7.634   3.159
  391   HH22  ARG  52          HH22      ARG  52  12.785  -9.151   2.833
  392    H    VAL  53           H        VAL  53   3.941  -5.376   3.338
  393    HA   VAL  53           HA       VAL  53   4.067  -2.949   1.783
  394    HB   VAL  53           HB       VAL  53   2.516  -3.441   4.327
  395   HG11  VAL  53          HG11      VAL  53   2.753  -1.088   3.709
  396   HG12  VAL  53          HG12      VAL  53   1.087  -1.634   3.515
  397   HG13  VAL  53          HG13      VAL  53   2.123  -1.443   2.101
  398   HG21  VAL  53          HG21      VAL  53   1.562  -3.789   1.488
  399   HG22  VAL  53          HG22      VAL  53   0.645  -4.088   2.965
  400   HG23  VAL  53          HG23      VAL  53   2.019  -5.115   2.557
  401    H    LYS  54           H        LYS  54   5.195  -1.169   2.237
  402    HA   LYS  54           HA       LYS  54   6.495  -0.989   4.876
  403    HB2  LYS  54           HB2      LYS  54   7.524   0.287   2.346
  404    HB3  LYS  54           HB3      LYS  54   8.379   0.046   3.864
  405    HG2  LYS  54           HG2      LYS  54   7.984  -2.481   3.362
  406    HG3  LYS  54           HG3      LYS  54   7.761  -1.914   1.706
  407    HD2  LYS  54           HD2      LYS  54  10.156  -1.124   3.336
  408    HD3  LYS  54           HD3      LYS  54  10.117  -2.631   2.419
  409    HE2  LYS  54           HE2      LYS  54   9.512   0.035   1.168
  410    HE3  LYS  54           HE3      LYS  54  11.151  -0.606   1.274
  411    HZ1  LYS  54           HZ1      LYS  54  10.304  -2.614   0.094
  412    HZ2  LYS  54           HZ2      LYS  54  10.281  -1.199  -0.833
  413    HZ3  LYS  54           HZ3      LYS  54   8.846  -1.794  -0.164
  414    H    TYR  55           H        TYR  55   5.457   0.462   6.073
  415    HA   TYR  55           HA       TYR  55   3.765   2.472   5.144
  416    HB2  TYR  55           HB2      TYR  55   5.120   1.903   7.740
  417    HB3  TYR  55           HB3      TYR  55   4.370   3.481   7.522
  418    HD1  TYR  55           HD2      TYR  55   3.246   0.152   6.285
  419    HD2  TYR  55           HD1      TYR  55   2.483   3.428   8.891
  420    HE1  TYR  55           HE2      TYR  55   1.058  -0.816   6.852
  421    HE2  TYR  55           HE1      TYR  55   0.293   2.468   9.465
  422    HH   TYR  55           HH       TYR  55  -0.576  -0.702   8.726
  423    H    ILE  56           H        ILE  56   4.026   4.541   4.528
  424    HA   ILE  56           HA       ILE  56   6.779   5.556   4.365
  425    HB   ILE  56           HB       ILE  56   4.381   5.880   2.628
  426   HG12  ILE  56          HG12      ILE  56   5.999   5.610   0.852
  427   HG13  ILE  56          HG13      ILE  56   7.334   5.807   1.982
  428   HG21  ILE  56          HG21      ILE  56   5.556   7.886   1.561
  429   HG22  ILE  56          HG22      ILE  56   6.415   8.037   3.094
  430   HG23  ILE  56          HG23      ILE  56   4.656   8.165   3.052
  431   HD11  ILE  56          HD11      ILE  56   6.667   3.719   3.091
  432   HD12  ILE  56          HD12      ILE  56   7.074   3.489   1.391
  433   HD13  ILE  56          HD13      ILE  56   5.385   3.518   1.897
  434    H    LYS  57           H        LYS  57   3.483   6.841   4.734
  435    HA   LYS  57           HA       LYS  57   4.369   9.250   5.969
  436    HB2  LYS  57           HB2      LYS  57   1.898   8.110   5.023
  437    HB3  LYS  57           HB3      LYS  57   1.656   8.853   6.599
  438    HG2  LYS  57           HG2      LYS  57   2.831  10.198   4.173
  439    HG3  LYS  57           HG3      LYS  57   1.195  10.419   4.795
  440    HD2  LYS  57           HD2      LYS  57   2.168  11.252   6.920
  441    HD3  LYS  57           HD3      LYS  57   3.772  11.132   6.194
  442    HE2  LYS  57           HE2      LYS  57   3.095  13.394   5.979
  443    HE3  LYS  57           HE3      LYS  57   2.948  12.666   4.380
  444    HZ1  LYS  57           HZ1      LYS  57   0.510  12.245   5.242
  445    HZ2  LYS  57           HZ2      LYS  57   0.952  13.706   4.513
  446    HZ3  LYS  57           HZ3      LYS  57   0.859  13.598   6.198
  447    H    ARG  58           H        ARG  58   3.440   9.925   8.145
  448    HA   ARG  58           HA       ARG  58   4.165   7.878  10.092
  449    HB2  ARG  58           HB2      ARG  58   4.151  10.826  10.022
  450    HB3  ARG  58           HB3      ARG  58   3.691  10.121  11.566
  451    HG2  ARG  58           HG2      ARG  58   6.038  10.539  11.596
  452    HG3  ARG  58           HG3      ARG  58   5.790   8.793  11.520
  453    HD2  ARG  58           HD2      ARG  58   6.510   8.653   9.331
  454    HD3  ARG  58           HD3      ARG  58   6.143  10.344   8.994
  455    HE   ARG  58           HE       ARG  58   8.608   9.300   9.924
  456   HH11  ARG  58          HH11      ARG  58   6.494  12.058  10.245
  457   HH12  ARG  58          HH12      ARG  58   7.774  13.149  10.658
  458   HH21  ARG  58          HH21      ARG  58  10.293  10.733  10.469
  459   HH22  ARG  58          HH22      ARG  58   9.931  12.397  10.785
  460    HA   PRO  59           HA       PRO  59   0.122   7.112  11.658
  461    HB2  PRO  59           HB2      PRO  59   0.399   7.318  14.361
  462    HB3  PRO  59           HB3      PRO  59   1.018   5.954  13.425
  463    HG2  PRO  59           HG2      PRO  59   2.470   8.364  14.446
  464    HG3  PRO  59           HG3      PRO  59   2.981   6.665  14.446
  465    HD2  PRO  59           HD2      PRO  59   3.879   8.438  12.619
  466    HD3  PRO  59           HD3      PRO  59   3.617   6.726  12.226
  467    H    GLY  60           H        GLY  60  -1.700   8.267  11.786
  468    HA2  GLY  60           HA2      GLY  60  -3.152   9.907  12.638
  469    HA3  GLY  60           HA3      GLY  60  -1.771  10.737  13.335
  470    H    ALA  61           H        ALA  61  -0.406  10.439  10.613
  471    HA   ALA  61           HA       ALA  61  -0.889  13.001   9.651
  472    HB1  ALA  61           HB1      ALA  61   1.137  11.682   9.172
  473    HB2  ALA  61           HB2      ALA  61   0.419  12.374   7.717
  474    HB3  ALA  61           HB3      ALA  61   0.193  10.663   8.084
  475    H    VAL  62           H        VAL  62  -2.187  13.867   8.105
  476    HA   VAL  62           HA       VAL  62  -4.549  12.391   7.387
  477    HB   VAL  62           HB       VAL  62  -5.272  14.463   6.274
  478   HG11  VAL  62          HG11      VAL  62  -5.636  14.139   8.687
  479   HG12  VAL  62          HG12      VAL  62  -5.450  15.840   8.259
  480   HG13  VAL  62          HG13      VAL  62  -4.114  14.969   9.012
  481   HG21  VAL  62          HG21      VAL  62  -2.541  15.483   7.050
  482   HG22  VAL  62          HG22      VAL  62  -3.865  16.491   6.466
  483   HG23  VAL  62          HG23      VAL  62  -3.163  15.261   5.415
  484    H    LEU  63           H        LEU  63  -4.912  11.303   5.563
  485    HA   LEU  63           HA       LEU  63  -2.848  11.208   3.539
  486    HB2  LEU  63           HB2      LEU  63  -5.481   9.742   3.728
  487    HB3  LEU  63           HB3      LEU  63  -4.227   9.424   2.544
  488    HG   LEU  63           HG       LEU  63  -4.011   7.739   4.180
  489   HD11  LEU  63          HD11      LEU  63  -1.950   9.573   5.269
  490   HD12  LEU  63          HD12      LEU  63  -1.934   9.253   3.534
  491   HD13  LEU  63          HD13      LEU  63  -1.800   7.918   4.678
  492   HD21  LEU  63          HD21      LEU  63  -4.197   7.992   6.466
  493   HD22  LEU  63          HD22      LEU  63  -5.355   9.182   5.871
  494   HD23  LEU  63          HD23      LEU  63  -3.761   9.701   6.419
  495    H    GLU  64           H        GLU  64  -3.201  11.565   1.300
  496    HA   GLU  64           HA       GLU  64  -5.483  13.324   0.690
  497    HB2  GLU  64           HB2      GLU  64  -2.744  13.641  -0.529
  498    HB3  GLU  64           HB3      GLU  64  -4.098  14.760  -0.603
  499    HG2  GLU  64           HG2      GLU  64  -3.817  14.805   1.994
  500    HG3  GLU  64           HG3      GLU  64  -2.192  14.234   1.621
  501    H    ALA  65           H        ALA  65  -6.192  13.319  -1.516
  502    HA   ALA  65           HA       ALA  65  -6.363  10.759  -2.650
  503    HB1  ALA  65           HB1      ALA  65  -6.860  13.330  -4.132
  504    HB2  ALA  65           HB2      ALA  65  -7.983  12.672  -2.941
  505    HB3  ALA  65           HB3      ALA  65  -7.608  11.755  -4.400
  506    H    GLY  66           H        GLY  66  -4.320   9.902  -3.026
  507    HA2  GLY  66           HA2      GLY  66  -3.037   9.468  -5.113
  508    HA3  GLY  66           HA3      GLY  66  -2.805  11.206  -5.206
  509    H    CYS  67           H        CYS  67  -2.519  11.040  -2.113
  510    HA   CYS  67           HA       CYS  67   0.299  11.103  -2.075
  511    HB2  CYS  67           HB2      CYS  67  -1.111  12.323  -0.458
  512    HB3  CYS  67           HB3      CYS  67  -1.616  10.791   0.247
  513    HG   CYS  67           HG       CYS  67   0.315  11.806   1.678
  514    H    VAL  68           H        VAL  68   1.814   9.662  -1.269
  515    HA   VAL  68           HA       VAL  68   1.100   6.877  -1.511
  516    HB   VAL  68           HB       VAL  68   3.777   8.054  -0.758
  517   HG11  VAL  68          HG11      VAL  68   4.655   5.922  -1.618
  518   HG12  VAL  68          HG12      VAL  68   3.002   5.359  -1.870
  519   HG13  VAL  68          HG13      VAL  68   3.581   5.693  -0.238
  520   HG21  VAL  68          HG21      VAL  68   4.183   8.586  -2.891
  521   HG22  VAL  68          HG22      VAL  68   2.438   8.483  -3.123
  522   HG23  VAL  68          HG23      VAL  68   3.459   7.094  -3.491
  523    H    VAL  69           H        VAL  69   0.060   6.003   0.165
  524    HA   VAL  69           HA       VAL  69   0.625   6.779   2.888
  525    HB   VAL  69           HB       VAL  69  -1.053   4.956   3.433
  526   HG11  VAL  69          HG11      VAL  69  -1.392   7.565   2.560
  527   HG12  VAL  69          HG12      VAL  69  -2.581   6.577   3.408
  528   HG13  VAL  69          HG13      VAL  69  -2.588   6.646   1.646
  529   HG21  VAL  69          HG21      VAL  69  -0.601   3.827   1.159
  530   HG22  VAL  69          HG22      VAL  69  -1.738   5.013   0.517
  531   HG23  VAL  69          HG23      VAL  69  -2.258   3.876   1.761
  532    H    ALA  70           H        ALA  70   1.636   4.291   0.710
  533    HA   ALA  70           HA       ALA  70   3.538   3.298   2.597
  534    HB1  ALA  70           HB1      ALA  70   1.154   2.188   3.014
  535    HB2  ALA  70           HB2      ALA  70   2.663   1.297   3.217
  536    HB3  ALA  70           HB3      ALA  70   1.728   1.121   1.731
  537    H    ARG  71           H        ARG  71   4.051   0.806   1.492
  538    HA   ARG  71           HA       ARG  71   4.427   1.252  -1.376
  539    HB2  ARG  71           HB2      ARG  71   6.588   0.910   0.673
  540    HB3  ARG  71           HB3      ARG  71   6.829   0.292  -0.955
  541    HG2  ARG  71           HG2      ARG  71   6.064   3.141  -0.378
  542    HG3  ARG  71           HG3      ARG  71   7.736   2.590  -0.509
  543    HD2  ARG  71           HD2      ARG  71   5.983   1.768  -2.717
  544    HD3  ARG  71           HD3      ARG  71   6.238   3.508  -2.583
  545    HE   ARG  71           HE       ARG  71   8.161   1.527  -3.381
  546   HH11  ARG  71          HH11      ARG  71   7.735   4.712  -2.017
  547   HH12  ARG  71          HH12      ARG  71   9.302   5.266  -2.504
  548   HH21  ARG  71          HH21      ARG  71  10.222   2.255  -4.022
  549   HH22  ARG  71          HH22      ARG  71  10.714   3.872  -3.643
  550    H    LEU  72           H        LEU  72   5.708  -0.862  -2.216
  551    HA   LEU  72           HA       LEU  72   4.681  -3.240  -0.868
  552    HB2  LEU  72           HB2      LEU  72   3.536  -2.098  -3.234
  553    HB3  LEU  72           HB3      LEU  72   4.240  -3.655  -3.625
  554    HG   LEU  72           HG       LEU  72   1.845  -3.794  -3.030
  555   HD11  LEU  72          HD11      LEU  72   3.551  -5.638  -2.623
  556   HD12  LEU  72          HD12      LEU  72   2.028  -5.744  -1.739
  557   HD13  LEU  72          HD13      LEU  72   3.483  -5.170  -0.924
  558   HD21  LEU  72          HD21      LEU  72   2.196  -1.921  -1.239
  559   HD22  LEU  72          HD22      LEU  72   2.549  -3.285  -0.178
  560   HD23  LEU  72          HD23      LEU  72   0.987  -3.180  -0.989
  561    H    GLU  73           H        GLU  73   6.243  -4.684  -0.729
  562    HA   GLU  73           HA       GLU  73   8.567  -4.480  -2.476
  563    HB2  GLU  73           HB2      GLU  73   8.848  -4.670  -0.007
  564    HB3  GLU  73           HB3      GLU  73   8.129  -6.273  -0.082
  565    HG2  GLU  73           HG2      GLU  73  10.587  -6.310   0.035
  566    HG3  GLU  73           HG3      GLU  73   9.948  -7.092  -1.410
  567    H    LEU  74           H        LEU  74   7.362  -5.262  -4.355
  568    HA   LEU  74           HA       LEU  74   6.192  -7.815  -4.476
  569    HB2  LEU  74           HB2      LEU  74   7.403  -6.075  -6.617
  570    HB3  LEU  74           HB3      LEU  74   6.581  -7.585  -6.961
  571    HG   LEU  74           HG       LEU  74   5.359  -5.115  -5.730
  572   HD11  LEU  74          HD11      LEU  74   4.302  -4.747  -7.739
  573   HD12  LEU  74          HD12      LEU  74   4.469  -6.424  -8.259
  574   HD13  LEU  74          HD13      LEU  74   5.869  -5.351  -8.277
  575   HD21  LEU  74          HD21      LEU  74   4.249  -7.875  -6.168
  576   HD22  LEU  74          HD22      LEU  74   3.224  -6.452  -5.992
  577   HD23  LEU  74          HD23      LEU  74   4.293  -6.937  -4.676
  578    H    ASP  75           H        ASP  75   7.189  -9.664  -4.070
  579    HA   ASP  75           HA       ASP  75  10.017  -9.993  -4.305
  580    HB2  ASP  75           HB2      ASP  75   8.411 -11.159  -2.658
  581    HB3  ASP  75           HB3      ASP  75   8.047 -12.248  -3.993
  582    H    ASP  76           H        ASP  76   9.778  -9.253  -6.682
  583    HA   ASP  76           HA       ASP  76   8.903 -11.235  -8.562
  584    HB2  ASP  76           HB2      ASP  76   9.940  -9.702 -10.248
  585    HB3  ASP  76           HB3      ASP  76   8.756  -8.920  -9.205
  586    H    LEU  77           H        LEU  77   9.987 -13.043  -8.930
  587    HA   LEU  77           HA       LEU  77  12.828 -13.214  -8.384
  588    HB2  LEU  77           HB2      LEU  77  10.963 -14.987  -7.913
  589    HB3  LEU  77           HB3      LEU  77  11.218 -15.429  -9.590
  590    HG   LEU  77           HG       LEU  77  13.718 -15.624  -8.920
  591   HD11  LEU  77          HD11      LEU  77  13.532 -14.595  -6.731
  592   HD12  LEU  77          HD12      LEU  77  14.052 -16.273  -6.579
  593   HD13  LEU  77          HD13      LEU  77  12.381 -15.832  -6.226
  594   HD21  LEU  77          HD21      LEU  77  12.296 -17.500  -9.578
  595   HD22  LEU  77          HD22      LEU  77  11.680 -17.615  -7.929
  596   HD23  LEU  77          HD23      LEU  77  13.380 -17.947  -8.260
  597    H    GLU  78           H        GLU  78  10.677 -13.676 -11.177
  598    HA   GLU  78           HA       GLU  78  12.609 -12.614 -12.984
  599    HB2  GLU  78           HB2      GLU  78  13.074 -15.233 -12.410
  600    HB3  GLU  78           HB3      GLU  78  11.997 -15.384 -13.792
  601    HG2  GLU  78           HG2      GLU  78  14.289 -13.504 -13.977
  602    HG3  GLU  78           HG3      GLU  78  14.600 -15.236 -14.087
  603    H    HIS  79           H        HIS  79  11.818 -12.600 -15.227
  604    HA   HIS  79           HA       HIS  79   8.910 -13.005 -15.416
  605    HB2  HIS  79           HB2      HIS  79   8.846 -10.904 -16.818
  606    HB3  HIS  79           HB3      HIS  79   9.164 -10.653 -15.105
  607    HD1  HIS  79           HD1      HIS  79  10.535 -10.011 -18.439
  608    HD2  HIS  79           HD2      HIS  79  11.942 -10.050 -14.529
  609    HE1  HIS  79           HE1      HIS  79  12.727  -8.780 -18.501
  610    HE2  HIS  79           HE2      HIS  79  13.601  -8.891 -16.140
  611    H    HIS  80           H        HIS  80   8.221 -13.987 -17.226
  612    HA   HIS  80           HA       HIS  80  10.060 -15.224 -18.966
  613    HB2  HIS  80           HB2      HIS  80   7.069 -14.854 -19.106
  614    HB3  HIS  80           HB3      HIS  80   7.969 -15.756 -20.321
  615    HD1  HIS  80           HD1      HIS  80   9.649 -17.661 -18.992
  616    HD2  HIS  80           HD2      HIS  80   6.038 -16.532 -17.274
  617    HE1  HIS  80           HE1      HIS  80   9.061 -19.507 -17.389
  618    HE2  HIS  80           HE2      HIS  80   6.829 -18.844 -16.426
  619    H    HIS  81           H        HIS  81   7.445 -13.088 -20.074
  620    HA   HIS  81           HA       HIS  81   7.350 -11.529 -21.727
  621    HB2  HIS  81           HB2      HIS  81   9.231 -10.627 -20.108
  622    HB3  HIS  81           HB3      HIS  81  10.279 -10.983 -21.477
  623    HD1  HIS  81           HD1      HIS  81  10.720  -8.877 -22.682
  624    HD2  HIS  81           HD2      HIS  81   6.785  -9.099 -21.366
  625    HE1  HIS  81           HE1      HIS  81   9.609  -6.787 -23.531
  626    HE2  HIS  81           HE2      HIS  81   7.207  -6.986 -22.797
  627    H    HIS  82           H        HIS  82   7.688 -14.138 -22.582
  628    HA   HIS  82           HA       HIS  82   8.170 -15.356 -24.441
  629    HB2  HIS  82           HB2      HIS  82   8.977 -12.718 -25.678
  630    HB3  HIS  82           HB3      HIS  82   8.508 -14.185 -26.530
  631    HD1  HIS  82           HD1      HIS  82   5.922 -14.918 -25.142
  632    HD2  HIS  82           HD2      HIS  82   6.926 -11.016 -26.157
  633    HE1  HIS  82           HE1      HIS  82   3.740 -13.677 -25.280
  634    HE2  HIS  82           HE2      HIS  82   4.366 -11.339 -25.979
  635    H    HIS  83           H        HIS  83  10.188 -15.023 -22.441
  636    HA   HIS  83           HA       HIS  83  12.647 -15.117 -24.059
  637    HB2  HIS  83           HB2      HIS  83  12.595 -13.415 -22.244
  638    HB3  HIS  83           HB3      HIS  83  12.390 -14.712 -21.072
  639    HD1  HIS  83           HD1      HIS  83  14.523 -15.118 -19.910
  640    HD2  HIS  83           HD2      HIS  83  15.113 -14.188 -23.917
  641    HE1  HIS  83           HE1      HIS  83  17.009 -15.244 -20.270
  642    HE2  HIS  83           HE2      HIS  83  17.334 -14.761 -22.722
  643    H    HIS  84           H        HIS  84  14.155 -16.793 -23.694
  644    HA   HIS  84           HA       HIS  84  12.933 -19.233 -22.602
  645    HB2  HIS  84           HB2      HIS  84  13.619 -19.209 -25.020
  646    HB3  HIS  84           HB3      HIS  84  15.287 -19.033 -24.487
  647    HD1  HIS  84           HD1      HIS  84  16.422 -21.103 -23.436
  648    HD2  HIS  84           HD2      HIS  84  12.517 -21.761 -24.695
  649    HE1  HIS  84           HE1      HIS  84  16.117 -23.599 -23.404
  650    HE2  HIS  84           HE2      HIS  84  13.719 -23.969 -24.085
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1   2.843  12.685 -13.888
    2    H2   MET   1           H2       MET   1   3.898  11.431 -13.388
    3    H3   MET   1           H3       MET   1   3.373  11.509 -15.020
    4    HA   MET   1           HA       MET   1   1.684  11.014 -12.660
    5    HB2  MET   1           HB2      MET   1   1.037  11.033 -15.617
    6    HB3  MET   1           HB3      MET   1  -0.088  10.667 -14.316
    7    HG2  MET   1           HG2      MET   1   0.638  13.064 -13.488
    8    HG3  MET   1           HG3      MET   1   1.017  13.275 -15.196
    9    HE1  MET   1           HE1      MET   1  -0.597  15.200 -15.505
   10    HE2  MET   1           HE2      MET   1  -1.153  15.186 -13.831
   11    HE3  MET   1           HE3      MET   1  -2.324  15.171 -15.149
   12    H    GLU   2           H        GLU   2   3.907   9.543 -12.745
   13    HA   GLU   2           HA       GLU   2   3.361   7.116 -14.279
   14    HB2  GLU   2           HB2      GLU   2   5.734   7.787 -12.531
   15    HB3  GLU   2           HB3      GLU   2   5.593   6.403 -13.605
   16    HG2  GLU   2           HG2      GLU   2   5.953   7.640 -15.480
   17    HG3  GLU   2           HG3      GLU   2   5.270   9.106 -14.779
   18    H    ASN   3           H        ASN   3   2.075   5.659 -13.374
   19    HA   ASN   3           HA       ASN   3   2.293   5.208 -10.469
   20    HB2  ASN   3           HB2      ASN   3   0.130   6.244 -11.160
   21    HB3  ASN   3           HB3      ASN   3  -0.184   4.834 -12.166
   22   HD21  ASN   3          HD21      ASN   3   1.081   5.259  -8.879
   23   HD22  ASN   3          HD22      ASN   3  -0.069   4.218  -8.119
   24    H    ASP   4           H        ASP   4   3.623   3.469 -10.414
   25    HA   ASP   4           HA       ASP   4   3.316   1.272 -12.258
   26    HB2  ASP   4           HB2      ASP   4   5.222   2.022 -10.108
   27    HB3  ASP   4           HB3      ASP   4   5.046   0.302 -10.443
   28    HA   PRO   5           HA       PRO   5   0.692  -1.374  -9.913
   29    HB2  PRO   5           HB2      PRO   5   1.888  -3.809 -10.113
   30    HB3  PRO   5           HB3      PRO   5   1.040  -3.036 -11.457
   31    HG2  PRO   5           HG2      PRO   5   3.975  -3.141 -10.879
   32    HG3  PRO   5           HG3      PRO   5   3.131  -3.355 -12.424
   33    HD2  PRO   5           HD2      PRO   5   4.341  -1.035 -11.747
   34    HD3  PRO   5           HD3      PRO   5   2.869  -1.083 -12.739
   35    H    THR   6           H        THR   6   4.040  -1.184  -9.020
   36    HA   THR   6           HA       THR   6   3.653  -2.581  -6.504
   37    HB   THR   6           HB       THR   6   6.025  -2.135  -6.128
   38    HG1  THR   6           HG1      THR   6   5.987  -0.745  -8.595
   39   HG21  THR   6          HG21      THR   6   5.294  -3.183  -8.831
   40   HG22  THR   6          HG22      THR   6   5.806  -4.068  -7.394
   41   HG23  THR   6          HG23      THR   6   6.972  -3.098  -8.294
   42    H    VAL   7           H        VAL   7   3.112   0.539  -7.636
   43    HA   VAL   7           HA       VAL   7   3.729   1.828  -5.092
   44    HB   VAL   7           HB       VAL   7   2.447   3.143  -7.474
   45   HG11  VAL   7          HG11      VAL   7   4.261   4.363  -5.418
   46   HG12  VAL   7          HG12      VAL   7   2.520   4.229  -5.171
   47   HG13  VAL   7          HG13      VAL   7   3.150   5.169  -6.524
   48   HG21  VAL   7          HG21      VAL   7   5.406   2.928  -6.930
   49   HG22  VAL   7          HG22      VAL   7   4.635   3.765  -8.278
   50   HG23  VAL   7          HG23      VAL   7   4.542   2.008  -8.161
   51    H    LEU   8           H        LEU   8   2.279   1.876  -3.526
   52    HA   LEU   8           HA       LEU   8  -0.522   1.350  -4.110
   53    HB2  LEU   8           HB2      LEU   8   1.108   0.562  -2.069
   54    HB3  LEU   8           HB3      LEU   8   0.257   1.904  -1.329
   55    HG   LEU   8           HG       LEU   8  -1.105  -0.444  -2.643
   56   HD11  LEU   8          HD11      LEU   8  -1.494  -1.342  -0.482
   57   HD12  LEU   8          HD12      LEU   8  -0.806   0.079   0.304
   58   HD13  LEU   8          HD13      LEU   8   0.236  -1.019  -0.602
   59   HD21  LEU   8          HD21      LEU   8  -2.599   1.350  -2.684
   60   HD22  LEU   8          HD22      LEU   8  -2.068   1.947  -1.112
   61   HD23  LEU   8          HD23      LEU   8  -3.024   0.468  -1.217
   62    H    ARG   9           H        ARG   9  -2.146   2.801  -3.947
   63    HA   ARG   9           HA       ARG   9  -1.704   5.366  -2.660
   64    HB2  ARG   9           HB2      ARG   9  -2.595   5.307  -5.539
   65    HB3  ARG   9           HB3      ARG   9  -2.168   6.711  -4.570
   66    HG2  ARG   9           HG2      ARG   9   0.166   5.751  -4.439
   67    HG3  ARG   9           HG3      ARG   9  -0.341   4.603  -5.680
   68    HD2  ARG   9           HD2      ARG   9  -0.512   6.218  -7.298
   69    HD3  ARG   9           HD3      ARG   9  -0.825   7.504  -6.135
   70    HE   ARG   9           HE       ARG   9   1.806   6.487  -5.837
   71   HH11  ARG   9          HH11      ARG   9  -0.142   8.531  -7.888
   72   HH12  ARG   9          HH12      ARG   9   1.199   9.491  -8.417
   73   HH21  ARG   9          HH21      ARG   9   3.571   7.748  -6.531
   74   HH22  ARG   9          HH22      ARG   9   3.307   9.046  -7.647
   75    H    SER  10           H        SER  10  -3.557   6.313  -1.929
   76    HA   SER  10           HA       SER  10  -5.863   4.681  -1.695
   77    HB2  SER  10           HB2      SER  10  -4.849   6.885  -0.352
   78    HB3  SER  10           HB3      SER  10  -6.314   7.507  -1.111
   79    HG   SER  10           HG       SER  10  -6.032   5.398   0.738
   80    HA   PRO  11           HA       PRO  11  -8.149   5.895  -5.272
   81    HB2  PRO  11           HB2      PRO  11 -10.668   5.379  -4.468
   82    HB3  PRO  11           HB3      PRO  11  -9.497   4.090  -4.772
   83    HG2  PRO  11           HG2      PRO  11 -10.349   5.299  -2.169
   84    HG3  PRO  11           HG3      PRO  11 -10.090   3.594  -2.578
   85    HD2  PRO  11           HD2      PRO  11  -8.253   5.111  -1.252
   86    HD3  PRO  11           HD3      PRO  11  -7.816   3.743  -2.295
   87    H    SER  12           H        SER  12  -8.872   7.353  -2.176
   88    HA   SER  12           HA       SER  12  -9.495   9.858  -3.490
   89    HB2  SER  12           HB2      SER  12 -11.567  10.025  -1.871
   90    HB3  SER  12           HB3      SER  12 -11.723   9.231  -3.438
   91    HG   SER  12           HG       SER  12 -11.682   8.131  -0.873
   92    H    ALA  13           H        ALA  13  -9.934  11.595  -1.772
   93    HA   ALA  13           HA       ALA  13  -7.760  11.515   0.094
   94    HB1  ALA  13           HB1      ALA  13  -8.619  13.530  -1.242
   95    HB2  ALA  13           HB2      ALA  13  -8.147  13.789   0.438
   96    HB3  ALA  13           HB3      ALA  13  -9.854  13.658   0.011
   97    H    GLY  14           H        GLY  14  -7.805  10.938   2.168
   98    HA2  GLY  14           HA2      GLY  14 -10.300  11.134   3.679
   99    HA3  GLY  14           HA3      GLY  14  -9.571   9.542   3.534
  100    H    LYS  15           H        LYS  15  -8.694   9.053   5.435
  101    HA   LYS  15           HA       LYS  15  -6.525  10.620   6.459
  102    HB2  LYS  15           HB2      LYS  15  -8.504  11.813   7.395
  103    HB3  LYS  15           HB3      LYS  15  -8.973  10.325   8.206
  104    HG2  LYS  15           HG2      LYS  15  -6.219  11.135   8.742
  105    HG3  LYS  15           HG3      LYS  15  -7.429  12.300   9.283
  106    HD2  LYS  15           HD2      LYS  15  -7.766   9.392   9.897
  107    HD3  LYS  15           HD3      LYS  15  -6.681  10.381  10.875
  108    HE2  LYS  15           HE2      LYS  15  -9.504  11.234  10.324
  109    HE3  LYS  15           HE3      LYS  15  -9.124  10.123  11.639
  110    HZ1  LYS  15           HZ1      LYS  15  -8.127  12.896  11.298
  111    HZ2  LYS  15           HZ2      LYS  15  -7.548  11.828  12.474
  112    HZ3  LYS  15           HZ3      LYS  15  -9.165  12.324  12.505
  113    H    LEU  16           H        LEU  16  -5.117   9.370   7.567
  114    HA   LEU  16           HA       LEU  16  -5.477   6.560   7.568
  115    HB2  LEU  16           HB2      LEU  16  -3.301   7.984   7.481
  116    HB3  LEU  16           HB3      LEU  16  -3.413   7.958   9.229
  117    HG   LEU  16           HG       LEU  16  -3.232   5.550   9.267
  118   HD11  LEU  16          HD11      LEU  16  -2.717   4.395   7.047
  119   HD12  LEU  16          HD12      LEU  16  -3.441   5.812   6.286
  120   HD13  LEU  16          HD13      LEU  16  -4.398   4.812   7.380
  121   HD21  LEU  16          HD21      LEU  16  -0.999   5.526   8.995
  122   HD22  LEU  16          HD22      LEU  16  -1.212   7.248   8.678
  123   HD23  LEU  16          HD23      LEU  16  -1.088   6.112   7.335
  124    H    THR  17           H        THR  17  -7.137   5.839   8.820
  125    HA   THR  17           HA       THR  17  -7.573   6.798  11.486
  126    HB   THR  17           HB       THR  17  -9.379   5.955   9.936
  127    HG1  THR  17           HG1      THR  17 -10.534   5.528  11.647
  128   HG21  THR  17          HG21      THR  17  -8.636   3.208  10.854
  129   HG22  THR  17          HG22      THR  17  -8.080   3.851   9.310
  130   HG23  THR  17          HG23      THR  17  -9.807   3.694   9.629
  131    H    GLN  18           H        GLN  18  -6.275   3.806  10.071
  132    HA   GLN  18           HA       GLN  18  -4.568   3.370  12.310
  133    HB2  GLN  18           HB2      GLN  18  -7.199   2.320  12.506
  134    HB3  GLN  18           HB3      GLN  18  -6.118   0.961  12.240
  135    HG2  GLN  18           HG2      GLN  18  -5.976   2.999  14.445
  136    HG3  GLN  18           HG3      GLN  18  -6.375   1.288  14.589
  137   HE21  GLN  18          HE21      GLN  18  -4.722  -0.256  14.303
  138   HE22  GLN  18          HE22      GLN  18  -3.059   0.166  14.511
  139    H    TYR  19           H        TYR  19  -4.206   0.590  12.036
  140    HA   TYR  19           HA       TYR  19  -3.741   0.066   9.217
  141    HB2  TYR  19           HB2      TYR  19  -1.352  -0.364   9.506
  142    HB3  TYR  19           HB3      TYR  19  -1.732   1.308   9.906
  143    HD1  TYR  19           HD1      TYR  19  -1.703   2.057  12.255
  144    HD2  TYR  19           HD2      TYR  19  -0.530  -1.885  11.169
  145    HE1  TYR  19           HE1      TYR  19  -0.624   1.781  14.447
  146    HE2  TYR  19           HE2      TYR  19   0.552  -2.173  13.358
  147    HH   TYR  19           HH       TYR  19   0.149  -1.018  15.777
  148    H    THR  20           H        THR  20  -3.723  -2.078   8.732
  149    HA   THR  20           HA       THR  20  -4.325  -3.900  10.933
  150    HB   THR  20           HB       THR  20  -5.323  -5.330   9.342
  151    HG1  THR  20           HG1      THR  20  -4.466  -5.558   7.460
  152   HG21  THR  20          HG21      THR  20  -6.693  -3.811   7.852
  153   HG22  THR  20          HG22      THR  20  -5.817  -2.471   8.592
  154   HG23  THR  20          HG23      THR  20  -6.806  -3.536   9.591
  155    H    VAL  21           H        VAL  21  -1.648  -3.003   9.131
  156    HA   VAL  21           HA       VAL  21  -0.204  -5.364  10.019
  157    HB   VAL  21           HB       VAL  21   0.867  -5.721   7.828
  158   HG11  VAL  21          HG11      VAL  21  -0.971  -6.918   6.796
  159   HG12  VAL  21          HG12      VAL  21  -2.136  -5.983   7.732
  160   HG13  VAL  21          HG13      VAL  21  -1.040  -7.097   8.549
  161   HG21  VAL  21          HG21      VAL  21   0.504  -3.509   6.869
  162   HG22  VAL  21          HG22      VAL  21  -1.233  -3.808   6.810
  163   HG23  VAL  21          HG23      VAL  21  -0.139  -4.764   5.809
  164    H    GLU  22           H        GLU  22   1.933  -4.996  10.435
  165    HA   GLU  22           HA       GLU  22   2.760  -2.308  10.796
  166    HB2  GLU  22           HB2      GLU  22   4.860  -3.256  11.581
  167    HB3  GLU  22           HB3      GLU  22   3.502  -4.149  12.253
  168    HG2  GLU  22           HG2      GLU  22   4.110  -5.502   9.914
  169    HG3  GLU  22           HG3      GLU  22   5.680  -5.061  10.585
  170    H    ASP  23           H        ASP  23   5.219  -1.874  10.069
  171    HA   ASP  23           HA       ASP  23   5.112  -1.268   7.339
  172    HB2  ASP  23           HB2      ASP  23   6.532  -0.071   8.978
  173    HB3  ASP  23           HB3      ASP  23   7.572  -1.488   9.089
  174    H    GLY  24           H        GLY  24   5.382  -2.502   5.605
  175    HA2  GLY  24           HA2      GLY  24   6.324  -4.095   4.209
  176    HA3  GLY  24           HA3      GLY  24   7.407  -4.553   5.515
  177    H    GLY  25           H        GLY  25   3.964  -4.443   6.021
  178    HA2  GLY  25           HA2      GLY  25   3.882  -7.136   6.905
  179    HA3  GLY  25           HA3      GLY  25   2.492  -6.095   6.639
  180    H    HIS  26           H        HIS  26   4.043  -8.857   5.633
  181    HA   HIS  26           HA       HIS  26   3.601  -8.864   2.859
  182    HB2  HIS  26           HB2      HIS  26   4.860 -10.549   4.488
  183    HB3  HIS  26           HB3      HIS  26   3.325 -11.405   4.394
  184    HD1  HIS  26           HD1      HIS  26   2.687 -10.923   1.407
  185    HD2  HIS  26           HD2      HIS  26   6.395 -12.109   2.860
  186    HE1  HIS  26           HE1      HIS  26   3.835 -12.052  -0.524
  187    HE2  HIS  26           HE2      HIS  26   6.043 -12.836   0.403
  188    H    VAL  27           H        VAL  27   1.756  -8.760   1.779
  189    HA   VAL  27           HA       VAL  27  -0.575 -10.227   2.742
  190    HB   VAL  27           HB       VAL  27  -2.079  -8.307   2.354
  191   HG11  VAL  27          HG11      VAL  27  -1.169  -8.896   4.615
  192   HG12  VAL  27          HG12      VAL  27  -1.688  -7.220   4.437
  193   HG13  VAL  27          HG13      VAL  27   0.029  -7.621   4.392
  194   HG21  VAL  27          HG21      VAL  27  -1.099  -6.788   0.962
  195   HG22  VAL  27          HG22      VAL  27   0.496  -6.985   1.688
  196   HG23  VAL  27          HG23      VAL  27  -0.735  -6.028   2.512
  197    H    GLU  28           H        GLU  28  -1.821 -11.044   1.128
  198    HA   GLU  28           HA       GLU  28  -0.798 -10.801  -1.567
  199    HB2  GLU  28           HB2      GLU  28  -2.230 -12.636  -2.115
  200    HB3  GLU  28           HB3      GLU  28  -1.495 -12.989  -0.558
  201    HG2  GLU  28           HG2      GLU  28  -3.911 -11.634  -0.038
  202    HG3  GLU  28           HG3      GLU  28  -4.252 -12.858  -1.260
  203    H    ALA  29           H        ALA  29  -2.267 -10.453  -3.408
  204    HA   ALA  29           HA       ALA  29  -3.492  -8.005  -3.403
  205    HB1  ALA  29           HB1      ALA  29  -3.957  -8.410  -5.566
  206    HB2  ALA  29           HB2      ALA  29  -4.744  -9.950  -5.219
  207    HB3  ALA  29           HB3      ALA  29  -2.985  -9.858  -5.302
  208    H    GLY  30           H        GLY  30  -5.327  -7.183  -2.627
  209    HA2  GLY  30           HA2      GLY  30  -7.692  -7.229  -2.297
  210    HA3  GLY  30           HA3      GLY  30  -7.607  -8.979  -2.167
  211    H    SER  31           H        SER  31  -5.230  -8.721  -0.347
  212    HA   SER  31           HA       SER  31  -6.689  -8.707   2.100
  213    HB2  SER  31           HB2      SER  31  -4.847 -10.196   2.000
  214    HB3  SER  31           HB3      SER  31  -3.754  -8.930   1.443
  215    HG   SER  31           HG       SER  31  -3.750  -8.045   3.462
  216    H    SER  32           H        SER  32  -6.995  -7.123   3.543
  217    HA   SER  32           HA       SER  32  -6.407  -4.437   2.872
  218    HB2  SER  32           HB2      SER  32  -7.202  -4.016   5.279
  219    HB3  SER  32           HB3      SER  32  -8.350  -4.770   4.173
  220    HG   SER  32           HG       SER  32  -8.183  -5.793   6.268
  221    H    TYR  33           H        TYR  33  -4.804  -3.096   3.481
  222    HA   TYR  33           HA       TYR  33  -2.693  -4.225   5.200
  223    HB2  TYR  33           HB2      TYR  33  -1.075  -2.949   3.958
  224    HB3  TYR  33           HB3      TYR  33  -2.065  -3.844   2.810
  225    HD1  TYR  33           HD1      TYR  33  -1.243  -0.524   4.129
  226    HD2  TYR  33           HD2      TYR  33  -3.576  -2.689   1.307
  227    HE1  TYR  33           HE1      TYR  33  -1.747   1.573   2.947
  228    HE2  TYR  33           HE2      TYR  33  -4.086  -0.599   0.116
  229    HH   TYR  33           HH       TYR  33  -3.917   2.263   1.269
  230    H    ALA  34           H        ALA  34  -5.055  -1.833   4.998
  231    HA   ALA  34           HA       ALA  34  -4.348  -0.675   7.478
  232    HB1  ALA  34           HB1      ALA  34  -4.024   1.222   5.168
  233    HB2  ALA  34           HB2      ALA  34  -2.662   0.388   5.917
  234    HB3  ALA  34           HB3      ALA  34  -3.649   1.496   6.870
  235    H    GLU  35           H        GLU  35  -5.613   1.710   7.426
  236    HA   GLU  35           HA       GLU  35  -8.190   1.370   6.117
  237    HB2  GLU  35           HB2      GLU  35  -8.214   0.197   8.383
  238    HB3  GLU  35           HB3      GLU  35  -8.068   1.794   9.099
  239    HG2  GLU  35           HG2      GLU  35 -10.157   2.452   7.949
  240    HG3  GLU  35           HG3      GLU  35 -10.313   0.796   7.363
  241    H    MET  36           H        MET  36  -9.543   3.307   6.271
  242    HA   MET  36           HA       MET  36  -8.253   5.715   7.241
  243    HB2  MET  36           HB2      MET  36  -8.209   6.876   5.163
  244    HB3  MET  36           HB3      MET  36  -7.397   5.339   4.907
  245    HG2  MET  36           HG2      MET  36  -9.474   4.450   3.910
  246    HG3  MET  36           HG3      MET  36 -10.207   6.043   4.091
  247    HE1  MET  36           HE1      MET  36  -9.293   8.131   1.537
  248    HE2  MET  36           HE2      MET  36 -10.485   7.415   2.621
  249    HE3  MET  36           HE3      MET  36 -10.333   6.827   0.965
  250    H    GLU  37           H        GLU  37  -9.725   6.905   8.221
  251    HA   GLU  37           HA       GLU  37 -12.548   6.430   7.687
  252    HB2  GLU  37           HB2      GLU  37 -11.468   6.558  10.025
  253    HB3  GLU  37           HB3      GLU  37 -11.441   8.297   9.771
  254    HG2  GLU  37           HG2      GLU  37 -13.834   8.358   9.566
  255    HG3  GLU  37           HG3      GLU  37 -13.921   6.599   9.644
  256    H    VAL  38           H        VAL  38 -13.285   7.533   5.978
  257    HA   VAL  38           HA       VAL  38 -12.381  10.259   5.487
  258    HB   VAL  38           HB       VAL  38 -12.557   8.649   3.606
  259   HG11  VAL  38          HG11      VAL  38 -15.461   8.698   4.352
  260   HG12  VAL  38          HG12      VAL  38 -14.405   7.307   4.115
  261   HG13  VAL  38          HG13      VAL  38 -14.922   8.268   2.730
  262   HG21  VAL  38          HG21      VAL  38 -14.528  10.883   3.214
  263   HG22  VAL  38          HG22      VAL  38 -13.413  10.183   2.040
  264   HG23  VAL  38          HG23      VAL  38 -12.793  11.162   3.370
  265    H    MET  39           H        MET  39 -14.102  11.899   4.876
  266    HA   MET  39           HA       MET  39 -15.751  12.427   7.039
  267    HB2  MET  39           HB2      MET  39 -16.291  13.431   4.249
  268    HB3  MET  39           HB3      MET  39 -16.651  14.230   5.773
  269    HG2  MET  39           HG2      MET  39 -13.897  13.795   5.806
  270    HG3  MET  39           HG3      MET  39 -14.268  14.323   4.166
  271    HE1  MET  39           HE1      MET  39 -15.312  17.916   4.445
  272    HE2  MET  39           HE2      MET  39 -16.328  16.519   4.087
  273    HE3  MET  39           HE3      MET  39 -14.684  16.599   3.455
  274    H    LYS  40           H        LYS  40 -16.348  10.443   4.255
  275    HA   LYS  40           HA       LYS  40 -19.196  10.409   4.518
  276    HB2  LYS  40           HB2      LYS  40 -18.139   9.986   2.365
  277    HB3  LYS  40           HB3      LYS  40 -17.297   8.592   3.024
  278    HG2  LYS  40           HG2      LYS  40 -19.005   7.514   2.024
  279    HG3  LYS  40           HG3      LYS  40 -19.782   7.844   3.573
  280    HD2  LYS  40           HD2      LYS  40 -21.238   9.306   2.672
  281    HD3  LYS  40           HD3      LYS  40 -20.023   9.999   1.596
  282    HE2  LYS  40           HE2      LYS  40 -21.613   8.972   0.189
  283    HE3  LYS  40           HE3      LYS  40 -20.228   7.882   0.223
  284    HZ1  LYS  40           HZ1      LYS  40 -22.795   7.580   1.676
  285    HZ2  LYS  40           HZ2      LYS  40 -21.435   6.626   1.993
  286    HZ3  LYS  40           HZ3      LYS  40 -22.168   6.574   0.469
  287    H    MET  41           H        MET  41 -17.007   7.612   4.682
  288    HA   MET  41           HA       MET  41 -18.031   6.864   7.288
  289    HB2  MET  41           HB2      MET  41 -19.424   5.933   5.151
  290    HB3  MET  41           HB3      MET  41 -18.221   4.662   5.328
  291    HG2  MET  41           HG2      MET  41 -19.075   3.931   7.288
  292    HG3  MET  41           HG3      MET  41 -19.599   5.538   7.788
  293    HE1  MET  41           HE1      MET  41 -22.019   6.076   8.013
  294    HE2  MET  41           HE2      MET  41 -21.820   4.496   8.772
  295    HE3  MET  41           HE3      MET  41 -23.218   4.811   7.744
  296    H    ILE  42           H        ILE  42 -17.082   4.479   7.731
  297    HA   ILE  42           HA       ILE  42 -14.221   4.808   7.499
  298    HB   ILE  42           HB       ILE  42 -15.202   4.044   9.614
  299   HG12  ILE  42          HG12      ILE  42 -13.665   2.189  10.041
  300   HG13  ILE  42          HG13      ILE  42 -13.493   1.912   8.311
  301   HG21  ILE  42          HG21      ILE  42 -17.089   2.794   8.809
  302   HG22  ILE  42          HG22      ILE  42 -16.074   1.729   9.782
  303   HG23  ILE  42          HG23      ILE  42 -16.030   1.623   8.022
  304   HD11  ILE  42          HD11      ILE  42 -12.870   4.642   9.050
  305   HD12  ILE  42          HD12      ILE  42 -11.926   3.471   8.130
  306   HD13  ILE  42          HD13      ILE  42 -11.864   3.465   9.893
  307    H    MET  43           H        MET  43 -12.812   3.560   6.334
  308    HA   MET  43           HA       MET  43 -13.837   1.272   4.843
  309    HB2  MET  43           HB2      MET  43 -13.013   2.095   2.705
  310    HB3  MET  43           HB3      MET  43 -14.209   3.203   3.365
  311    HG2  MET  43           HG2      MET  43 -12.470   4.713   4.084
  312    HG3  MET  43           HG3      MET  43 -11.229   3.580   3.549
  313    HE1  MET  43           HE1      MET  43 -13.940   6.199   0.960
  314    HE2  MET  43           HE2      MET  43 -14.137   5.798   2.666
  315    HE3  MET  43           HE3      MET  43 -14.612   4.637   1.426
  316    H    THR  44           H        THR  44 -12.183  -0.087   3.964
  317    HA   THR  44           HA       THR  44  -9.554   0.334   5.226
  318    HB   THR  44           HB       THR  44 -10.178  -2.429   4.509
  319    HG1  THR  44           HG1      THR  44 -11.771  -2.754   5.996
  320   HG21  THR  44          HG21      THR  44  -8.503  -2.521   5.981
  321   HG22  THR  44          HG22      THR  44  -9.789  -2.419   7.184
  322   HG23  THR  44          HG23      THR  44  -8.913  -0.966   6.704
  323    H    LEU  45           H        LEU  45  -7.770   0.208   3.983
  324    HA   LEU  45           HA       LEU  45  -8.171  -0.095   1.112
  325    HB2  LEU  45           HB2      LEU  45  -6.016   1.069   2.829
  326    HB3  LEU  45           HB3      LEU  45  -5.644   0.599   1.182
  327    HG   LEU  45           HG       LEU  45  -6.124   2.917   1.135
  328   HD11  LEU  45          HD11      LEU  45  -7.891   3.049  -0.422
  329   HD12  LEU  45          HD12      LEU  45  -8.696   1.634   0.256
  330   HD13  LEU  45          HD13      LEU  45  -7.180   1.448  -0.627
  331   HD21  LEU  45          HD21      LEU  45  -7.273   3.729   2.869
  332   HD22  LEU  45          HD22      LEU  45  -8.115   2.204   3.142
  333   HD23  LEU  45          HD23      LEU  45  -8.716   3.339   1.934
  334    H    ASN  46           H        ASN  46  -6.903  -1.481  -0.180
  335    HA   ASN  46           HA       ASN  46  -5.455  -3.600   1.248
  336    HB2  ASN  46           HB2      ASN  46  -6.492  -5.238  -0.401
  337    HB3  ASN  46           HB3      ASN  46  -7.561  -4.619   0.854
  338   HD21  ASN  46          HD21      ASN  46  -9.098  -3.016   0.296
  339   HD22  ASN  46          HD22      ASN  46  -9.649  -2.851  -1.333
  340    H    VAL  47           H        VAL  47  -4.397  -5.100  -0.524
  341    HA   VAL  47           HA       VAL  47  -2.812  -3.309  -2.196
  342    HB   VAL  47           HB       VAL  47  -1.339  -5.278  -2.523
  343   HG11  VAL  47          HG11      VAL  47  -1.813  -4.982   0.417
  344   HG12  VAL  47          HG12      VAL  47  -1.248  -3.616  -0.544
  345   HG13  VAL  47          HG13      VAL  47  -0.289  -5.094  -0.463
  346   HG21  VAL  47          HG21      VAL  47  -1.861  -7.364  -1.879
  347   HG22  VAL  47          HG22      VAL  47  -3.521  -6.767  -1.855
  348   HG23  VAL  47          HG23      VAL  47  -2.582  -6.822  -0.364
  349    H    GLN  48           H        GLN  48  -2.605  -3.516  -4.410
  350    HA   GLN  48           HA       GLN  48  -4.826  -4.818  -5.739
  351    HB2  GLN  48           HB2      GLN  48  -3.771  -3.735  -7.805
  352    HB3  GLN  48           HB3      GLN  48  -4.435  -2.666  -6.579
  353    HG2  GLN  48           HG2      GLN  48  -2.301  -1.865  -7.451
  354    HG3  GLN  48           HG3      GLN  48  -2.220  -2.210  -5.726
  355   HE21  GLN  48          HE21      GLN  48  -0.289  -2.963  -5.252
  356   HE22  GLN  48          HE22      GLN  48   0.601  -4.134  -6.159
  357    H    GLU  49           H        GLU  49  -1.708  -5.706  -4.883
  358    HA   GLU  49           HA       GLU  49  -1.851  -8.053  -6.562
  359    HB2  GLU  49           HB2      GLU  49   0.142  -5.885  -7.002
  360    HB3  GLU  49           HB3      GLU  49   0.703  -7.546  -7.131
  361    HG2  GLU  49           HG2      GLU  49  -0.994  -7.993  -8.825
  362    HG3  GLU  49           HG3      GLU  49  -1.566  -6.331  -8.692
  363    H    ARG  50           H        ARG  50  -0.141  -9.636  -6.013
  364    HA   ARG  50           HA       ARG  50   0.119  -9.877  -3.199
  365    HB2  ARG  50           HB2      ARG  50   1.053 -11.451  -5.562
  366    HB3  ARG  50           HB3      ARG  50   1.757 -11.792  -3.987
  367    HG2  ARG  50           HG2      ARG  50   0.022 -13.292  -4.058
  368    HG3  ARG  50           HG3      ARG  50  -0.721 -11.934  -3.210
  369    HD2  ARG  50           HD2      ARG  50  -2.333 -12.438  -4.777
  370    HD3  ARG  50           HD3      ARG  50  -1.417 -11.179  -5.604
  371    HE   ARG  50           HE       ARG  50  -0.773 -12.724  -7.161
  372   HH11  ARG  50          HH11      ARG  50  -1.994 -14.405  -4.357
  373   HH12  ARG  50          HH12      ARG  50  -1.947 -15.961  -5.115
  374   HH21  ARG  50          HH21      ARG  50  -0.711 -14.770  -8.159
  375   HH22  ARG  50          HH22      ARG  50  -1.219 -16.169  -7.273
  376    H    GLY  51           H        GLY  51   1.637  -9.110  -1.883
  377    HA2  GLY  51           HA2      GLY  51   4.368  -9.076  -2.300
  378    HA3  GLY  51           HA3      GLY  51   3.785  -7.520  -2.871
  379    H    ARG  52           H        ARG  52   5.468  -7.182  -0.970
  380    HA   ARG  52           HA       ARG  52   4.117  -7.211   1.620
  381    HB2  ARG  52           HB2      ARG  52   6.924  -7.033   0.704
  382    HB3  ARG  52           HB3      ARG  52   6.531  -6.109   2.148
  383    HG2  ARG  52           HG2      ARG  52   6.359  -7.939   3.420
  384    HG3  ARG  52           HG3      ARG  52   5.500  -8.845   2.173
  385    HD2  ARG  52           HD2      ARG  52   7.731  -9.785   2.775
  386    HD3  ARG  52           HD3      ARG  52   7.544  -9.395   1.066
  387    HE   ARG  52           HE       ARG  52   8.692  -7.213   2.447
  388   HH11  ARG  52          HH11      ARG  52   9.463 -10.404   1.265
  389   HH12  ARG  52          HH12      ARG  52  11.150 -10.062   1.074
  390   HH21  ARG  52          HH21      ARG  52  10.910  -6.760   2.195
  391   HH22  ARG  52          HH22      ARG  52  11.971  -7.993   1.602
  392    H    VAL  53           H        VAL  53   3.093  -5.488   2.378
  393    HA   VAL  53           HA       VAL  53   3.216  -2.979   0.954
  394    HB   VAL  53           HB       VAL  53   1.680  -3.634   3.472
  395   HG11  VAL  53          HG11      VAL  53   1.535  -1.373   1.494
  396   HG12  VAL  53          HG12      VAL  53   1.789  -1.288   3.238
  397   HG13  VAL  53          HG13      VAL  53   0.215  -1.760   2.598
  398   HG21  VAL  53          HG21      VAL  53   0.676  -3.693   0.633
  399   HG22  VAL  53          HG22      VAL  53  -0.199  -4.157   2.092
  400   HG23  VAL  53          HG23      VAL  53   1.164  -5.127   1.535
  401    H    LYS  54           H        LYS  54   4.433  -1.284   1.459
  402    HA   LYS  54           HA       LYS  54   5.694  -1.213   4.122
  403    HB2  LYS  54           HB2      LYS  54   6.751  -0.588   1.398
  404    HB3  LYS  54           HB3      LYS  54   7.389   0.299   2.775
  405    HG2  LYS  54           HG2      LYS  54   7.276  -2.680   2.864
  406    HG3  LYS  54           HG3      LYS  54   8.560  -1.872   1.961
  407    HD2  LYS  54           HD2      LYS  54   8.847  -0.488   4.153
  408    HD3  LYS  54           HD3      LYS  54   7.995  -1.843   4.897
  409    HE2  LYS  54           HE2      LYS  54  10.305  -2.312   5.105
  410    HE3  LYS  54           HE3      LYS  54   9.699  -3.355   3.818
  411    HZ1  LYS  54           HZ1      LYS  54  11.115  -0.777   3.400
  412    HZ2  LYS  54           HZ2      LYS  54  10.588  -1.834   2.189
  413    HZ3  LYS  54           HZ3      LYS  54  11.818  -2.309   3.249
  414    H    TYR  55           H        TYR  55   4.939   0.352   5.367
  415    HA   TYR  55           HA       TYR  55   3.200   2.369   4.541
  416    HB2  TYR  55           HB2      TYR  55   4.388   1.502   6.990
  417    HB3  TYR  55           HB3      TYR  55   4.539   3.253   6.891
  418    HD1  TYR  55           HD2      TYR  55   1.824   1.005   5.671
  419    HD2  TYR  55           HD1      TYR  55   2.950   4.109   8.354
  420    HE1  TYR  55           HE2      TYR  55  -0.521   1.240   6.374
  421    HE2  TYR  55           HE1      TYR  55   0.609   4.352   9.065
  422    HH   TYR  55           HH       TYR  55  -1.444   3.111   9.103
  423    H    ILE  56           H        ILE  56   3.500   4.239   3.534
  424    HA   ILE  56           HA       ILE  56   6.232   5.299   3.327
  425    HB   ILE  56           HB       ILE  56   3.908   5.284   1.483
  426   HG12  ILE  56          HG12      ILE  56   5.662   5.001  -0.191
  427   HG13  ILE  56          HG13      ILE  56   6.897   5.330   1.020
  428   HG21  ILE  56          HG21      ILE  56   4.937   7.241   0.227
  429   HG22  ILE  56          HG22      ILE  56   5.770   7.630   1.732
  430   HG23  ILE  56          HG23      ILE  56   4.007   7.627   1.675
  431   HD11  ILE  56          HD11      ILE  56   6.101   3.305   2.248
  432   HD12  ILE  56          HD12      ILE  56   6.829   2.989   0.673
  433   HD13  ILE  56          HD13      ILE  56   5.075   2.949   0.858
  434    H    LYS  57           H        LYS  57   2.878   6.433   3.596
  435    HA   LYS  57           HA       LYS  57   3.620   9.056   4.423
  436    HB2  LYS  57           HB2      LYS  57   1.192   7.579   3.841
  437    HB3  LYS  57           HB3      LYS  57   0.987   8.632   5.235
  438    HG2  LYS  57           HG2      LYS  57   1.961   9.490   2.517
  439    HG3  LYS  57           HG3      LYS  57   0.333   9.729   3.153
  440    HD2  LYS  57           HD2      LYS  57   2.630  10.733   4.754
  441    HD3  LYS  57           HD3      LYS  57   2.175  11.623   3.300
  442    HE2  LYS  57           HE2      LYS  57  -0.029  10.850   5.105
  443    HE3  LYS  57           HE3      LYS  57   1.089  12.066   5.720
  444    HZ1  LYS  57           HZ1      LYS  57  -0.248  12.262   3.080
  445    HZ2  LYS  57           HZ2      LYS  57   0.631  13.466   3.877
  446    HZ3  LYS  57           HZ3      LYS  57  -0.863  12.964   4.491
  447    H    ARG  58           H        ARG  58   2.477   9.895   6.546
  448    HA   ARG  58           HA       ARG  58   3.628   8.318   8.712
  449    HB2  ARG  58           HB2      ARG  58   3.094  11.154   8.229
  450    HB3  ARG  58           HB3      ARG  58   2.656  10.634   9.851
  451    HG2  ARG  58           HG2      ARG  58   5.131   9.494   9.483
  452    HG3  ARG  58           HG3      ARG  58   5.277  11.050   8.664
  453    HD2  ARG  58           HD2      ARG  58   4.100  11.918  10.862
  454    HD3  ARG  58           HD3      ARG  58   4.793  10.445  11.538
  455    HE   ARG  58           HE       ARG  58   6.722  11.944  10.073
  456   HH11  ARG  58          HH11      ARG  58   5.050  11.786  13.132
  457   HH12  ARG  58          HH12      ARG  58   6.307  12.599  14.003
  458   HH21  ARG  58          HH21      ARG  58   8.376  13.012  11.217
  459   HH22  ARG  58          HH22      ARG  58   8.195  13.295  12.916
  460    HA   PRO  59           HA       PRO  59  -0.211   6.947  10.383
  461    HB2  PRO  59           HB2      PRO  59   0.216   7.081  13.055
  462    HB3  PRO  59           HB3      PRO  59   1.005   5.882  12.023
  463    HG2  PRO  59           HG2      PRO  59   2.076   8.471  13.080
  464    HG3  PRO  59           HG3      PRO  59   2.870   6.888  12.983
  465    HD2  PRO  59           HD2      PRO  59   3.322   8.867  11.185
  466    HD3  PRO  59           HD3      PRO  59   3.392   7.146  10.755
  467    H    GLY  60           H        GLY  60  -2.133   7.891  10.571
  468    HA2  GLY  60           HA2      GLY  60  -3.763   9.287  11.512
  469    HA3  GLY  60           HA3      GLY  60  -2.490  10.200  12.307
  470    H    ALA  61           H        ALA  61  -1.124  10.253   9.535
  471    HA   ALA  61           HA       ALA  61  -1.816  12.844   8.820
  472    HB1  ALA  61           HB1      ALA  61   0.280  11.698   8.184
  473    HB2  ALA  61           HB2      ALA  61  -0.509  12.500   6.826
  474    HB3  ALA  61           HB3      ALA  61  -0.629  10.749   7.008
  475    H    VAL  62           H        VAL  62  -2.995  13.719   7.096
  476    HA   VAL  62           HA       VAL  62  -5.415  12.292   6.468
  477    HB   VAL  62           HB       VAL  62  -4.523  14.968   5.389
  478   HG11  VAL  62          HG11      VAL  62  -7.329  13.983   5.819
  479   HG12  VAL  62          HG12      VAL  62  -6.455  13.712   4.311
  480   HG13  VAL  62          HG13      VAL  62  -6.781  15.357   4.859
  481   HG21  VAL  62          HG21      VAL  62  -4.454  14.984   7.832
  482   HG22  VAL  62          HG22      VAL  62  -6.109  14.376   7.887
  483   HG23  VAL  62          HG23      VAL  62  -5.779  15.977   7.225
  484    H    LEU  63           H        LEU  63  -5.815  11.125   4.699
  485    HA   LEU  63           HA       LEU  63  -3.775  10.879   2.666
  486    HB2  LEU  63           HB2      LEU  63  -6.459   9.530   2.628
  487    HB3  LEU  63           HB3      LEU  63  -4.959   8.992   1.896
  488    HG   LEU  63           HG       LEU  63  -5.603   9.028   4.844
  489   HD11  LEU  63          HD11      LEU  63  -5.214   6.544   4.533
  490   HD12  LEU  63          HD12      LEU  63  -5.329   6.844   2.799
  491   HD13  LEU  63          HD13      LEU  63  -6.701   7.199   3.849
  492   HD21  LEU  63          HD21      LEU  63  -3.223   9.595   4.279
  493   HD22  LEU  63          HD22      LEU  63  -3.098   8.006   3.523
  494   HD23  LEU  63          HD23      LEU  63  -3.437   8.137   5.249
  495    H    GLU  64           H        GLU  64  -4.103  11.196   0.429
  496    HA   GLU  64           HA       GLU  64  -6.381  12.928  -0.264
  497    HB2  GLU  64           HB2      GLU  64  -3.615  13.286  -1.407
  498    HB3  GLU  64           HB3      GLU  64  -4.988  14.376  -1.535
  499    HG2  GLU  64           HG2      GLU  64  -4.750  14.386   1.102
  500    HG3  GLU  64           HG3      GLU  64  -3.085  13.968   0.698
  501    H    ALA  65           H        ALA  65  -7.170  12.757  -2.378
  502    HA   ALA  65           HA       ALA  65  -7.096  10.195  -3.519
  503    HB1  ALA  65           HB1      ALA  65  -7.923  12.699  -4.969
  504    HB2  ALA  65           HB2      ALA  65  -8.926  11.918  -3.747
  505    HB3  ALA  65           HB3      ALA  65  -8.500  11.052  -5.223
  506    H    GLY  66           H        GLY  66  -5.074   9.486  -4.077
  507    HA2  GLY  66           HA2      GLY  66  -3.852   9.292  -6.248
  508    HA3  GLY  66           HA3      GLY  66  -3.685  11.040  -6.175
  509    H    CYS  67           H        CYS  67  -3.264  10.790  -3.182
  510    HA   CYS  67           HA       CYS  67  -0.442  10.787  -3.232
  511    HB2  CYS  67           HB2      CYS  67  -1.844  12.030  -1.582
  512    HB3  CYS  67           HB3      CYS  67  -2.240  10.494  -0.818
  513    HG   CYS  67           HG       CYS  67  -0.226  11.733   0.397
  514    H    VAL  68           H        VAL  68   1.048   9.332  -2.320
  515    HA   VAL  68           HA       VAL  68   0.305   6.560  -2.625
  516    HB   VAL  68           HB       VAL  68   2.969   7.631  -1.697
  517   HG11  VAL  68          HG11      VAL  68   3.862   5.562  -2.299
  518   HG12  VAL  68          HG12      VAL  68   2.459   5.137  -3.280
  519   HG13  VAL  68          HG13      VAL  68   2.334   5.148  -1.521
  520   HG21  VAL  68          HG21      VAL  68   3.179   8.611  -3.688
  521   HG22  VAL  68          HG22      VAL  68   1.679   7.894  -4.276
  522   HG23  VAL  68          HG23      VAL  68   3.191   6.994  -4.391
  523    H    VAL  69           H        VAL  69  -0.635   5.484  -1.020
  524    HA   VAL  69           HA       VAL  69  -0.359   6.328   1.728
  525    HB   VAL  69           HB       VAL  69  -1.798   3.892   0.673
  526   HG11  VAL  69          HG11      VAL  69  -1.427   3.772   3.042
  527   HG12  VAL  69          HG12      VAL  69  -3.123   4.162   2.759
  528   HG13  VAL  69          HG13      VAL  69  -2.000   5.425   3.261
  529   HG21  VAL  69          HG21      VAL  69  -3.144   6.481   1.338
  530   HG22  VAL  69          HG22      VAL  69  -3.722   5.144   0.344
  531   HG23  VAL  69          HG23      VAL  69  -2.461   6.215  -0.266
  532    H    ALA  70           H        ALA  70   0.941   3.832  -0.336
  533    HA   ALA  70           HA       ALA  70   2.936   3.165   1.598
  534    HB1  ALA  70           HB1      ALA  70   2.332   1.006   2.207
  535    HB2  ALA  70           HB2      ALA  70   1.162   0.858   0.895
  536    HB3  ALA  70           HB3      ALA  70   0.803   1.883   2.285
  537    H    ARG  71           H        ARG  71   3.670   0.648   0.644
  538    HA   ARG  71           HA       ARG  71   4.008   0.979  -2.245
  539    HB2  ARG  71           HB2      ARG  71   6.094   1.268  -0.213
  540    HB3  ARG  71           HB3      ARG  71   6.498   0.087  -1.452
  541    HG2  ARG  71           HG2      ARG  71   5.692   2.944  -1.950
  542    HG3  ARG  71           HG3      ARG  71   7.336   2.306  -2.008
  543    HD2  ARG  71           HD2      ARG  71   5.336   0.910  -3.671
  544    HD3  ARG  71           HD3      ARG  71   5.748   2.549  -4.168
  545    HE   ARG  71           HE       ARG  71   7.891   1.843  -4.680
  546   HH11  ARG  71          HH11      ARG  71   6.100  -0.750  -3.178
  547   HH12  ARG  71          HH12      ARG  71   7.253  -1.963  -3.616
  548   HH21  ARG  71          HH21      ARG  71   9.405   0.247  -5.255
  549   HH22  ARG  71          HH22      ARG  71   9.128  -1.399  -4.793
  550    H    LEU  72           H        LEU  72   3.878  -0.886  -3.337
  551    HA   LEU  72           HA       LEU  72   3.527  -3.338  -1.795
  552    HB2  LEU  72           HB2      LEU  72   2.366  -2.251  -4.162
  553    HB3  LEU  72           HB3      LEU  72   3.130  -3.774  -4.575
  554    HG   LEU  72           HG       LEU  72   0.855  -4.236  -4.040
  555   HD11  LEU  72          HD11      LEU  72   2.660  -5.747  -3.121
  556   HD12  LEU  72          HD12      LEU  72   1.081  -5.861  -2.343
  557   HD13  LEU  72          HD13      LEU  72   2.387  -4.971  -1.561
  558   HD21  LEU  72          HD21      LEU  72   0.833  -2.032  -2.555
  559   HD22  LEU  72          HD22      LEU  72   1.039  -3.215  -1.264
  560   HD23  LEU  72          HD23      LEU  72  -0.350  -3.322  -2.345
  561    H    GLU  73           H        GLU  73   5.054  -4.814  -1.645
  562    HA   GLU  73           HA       GLU  73   7.433  -4.611  -3.314
  563    HB2  GLU  73           HB2      GLU  73   6.837  -5.565  -0.638
  564    HB3  GLU  73           HB3      GLU  73   7.769  -6.749  -1.545
  565    HG2  GLU  73           HG2      GLU  73   8.658  -3.914  -1.587
  566    HG3  GLU  73           HG3      GLU  73   8.933  -4.868  -0.130
  567    H    LEU  74           H        LEU  74   6.483  -5.380  -5.273
  568    HA   LEU  74           HA       LEU  74   5.166  -7.849  -5.527
  569    HB2  LEU  74           HB2      LEU  74   6.484  -5.939  -7.373
  570    HB3  LEU  74           HB3      LEU  74   6.242  -7.571  -7.967
  571    HG   LEU  74           HG       LEU  74   3.854  -7.396  -7.653
  572   HD11  LEU  74          HD11      LEU  74   3.289  -6.146  -5.862
  573   HD12  LEU  74          HD12      LEU  74   3.152  -4.872  -7.074
  574   HD13  LEU  74          HD13      LEU  74   4.615  -5.008  -6.098
  575   HD21  LEU  74          HD21      LEU  74   5.255  -5.247  -9.172
  576   HD22  LEU  74          HD22      LEU  74   3.494  -5.237  -9.088
  577   HD23  LEU  74          HD23      LEU  74   4.336  -6.630  -9.764
  578    H    ASP  75           H        ASP  75   5.932  -9.805  -5.166
  579    HA   ASP  75           HA       ASP  75   8.727 -10.342  -4.927
  580    HB2  ASP  75           HB2      ASP  75   6.756 -11.463  -3.678
  581    HB3  ASP  75           HB3      ASP  75   6.601 -12.463  -5.119
  582    H    ASP  76           H        ASP  76   8.976  -9.464  -7.249
  583    HA   ASP  76           HA       ASP  76   8.312 -11.256  -9.387
  584    HB2  ASP  76           HB2      ASP  76  10.041  -8.790  -9.217
  585    HB3  ASP  76           HB3      ASP  76   9.877  -9.724 -10.700
  586    H    LEU  77           H        LEU  77   9.682 -12.587 -10.564
  587    HA   LEU  77           HA       LEU  77  11.916 -13.654  -9.059
  588    HB2  LEU  77           HB2      LEU  77  10.089 -14.956 -10.387
  589    HB3  LEU  77           HB3      LEU  77  11.098 -14.606 -11.778
  590    HG   LEU  77           HG       LEU  77  13.009 -15.684 -10.450
  591   HD11  LEU  77          HD11      LEU  77  12.113 -15.755  -8.264
  592   HD12  LEU  77          HD12      LEU  77  12.158 -17.424  -8.834
  593   HD13  LEU  77          HD13      LEU  77  10.632 -16.538  -8.818
  594   HD21  LEU  77          HD21      LEU  77  10.689 -17.402 -11.325
  595   HD22  LEU  77          HD22      LEU  77  12.373 -17.908 -11.187
  596   HD23  LEU  77          HD23      LEU  77  11.909 -16.708 -12.393
  597    H    GLU  78           H        GLU  78  11.354 -11.771 -11.947
  598    HA   GLU  78           HA       GLU  78  14.004 -12.025 -12.985
  599    HB2  GLU  78           HB2      GLU  78  11.962 -11.437 -14.335
  600    HB3  GLU  78           HB3      GLU  78  11.997  -9.849 -13.581
  601    HG2  GLU  78           HG2      GLU  78  13.024  -9.670 -15.714
  602    HG3  GLU  78           HG3      GLU  78  14.290  -9.538 -14.494
  603    H    HIS  79           H        HIS  79  15.078 -11.568 -10.895
  604    HA   HIS  79           HA       HIS  79  16.224  -9.010 -10.878
  605    HB2  HIS  79           HB2      HIS  79  13.807  -8.720  -9.831
  606    HB3  HIS  79           HB3      HIS  79  14.609  -9.329  -8.387
  607    HD1  HIS  79           HD1      HIS  79  15.179  -7.418  -6.939
  608    HD2  HIS  79           HD2      HIS  79  15.747  -6.523 -10.957
  609    HE1  HIS  79           HE1      HIS  79  16.098  -5.077  -6.983
  610    HE2  HIS  79           HE2      HIS  79  16.516  -4.591  -9.419
  611    H    HIS  80           H        HIS  80  18.205  -9.352 -10.137
  612    HA   HIS  80           HA       HIS  80  19.977 -10.217  -9.005
  613    HB2  HIS  80           HB2      HIS  80  17.968 -10.985  -6.880
  614    HB3  HIS  80           HB3      HIS  80  19.700 -10.746  -6.669
  615    HD1  HIS  80           HD1      HIS  80  17.748  -9.156  -4.949
  616    HD2  HIS  80           HD2      HIS  80  19.255  -7.795  -8.574
  617    HE1  HIS  80           HE1      HIS  80  17.548  -6.650  -4.863
  618    HE2  HIS  80           HE2      HIS  80  18.387  -5.855  -7.101
  619    H    HIS  81           H        HIS  81  18.760 -11.861 -10.923
  620    HA   HIS  81           HA       HIS  81  18.268 -14.486 -10.011
  621    HB2  HIS  81           HB2      HIS  81  18.546 -15.151 -12.352
  622    HB3  HIS  81           HB3      HIS  81  17.564 -13.695 -12.229
  623    HD1  HIS  81           HD1      HIS  81  20.856 -14.939 -13.471
  624    HD2  HIS  81           HD2      HIS  81  18.726 -11.376 -13.304
  625    HE1  HIS  81           HE1      HIS  81  22.072 -13.357 -15.001
  626    HE2  HIS  81           HE2      HIS  81  20.814 -11.182 -14.818
  627    H    HIS  82           H        HIS  82  19.589 -16.124  -9.492
  628    HA   HIS  82           HA       HIS  82  22.477 -15.631  -9.647
  629    HB2  HIS  82           HB2      HIS  82  22.694 -17.326  -7.894
  630    HB3  HIS  82           HB3      HIS  82  21.568 -16.064  -7.404
  631    HD1  HIS  82           HD1      HIS  82  19.170 -16.750  -6.934
  632    HD2  HIS  82           HD2      HIS  82  21.482 -19.837  -8.482
  633    HE1  HIS  82           HE1      HIS  82  17.778 -18.828  -6.674
  634    HE2  HIS  82           HE2      HIS  82  19.232 -20.696  -7.538
  635    H    HIS  83           H        HIS  83  19.957 -17.823 -10.647
  636    HA   HIS  83           HA       HIS  83  21.887 -19.705 -11.762
  637    HB2  HIS  83           HB2      HIS  83  19.936 -21.091 -12.287
  638    HB3  HIS  83           HB3      HIS  83  19.923 -20.607 -10.595
  639    HD1  HIS  83           HD1      HIS  83  18.191 -18.688  -9.954
  640    HD2  HIS  83           HD2      HIS  83  17.724 -20.354 -13.732
  641    HE1  HIS  83           HE1      HIS  83  15.888 -18.014 -10.706
  642    HE2  HIS  83           HE2      HIS  83  15.661 -18.960 -13.030
  643    H    HIS  84           H        HIS  84  21.918 -20.274 -13.979
  644    HA   HIS  84           HA       HIS  84  21.413 -18.026 -15.730
  645    HB2  HIS  84           HB2      HIS  84  23.493 -19.572 -15.725
  646    HB3  HIS  84           HB3      HIS  84  22.475 -20.693 -16.622
  647    HD1  HIS  84           HD1      HIS  84  23.817 -17.157 -16.896
  648    HD2  HIS  84           HD2      HIS  84  22.343 -20.208 -19.301
  649    HE1  HIS  84           HE1      HIS  84  24.160 -16.374 -19.261
  650    HE2  HIS  84           HE2      HIS  84  23.341 -18.274 -20.698
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1   8.196  12.866 -12.777
    2    H2   MET   1           H2       MET   1   6.891  13.628 -13.587
    3    H3   MET   1           H3       MET   1   6.691  13.069 -11.976
    4    HA   MET   1           HA       MET   1   5.643  11.623 -13.553
    5    HB2  MET   1           HB2      MET   1   8.447  11.570 -14.652
    6    HB3  MET   1           HB3      MET   1   7.304  10.276 -14.985
    7    HG2  MET   1           HG2      MET   1   6.715  13.159 -15.577
    8    HG3  MET   1           HG3      MET   1   7.501  12.082 -16.730
    9    HE1  MET   1           HE1      MET   1   6.004  11.676 -18.662
   10    HE2  MET   1           HE2      MET   1   5.242  13.177 -18.138
   11    HE3  MET   1           HE3      MET   1   4.246  11.792 -18.585
   12    H    GLU   2           H        GLU   2   5.388  10.876 -11.364
   13    HA   GLU   2           HA       GLU   2   7.252   8.699 -10.680
   14    HB2  GLU   2           HB2      GLU   2   5.676  10.388  -8.730
   15    HB3  GLU   2           HB3      GLU   2   6.825   9.120  -8.326
   16    HG2  GLU   2           HG2      GLU   2   8.044  11.048  -7.991
   17    HG3  GLU   2           HG3      GLU   2   8.530  10.557  -9.613
   18    H    ASN   3           H        ASN   3   6.299   6.817 -11.067
   19    HA   ASN   3           HA       ASN   3   3.924   6.023  -9.773
   20    HB2  ASN   3           HB2      ASN   3   2.914   7.459 -11.540
   21    HB3  ASN   3           HB3      ASN   3   3.641   6.416 -12.759
   22   HD21  ASN   3          HD21      ASN   3   1.938   5.789  -9.711
   23   HD22  ASN   3          HD22      ASN   3   0.748   4.739 -10.395
   24    H    ASP   4           H        ASP   4   3.952   3.867  -9.566
   25    HA   ASP   4           HA       ASP   4   4.998   2.147 -11.624
   26    HB2  ASP   4           HB2      ASP   4   6.603   2.848  -9.226
   27    HB3  ASP   4           HB3      ASP   4   6.570   1.147  -9.683
   28    HA   PRO   5           HA       PRO   5   2.296  -0.753  -9.698
   29    HB2  PRO   5           HB2      PRO   5   3.483  -3.128 -10.178
   30    HB3  PRO   5           HB3      PRO   5   2.766  -2.154 -11.467
   31    HG2  PRO   5           HG2      PRO   5   5.638  -2.407 -10.660
   32    HG3  PRO   5           HG3      PRO   5   4.931  -2.384 -12.286
   33    HD2  PRO   5           HD2      PRO   5   6.094  -0.206 -11.139
   34    HD3  PRO   5           HD3      PRO   5   4.774  -0.091 -12.320
   35    H    THR   6           H        THR   6   5.631  -0.737  -8.683
   36    HA   THR   6           HA       THR   6   5.084  -2.371  -6.339
   37    HB   THR   6           HB       THR   6   7.461  -2.228  -5.896
   38    HG1  THR   6           HG1      THR   6   8.737  -0.794  -6.830
   39   HG21  THR   6          HG21      THR   6   7.075  -2.585  -8.857
   40   HG22  THR   6          HG22      THR   6   6.792  -3.826  -7.636
   41   HG23  THR   6          HG23      THR   6   8.417  -3.187  -7.884
   42    H    VAL   7           H        VAL   7   3.560  -0.078  -6.324
   43    HA   VAL   7           HA       VAL   7   4.625   1.273  -3.980
   44    HB   VAL   7           HB       VAL   7   4.147   3.484  -4.762
   45   HG11  VAL   7          HG11      VAL   7   6.006   3.771  -6.067
   46   HG12  VAL   7          HG12      VAL   7   5.645   2.376  -7.083
   47   HG13  VAL   7          HG13      VAL   7   6.306   2.142  -5.466
   48   HG21  VAL   7          HG21      VAL   7   2.681   2.024  -6.763
   49   HG22  VAL   7          HG22      VAL   7   3.707   3.262  -7.486
   50   HG23  VAL   7          HG23      VAL   7   2.524   3.702  -6.255
   51    H    LEU   8           H        LEU   8   2.763   3.067  -3.400
   52    HA   LEU   8           HA       LEU   8   0.119   1.911  -3.747
   53    HB2  LEU   8           HB2      LEU   8   1.549   1.099  -1.588
   54    HB3  LEU   8           HB3      LEU   8   0.756   2.518  -0.932
   55    HG   LEU   8           HG       LEU   8  -0.551   0.547  -0.436
   56   HD11  LEU   8          HD11      LEU   8  -2.565   1.474  -0.893
   57   HD12  LEU   8          HD12      LEU   8  -2.188   1.728  -2.597
   58   HD13  LEU   8          HD13      LEU   8  -1.551   2.832  -1.378
   59   HD21  LEU   8          HD21      LEU   8  -1.161   0.043  -3.298
   60   HD22  LEU   8          HD22      LEU   8  -1.153  -1.068  -1.928
   61   HD23  LEU   8          HD23      LEU   8   0.369  -0.557  -2.658
   62    H    ARG   9           H        ARG   9  -1.532   3.378  -3.503
   63    HA   ARG   9           HA       ARG   9  -0.954   6.031  -2.450
   64    HB2  ARG   9           HB2      ARG   9  -1.562   5.434  -5.324
   65    HB3  ARG   9           HB3      ARG   9  -2.113   6.944  -4.614
   66    HG2  ARG   9           HG2      ARG   9  -0.072   7.844  -4.657
   67    HG3  ARG   9           HG3      ARG   9   0.694   6.365  -4.075
   68    HD2  ARG   9           HD2      ARG   9   0.513   5.413  -6.342
   69    HD3  ARG   9           HD3      ARG   9  -0.180   6.932  -6.905
   70    HE   ARG   9           HE       ARG   9   2.591   6.385  -6.344
   71   HH11  ARG   9          HH11      ARG   9   0.162   8.869  -6.681
   72   HH12  ARG   9          HH12      ARG   9   1.308  10.114  -7.049
   73   HH21  ARG   9          HH21      ARG   9   4.099   8.022  -6.828
   74   HH22  ARG   9          HH22      ARG   9   3.542   9.634  -7.133
   75    H    SER  10           H        SER  10  -2.741   7.087  -1.679
   76    HA   SER  10           HA       SER  10  -5.033   5.514  -1.105
   77    HB2  SER  10           HB2      SER  10  -3.950   8.059  -0.286
   78    HB3  SER  10           HB3      SER  10  -5.675   8.216  -0.613
   79    HG   SER  10           HG       SER  10  -4.618   6.125   0.972
   80    HA   PRO  11           HA       PRO  11  -7.547   6.423  -4.627
   81    HB2  PRO  11           HB2      PRO  11 -10.002   5.947  -3.614
   82    HB3  PRO  11           HB3      PRO  11  -8.843   4.649  -3.923
   83    HG2  PRO  11           HG2      PRO  11  -9.517   6.012  -1.344
   84    HG3  PRO  11           HG3      PRO  11  -9.271   4.286  -1.666
   85    HD2  PRO  11           HD2      PRO  11  -7.358   5.884  -0.569
   86    HD3  PRO  11           HD3      PRO  11  -6.982   4.468  -1.569
   87    H    SER  12           H        SER  12  -8.153   8.038  -1.576
   88    HA   SER  12           HA       SER  12  -8.818  10.481  -2.980
   89    HB2  SER  12           HB2      SER  12 -10.899  10.836  -1.636
   90    HB3  SER  12           HB3      SER  12 -11.027   9.513  -2.795
   91    HG   SER  12           HG       SER  12 -11.056   9.463  -0.036
   92    H    ALA  13           H        ALA  13  -9.202  12.294  -1.324
   93    HA   ALA  13           HA       ALA  13  -6.981  12.274   0.488
   94    HB1  ALA  13           HB1      ALA  13  -7.926  14.589   1.075
   95    HB2  ALA  13           HB2      ALA  13  -9.056  14.308  -0.249
   96    HB3  ALA  13           HB3      ALA  13  -7.321  14.329  -0.561
   97    H    GLY  14           H        GLY  14  -7.139  11.153   2.333
   98    HA2  GLY  14           HA2      GLY  14  -9.536  11.614   3.996
   99    HA3  GLY  14           HA3      GLY  14  -8.825  10.015   3.835
  100    H    LYS  15           H        LYS  15  -7.949   9.524   5.738
  101    HA   LYS  15           HA       LYS  15  -5.733  11.051   6.723
  102    HB2  LYS  15           HB2      LYS  15  -7.737  12.260   7.655
  103    HB3  LYS  15           HB3      LYS  15  -8.127  10.796   8.547
  104    HG2  LYS  15           HG2      LYS  15  -5.375  11.714   8.912
  105    HG3  LYS  15           HG3      LYS  15  -6.601  12.850   9.478
  106    HD2  LYS  15           HD2      LYS  15  -7.034  10.026  10.209
  107    HD3  LYS  15           HD3      LYS  15  -5.639  10.806  10.958
  108    HE2  LYS  15           HE2      LYS  15  -8.192  12.310  10.943
  109    HE3  LYS  15           HE3      LYS  15  -8.089  10.910  12.010
  110    HZ1  LYS  15           HZ1      LYS  15  -6.375  13.327  12.019
  111    HZ2  LYS  15           HZ2      LYS  15  -5.971  11.919  12.864
  112    HZ3  LYS  15           HZ3      LYS  15  -7.383  12.763  13.255
  113    H    LEU  16           H        LEU  16  -4.370   9.820   7.941
  114    HA   LEU  16           HA       LEU  16  -4.726   7.009   7.907
  115    HB2  LEU  16           HB2      LEU  16  -2.543   8.373   7.886
  116    HB3  LEU  16           HB3      LEU  16  -2.735   8.464   9.624
  117    HG   LEU  16           HG       LEU  16  -2.547   6.076   9.844
  118   HD11  LEU  16          HD11      LEU  16  -1.995   4.738   7.744
  119   HD12  LEU  16          HD12      LEU  16  -2.672   6.096   6.845
  120   HD13  LEU  16          HD13      LEU  16  -3.679   5.205   7.986
  121   HD21  LEU  16          HD21      LEU  16  -0.307   6.008   9.611
  122   HD22  LEU  16          HD22      LEU  16  -0.506   7.709   9.191
  123   HD23  LEU  16          HD23      LEU  16  -0.359   6.498   7.918
  124    H    THR  17           H        THR  17  -6.467   6.316   9.078
  125    HA   THR  17           HA       THR  17  -7.008   7.255  11.728
  126    HB   THR  17           HB       THR  17  -8.767   6.455  10.139
  127    HG1  THR  17           HG1      THR  17  -9.918   6.059  11.835
  128   HG21  THR  17          HG21      THR  17  -8.157   3.655  10.929
  129   HG22  THR  17          HG22      THR  17  -7.349   4.356   9.528
  130   HG23  THR  17          HG23      THR  17  -9.109   4.267   9.577
  131    H    GLN  18           H        GLN  18  -5.576   4.328  10.344
  132    HA   GLN  18           HA       GLN  18  -4.040   3.846  12.692
  133    HB2  GLN  18           HB2      GLN  18  -6.581   2.909  12.938
  134    HB3  GLN  18           HB3      GLN  18  -5.785   1.511  12.228
  135    HG2  GLN  18           HG2      GLN  18  -4.020   2.215  14.174
  136    HG3  GLN  18           HG3      GLN  18  -5.561   2.648  14.912
  137   HE21  GLN  18          HE21      GLN  18  -4.127   0.714  16.078
  138   HE22  GLN  18          HE22      GLN  18  -4.844  -0.835  15.815
  139    H    TYR  19           H        TYR  19  -3.635   1.065  12.343
  140    HA   TYR  19           HA       TYR  19  -2.921   0.664   9.557
  141    HB2  TYR  19           HB2      TYR  19  -0.544   0.129  10.179
  142    HB3  TYR  19           HB3      TYR  19  -0.965   1.835  10.287
  143    HD1  TYR  19           HD1      TYR  19  -0.222  -1.206  12.226
  144    HD2  TYR  19           HD2      TYR  19  -0.957   2.982  12.395
  145    HE1  TYR  19           HE1      TYR  19   0.572  -1.166  14.553
  146    HE2  TYR  19           HE2      TYR  19  -0.164   3.033  14.722
  147    HH   TYR  19           HH       TYR  19  -0.049   0.845  16.675
  148    H    THR  20           H        THR  20  -2.881  -1.450   8.988
  149    HA   THR  20           HA       THR  20  -3.590  -3.375  11.067
  150    HB   THR  20           HB       THR  20  -4.505  -4.724   9.380
  151    HG1  THR  20           HG1      THR  20  -2.803  -3.305   7.639
  152   HG21  THR  20          HG21      THR  20  -5.741  -3.185   7.815
  153   HG22  THR  20          HG22      THR  20  -4.886  -1.855   8.596
  154   HG23  THR  20          HG23      THR  20  -5.961  -2.887   9.539
  155    H    VAL  21           H        VAL  21  -0.873  -2.412   9.277
  156    HA   VAL  21           HA       VAL  21   0.624  -4.694  10.278
  157    HB   VAL  21           HB       VAL  21   1.720  -5.130   8.123
  158   HG11  VAL  21          HG11      VAL  21  -0.053  -6.410   7.126
  159   HG12  VAL  21          HG12      VAL  21  -1.273  -5.410   7.913
  160   HG13  VAL  21          HG13      VAL  21  -0.235  -6.457   8.880
  161   HG21  VAL  21          HG21      VAL  21   1.598  -3.519   6.578
  162   HG22  VAL  21          HG22      VAL  21   0.169  -2.802   7.321
  163   HG23  VAL  21          HG23      VAL  21  -0.004  -4.155   6.203
  164    H    GLU  22           H        GLU  22   2.743  -4.243  10.711
  165    HA   GLU  22           HA       GLU  22   3.485  -1.520  10.969
  166    HB2  GLU  22           HB2      GLU  22   5.622  -2.385  11.787
  167    HB3  GLU  22           HB3      GLU  22   4.276  -3.249  12.515
  168    HG2  GLU  22           HG2      GLU  22   4.946  -5.200  11.688
  169    HG3  GLU  22           HG3      GLU  22   5.217  -4.521  10.083
  170    H    ASP  23           H        ASP  23   6.014  -1.152  10.266
  171    HA   ASP  23           HA       ASP  23   5.915  -0.558   7.534
  172    HB2  ASP  23           HB2      ASP  23   8.071  -0.584   9.602
  173    HB3  ASP  23           HB3      ASP  23   8.532  -0.420   7.910
  174    H    GLY  24           H        GLY  24   6.476  -1.641   5.729
  175    HA2  GLY  24           HA2      GLY  24   7.199  -3.347   4.367
  176    HA3  GLY  24           HA3      GLY  24   8.316  -3.792   5.649
  177    H    GLY  25           H        GLY  25   4.887  -3.648   6.235
  178    HA2  GLY  25           HA2      GLY  25   4.801  -6.311   7.193
  179    HA3  GLY  25           HA3      GLY  25   3.412  -5.273   6.908
  180    H    HIS  26           H        HIS  26   4.928  -8.079   5.983
  181    HA   HIS  26           HA       HIS  26   4.459  -8.178   3.215
  182    HB2  HIS  26           HB2      HIS  26   4.572 -10.638   3.488
  183    HB3  HIS  26           HB3      HIS  26   5.890  -9.808   4.309
  184    HD1  HIS  26           HD1      HIS  26   5.806  -9.764   6.928
  185    HD2  HIS  26           HD2      HIS  26   2.871 -12.089   5.125
  186    HE1  HIS  26           HE1      HIS  26   4.855 -11.191   8.767
  187    HE2  HIS  26           HE2      HIS  26   3.025 -12.530   7.669
  188    H    VAL  27           H        VAL  27   2.618  -8.137   2.129
  189    HA   VAL  27           HA       VAL  27   0.276  -9.513   3.198
  190    HB   VAL  27           HB       VAL  27  -1.217  -7.619   2.779
  191   HG11  VAL  27          HG11      VAL  27  -0.154  -8.032   5.022
  192   HG12  VAL  27          HG12      VAL  27  -0.730  -6.387   4.749
  193   HG13  VAL  27          HG13      VAL  27   0.992  -6.750   4.629
  194   HG21  VAL  27          HG21      VAL  27  -0.394  -6.151   1.269
  195   HG22  VAL  27          HG22      VAL  27   1.276  -6.397   1.779
  196   HG23  VAL  27          HG23      VAL  27   0.215  -5.344   2.714
  197    H    GLU  28           H        GLU  28  -0.924 -10.474   1.662
  198    HA   GLU  28           HA       GLU  28   0.000 -10.313  -1.078
  199    HB2  GLU  28           HB2      GLU  28  -1.427 -12.221  -1.485
  200    HB3  GLU  28           HB3      GLU  28  -0.512 -12.492  -0.008
  201    HG2  GLU  28           HG2      GLU  28  -2.980 -11.226   0.650
  202    HG3  GLU  28           HG3      GLU  28  -3.300 -12.614  -0.390
  203    H    ALA  29           H        ALA  29  -1.664 -10.254  -2.854
  204    HA   ALA  29           HA       ALA  29  -2.958  -7.842  -2.985
  205    HB1  ALA  29           HB1      ALA  29  -2.517  -9.781  -4.759
  206    HB2  ALA  29           HB2      ALA  29  -3.680  -8.484  -5.035
  207    HB3  ALA  29           HB3      ALA  29  -4.234 -10.060  -4.470
  208    H    GLY  30           H        GLY  30  -4.793  -6.991  -2.222
  209    HA2  GLY  30           HA2      GLY  30  -7.087  -7.031  -1.637
  210    HA3  GLY  30           HA3      GLY  30  -6.972  -8.768  -1.403
  211    H    SER  31           H        SER  31  -4.457  -8.362   0.201
  212    HA   SER  31           HA       SER  31  -5.720  -8.212   2.751
  213    HB2  SER  31           HB2      SER  31  -3.843  -9.680   2.531
  214    HB3  SER  31           HB3      SER  31  -2.821  -8.381   1.918
  215    HG   SER  31           HG       SER  31  -2.785  -9.088   4.302
  216    H    SER  32           H        SER  32  -6.074  -6.500   4.000
  217    HA   SER  32           HA       SER  32  -5.454  -3.876   3.138
  218    HB2  SER  32           HB2      SER  32  -6.228  -3.328   5.570
  219    HB3  SER  32           HB3      SER  32  -7.394  -3.987   4.423
  220    HG   SER  32           HG       SER  32  -6.042  -5.320   6.518
  221    H    TYR  33           H        TYR  33  -3.909  -2.442   3.780
  222    HA   TYR  33           HA       TYR  33  -1.752  -3.535   5.459
  223    HB2  TYR  33           HB2      TYR  33  -0.217  -2.091   4.262
  224    HB3  TYR  33           HB3      TYR  33  -1.135  -3.052   3.108
  225    HD1  TYR  33           HD1      TYR  33  -0.760   0.321   4.567
  226    HD2  TYR  33           HD2      TYR  33  -2.550  -2.019   1.498
  227    HE1  TYR  33           HE1      TYR  33  -1.428   2.378   3.396
  228    HE2  TYR  33           HE2      TYR  33  -3.222   0.031   0.318
  229    HH   TYR  33           HH       TYR  33  -3.011   3.140   1.769
  230    H    ALA  34           H        ALA  34  -4.033  -0.963   5.104
  231    HA   ALA  34           HA       ALA  34  -3.617  -0.038   7.742
  232    HB1  ALA  34           HB1      ALA  34  -2.880   2.102   5.806
  233    HB2  ALA  34           HB2      ALA  34  -1.650   0.946   6.316
  234    HB3  ALA  34           HB3      ALA  34  -2.481   1.940   7.516
  235    H    GLU  35           H        GLU  35  -5.171   1.473   8.402
  236    HA   GLU  35           HA       GLU  35  -7.453   1.661   6.587
  237    HB2  GLU  35           HB2      GLU  35  -7.259   2.196   9.555
  238    HB3  GLU  35           HB3      GLU  35  -8.739   2.254   8.608
  239    HG2  GLU  35           HG2      GLU  35  -8.964   0.025   8.580
  240    HG3  GLU  35           HG3      GLU  35  -7.233  -0.253   8.394
  241    H    MET  36           H        MET  36  -8.756   3.680   6.650
  242    HA   MET  36           HA       MET  36  -7.340   6.109   7.330
  243    HB2  MET  36           HB2      MET  36  -7.334   7.063   5.127
  244    HB3  MET  36           HB3      MET  36  -6.505   5.516   5.057
  245    HG2  MET  36           HG2      MET  36  -8.628   4.508   4.211
  246    HG3  MET  36           HG3      MET  36  -9.291   6.138   4.115
  247    HE1  MET  36           HE1      MET  36  -7.615   7.991   1.625
  248    HE2  MET  36           HE2      MET  36  -8.954   7.720   2.740
  249    HE3  MET  36           HE3      MET  36  -9.047   7.115   1.085
  250    H    GLU  37           H        GLU  37  -8.797   7.327   8.311
  251    HA   GLU  37           HA       GLU  37 -11.627   6.946   7.744
  252    HB2  GLU  37           HB2      GLU  37 -10.661   7.072  10.091
  253    HB3  GLU  37           HB3      GLU  37 -10.410   8.788   9.800
  254    HG2  GLU  37           HG2      GLU  37 -13.117   7.856   9.207
  255    HG3  GLU  37           HG3      GLU  37 -12.641   7.687  10.896
  256    H    VAL  38           H        VAL  38 -12.246   7.992   5.950
  257    HA   VAL  38           HA       VAL  38 -11.302  10.701   5.430
  258    HB   VAL  38           HB       VAL  38 -11.381   9.086   3.566
  259   HG11  VAL  38          HG11      VAL  38 -14.315   9.050   4.201
  260   HG12  VAL  38          HG12      VAL  38 -13.201   7.688   4.081
  261   HG13  VAL  38          HG13      VAL  38 -13.682   8.566   2.628
  262   HG21  VAL  38          HG21      VAL  38 -13.453  11.184   3.021
  263   HG22  VAL  38          HG22      VAL  38 -12.185  10.573   1.958
  264   HG23  VAL  38          HG23      VAL  38 -11.768  11.611   3.321
  265    H    MET  39           H        MET  39 -12.969  12.345   4.741
  266    HA   MET  39           HA       MET  39 -14.743  12.881   6.805
  267    HB2  MET  39           HB2      MET  39 -15.110  13.903   3.994
  268    HB3  MET  39           HB3      MET  39 -15.539  14.701   5.501
  269    HG2  MET  39           HG2      MET  39 -12.892  14.405   5.864
  270    HG3  MET  39           HG3      MET  39 -12.954  14.541   4.108
  271    HE1  MET  39           HE1      MET  39 -13.641  17.807   7.200
  272    HE2  MET  39           HE2      MET  39 -12.721  16.311   7.359
  273    HE3  MET  39           HE3      MET  39 -14.484  16.268   7.377
  274    H    LYS  40           H        LYS  40 -15.154  10.854   4.039
  275    HA   LYS  40           HA       LYS  40 -18.024  10.867   4.080
  276    HB2  LYS  40           HB2      LYS  40 -15.914   9.340   2.620
  277    HB3  LYS  40           HB3      LYS  40 -17.543   8.680   2.672
  278    HG2  LYS  40           HG2      LYS  40 -17.719   9.890   0.769
  279    HG3  LYS  40           HG3      LYS  40 -18.158  11.150   1.925
  280    HD2  LYS  40           HD2      LYS  40 -16.150  12.244   1.701
  281    HD3  LYS  40           HD3      LYS  40 -15.283  10.779   1.233
  282    HE2  LYS  40           HE2      LYS  40 -17.312  12.190  -0.494
  283    HE3  LYS  40           HE3      LYS  40 -15.569  12.422  -0.615
  284    HZ1  LYS  40           HZ1      LYS  40 -17.095   9.933  -1.135
  285    HZ2  LYS  40           HZ2      LYS  40 -15.408   9.978  -1.015
  286    HZ3  LYS  40           HZ3      LYS  40 -16.191  10.840  -2.242
  287    H    MET  41           H        MET  41 -15.905   8.040   4.439
  288    HA   MET  41           HA       MET  41 -17.103   7.350   6.981
  289    HB2  MET  41           HB2      MET  41 -18.652   5.960   6.172
  290    HB3  MET  41           HB3      MET  41 -18.126   6.286   4.530
  291    HG2  MET  41           HG2      MET  41 -16.385   4.516   4.830
  292    HG3  MET  41           HG3      MET  41 -17.143   4.125   6.372
  293    HE1  MET  41           HE1      MET  41 -18.207   1.120   4.162
  294    HE2  MET  41           HE2      MET  41 -18.000   1.544   5.862
  295    HE3  MET  41           HE3      MET  41 -16.713   1.884   4.705
  296    H    ILE  42           H        ILE  42 -16.168   5.158   7.741
  297    HA   ILE  42           HA       ILE  42 -13.305   5.338   7.459
  298    HB   ILE  42           HB       ILE  42 -14.303   4.889   9.653
  299   HG12  ILE  42          HG12      ILE  42 -12.843   3.042  10.318
  300   HG13  ILE  42          HG13      ILE  42 -12.689   2.537   8.639
  301   HG21  ILE  42          HG21      ILE  42 -16.243   3.634   9.068
  302   HG22  ILE  42          HG22      ILE  42 -15.237   2.611  10.094
  303   HG23  ILE  42          HG23      ILE  42 -15.267   2.352   8.350
  304   HD11  ILE  42          HD11      ILE  42 -11.951   5.295   8.920
  305   HD12  ILE  42          HD12      ILE  42 -11.005   3.933   8.322
  306   HD13  ILE  42          HD13      ILE  42 -11.044   4.289  10.049
  307    H    MET  43           H        MET  43 -11.958   3.955   6.407
  308    HA   MET  43           HA       MET  43 -13.038   1.500   5.256
  309    HB2  MET  43           HB2      MET  43 -12.302   2.020   3.014
  310    HB3  MET  43           HB3      MET  43 -13.398   3.279   3.565
  311    HG2  MET  43           HG2      MET  43 -11.114   4.417   4.287
  312    HG3  MET  43           HG3      MET  43 -10.498   3.402   2.984
  313    HE1  MET  43           HE1      MET  43 -11.438   5.081  -0.154
  314    HE2  MET  43           HE2      MET  43 -11.098   3.525   0.602
  315    HE3  MET  43           HE3      MET  43  -9.994   4.880   0.839
  316    H    THR  44           H        THR  44 -11.265   0.226   4.142
  317    HA   THR  44           HA       THR  44  -8.713   0.616   5.561
  318    HB   THR  44           HB       THR  44  -9.323  -2.130   4.721
  319    HG1  THR  44           HG1      THR  44 -11.400  -1.493   5.382
  320   HG21  THR  44          HG21      THR  44  -7.986  -2.656   6.404
  321   HG22  THR  44          HG22      THR  44  -8.913  -1.682   7.545
  322   HG23  THR  44          HG23      THR  44  -7.656  -0.931   6.563
  323    H    LEU  45           H        LEU  45  -6.878   0.561   4.386
  324    HA   LEU  45           HA       LEU  45  -7.160   0.339   1.491
  325    HB2  LEU  45           HB2      LEU  45  -4.835   1.254   3.185
  326    HB3  LEU  45           HB3      LEU  45  -4.870   1.268   1.433
  327    HG   LEU  45           HG       LEU  45  -7.130   2.707   2.102
  328   HD11  LEU  45          HD11      LEU  45  -5.208   2.850   4.296
  329   HD12  LEU  45          HD12      LEU  45  -6.903   3.334   4.234
  330   HD13  LEU  45          HD13      LEU  45  -5.652   4.423   3.634
  331   HD21  LEU  45          HD21      LEU  45  -6.159   4.256   0.802
  332   HD22  LEU  45          HD22      LEU  45  -4.907   3.037   0.568
  333   HD23  LEU  45          HD23      LEU  45  -4.691   4.301   1.778
  334    H    ASN  46           H        ASN  46  -6.135  -1.160   0.239
  335    HA   ASN  46           HA       ASN  46  -4.452  -3.152   1.592
  336    HB2  ASN  46           HB2      ASN  46  -5.656  -4.798  -0.103
  337    HB3  ASN  46           HB3      ASN  46  -6.344  -4.456   1.480
  338   HD21  ASN  46          HD21      ASN  46  -6.322  -2.854  -1.692
  339   HD22  ASN  46          HD22      ASN  46  -8.031  -2.615  -1.769
  340    H    VAL  47           H        VAL  47  -3.463  -4.669  -0.168
  341    HA   VAL  47           HA       VAL  47  -2.198  -2.903  -2.116
  342    HB   VAL  47           HB       VAL  47  -0.558  -4.683  -2.427
  343   HG11  VAL  47          HG11      VAL  47  -0.987  -4.366   0.530
  344   HG12  VAL  47          HG12      VAL  47  -0.456  -3.033  -0.496
  345   HG13  VAL  47          HG13      VAL  47   0.535  -4.485  -0.354
  346   HG21  VAL  47          HG21      VAL  47  -1.519  -6.738  -2.217
  347   HG22  VAL  47          HG22      VAL  47  -2.534  -6.251  -0.860
  348   HG23  VAL  47          HG23      VAL  47  -0.823  -6.595  -0.604
  349    H    GLN  48           H        GLN  48  -1.991  -3.453  -4.331
  350    HA   GLN  48           HA       GLN  48  -4.332  -4.799  -5.375
  351    HB2  GLN  48           HB2      GLN  48  -3.782  -3.842  -7.481
  352    HB3  GLN  48           HB3      GLN  48  -3.482  -2.606  -6.270
  353    HG2  GLN  48           HG2      GLN  48  -1.260  -4.356  -7.246
  354    HG3  GLN  48           HG3      GLN  48  -1.779  -2.948  -8.169
  355   HE21  GLN  48          HE21      GLN  48   0.059  -4.083  -5.558
  356   HE22  GLN  48          HE22      GLN  48   0.567  -2.552  -4.938
  357    H    GLU  49           H        GLU  49  -1.113  -5.640  -4.685
  358    HA   GLU  49           HA       GLU  49  -1.489  -8.228  -5.916
  359    HB2  GLU  49           HB2      GLU  49   0.643  -6.313  -6.838
  360    HB3  GLU  49           HB3      GLU  49   0.822  -8.053  -7.017
  361    HG2  GLU  49           HG2      GLU  49  -1.253  -8.107  -8.335
  362    HG3  GLU  49           HG3      GLU  49  -1.361  -6.353  -8.200
  363    H    ARG  50           H        ARG  50   0.591  -9.593  -5.523
  364    HA   ARG  50           HA       ARG  50   1.032  -9.626  -2.722
  365    HB2  ARG  50           HB2      ARG  50   2.080 -11.188  -5.050
  366    HB3  ARG  50           HB3      ARG  50   2.864 -11.350  -3.485
  367    HG2  ARG  50           HG2      ARG  50   1.334 -13.076  -3.468
  368    HG3  ARG  50           HG3      ARG  50   0.478 -11.800  -2.599
  369    HD2  ARG  50           HD2      ARG  50  -1.132 -12.569  -4.074
  370    HD3  ARG  50           HD3      ARG  50  -0.463 -11.180  -4.929
  371    HE   ARG  50           HE       ARG  50   0.876 -13.598  -5.622
  372   HH11  ARG  50          HH11      ARG  50  -2.014 -11.737  -6.223
  373   HH12  ARG  50          HH12      ARG  50  -2.262 -12.398  -7.804
  374   HH21  ARG  50          HH21      ARG  50   0.552 -14.469  -7.701
  375   HH22  ARG  50          HH22      ARG  50  -0.806 -13.950  -8.643
  376    H    GLY  51           H        GLY  51   2.622  -8.791  -1.507
  377    HA2  GLY  51           HA2      GLY  51   5.246  -8.335  -2.112
  378    HA3  GLY  51           HA3      GLY  51   4.424  -6.897  -2.700
  379    H    ARG  52           H        ARG  52   6.289  -6.556  -0.784
  380    HA   ARG  52           HA       ARG  52   4.932  -6.487   1.791
  381    HB2  ARG  52           HB2      ARG  52   7.757  -6.121   0.883
  382    HB3  ARG  52           HB3      ARG  52   7.259  -5.483   2.446
  383    HG2  ARG  52           HG2      ARG  52   6.289  -7.892   2.765
  384    HG3  ARG  52           HG3      ARG  52   7.484  -8.302   1.532
  385    HD2  ARG  52           HD2      ARG  52   8.940  -6.737   3.208
  386    HD3  ARG  52           HD3      ARG  52   7.841  -7.528   4.337
  387    HE   ARG  52           HE       ARG  52   8.786  -9.559   2.787
  388   HH11  ARG  52          HH11      ARG  52  10.277  -7.080   4.740
  389   HH12  ARG  52          HH12      ARG  52  11.663  -8.043   5.127
  390   HH21  ARG  52          HH21      ARG  52  10.609 -10.827   3.295
  391   HH22  ARG  52          HH22      ARG  52  11.852 -10.170   4.306
  392    H    VAL  53           H        VAL  53   4.007  -4.756   2.604
  393    HA   VAL  53           HA       VAL  53   4.018  -2.284   1.101
  394    HB   VAL  53           HB       VAL  53   2.599  -2.888   3.698
  395   HG11  VAL  53          HG11      VAL  53   2.325  -0.702   1.649
  396   HG12  VAL  53          HG12      VAL  53   2.659  -0.548   3.374
  397   HG13  VAL  53          HG13      VAL  53   1.065  -1.070   2.827
  398   HG21  VAL  53          HG21      VAL  53   1.533  -3.102   0.884
  399   HG22  VAL  53          HG22      VAL  53   0.655  -3.437   2.377
  400   HG23  VAL  53          HG23      VAL  53   1.999  -4.471   1.893
  401    H    LYS  54           H        LYS  54   5.193  -0.537   1.524
  402    HA   LYS  54           HA       LYS  54   6.576  -0.380   4.122
  403    HB2  LYS  54           HB2      LYS  54   7.570   0.895   1.580
  404    HB3  LYS  54           HB3      LYS  54   8.457   0.602   3.070
  405    HG2  LYS  54           HG2      LYS  54   8.135  -1.872   2.596
  406    HG3  LYS  54           HG3      LYS  54   7.620  -1.381   0.981
  407    HD2  LYS  54           HD2      LYS  54  10.237  -0.521   2.193
  408    HD3  LYS  54           HD3      LYS  54  10.063  -1.995   1.238
  409    HE2  LYS  54           HE2      LYS  54   9.112   0.626   0.155
  410    HE3  LYS  54           HE3      LYS  54  10.822   0.206   0.082
  411    HZ1  LYS  54           HZ1      LYS  54  10.256  -1.787  -1.143
  412    HZ2  LYS  54           HZ2      LYS  54   9.644  -0.426  -1.938
  413    HZ3  LYS  54           HZ3      LYS  54   8.607  -1.420  -1.046
  414    H    TYR  55           H        TYR  55   5.640   1.112   5.345
  415    HA   TYR  55           HA       TYR  55   3.911   3.113   4.470
  416    HB2  TYR  55           HB2      TYR  55   5.400   2.592   7.004
  417    HB3  TYR  55           HB3      TYR  55   4.618   4.156   6.797
  418    HD1  TYR  55           HD1      TYR  55   3.417   0.860   5.576
  419    HD2  TYR  55           HD2      TYR  55   2.866   4.032   8.357
  420    HE1  TYR  55           HE1      TYR  55   1.274  -0.127   6.268
  421    HE2  TYR  55           HE2      TYR  55   0.722   3.053   9.058
  422    HH   TYR  55           HH       TYR  55  -0.228  -0.095   8.200
  423    H    ILE  56           H        ILE  56   4.139   5.168   3.811
  424    HA   ILE  56           HA       ILE  56   6.878   6.204   3.538
  425    HB   ILE  56           HB       ILE  56   4.442   6.447   1.838
  426   HG12  ILE  56          HG12      ILE  56   6.063   6.181   0.038
  427   HG13  ILE  56          HG13      ILE  56   7.393   6.339   1.181
  428   HG21  ILE  56          HG21      ILE  56   5.589   8.429   0.688
  429   HG22  ILE  56          HG22      ILE  56   6.461   8.637   2.206
  430   HG23  ILE  56          HG23      ILE  56   4.701   8.746   2.178
  431   HD11  ILE  56          HD11      ILE  56   6.739   4.267   2.254
  432   HD12  ILE  56          HD12      ILE  56   7.008   4.022   0.528
  433   HD13  ILE  56          HD13      ILE  56   5.364   4.119   1.160
  434    H    LYS  57           H        LYS  57   3.560   7.409   3.976
  435    HA   LYS  57           HA       LYS  57   4.408   9.889   5.093
  436    HB2  LYS  57           HB2      LYS  57   1.960   8.664   4.244
  437    HB3  LYS  57           HB3      LYS  57   1.727   9.363   5.841
  438    HG2  LYS  57           HG2      LYS  57   2.736  10.803   3.396
  439    HG3  LYS  57           HG3      LYS  57   1.132  10.953   4.117
  440    HD2  LYS  57           HD2      LYS  57   2.226  11.762   6.208
  441    HD3  LYS  57           HD3      LYS  57   3.766  11.759   5.346
  442    HE2  LYS  57           HE2      LYS  57   2.560  13.979   5.470
  443    HE3  LYS  57           HE3      LYS  57   3.054  13.449   3.863
  444    HZ1  LYS  57           HZ1      LYS  57   0.333  12.996   4.949
  445    HZ2  LYS  57           HZ2      LYS  57   0.850  12.816   3.349
  446    HZ3  LYS  57           HZ3      LYS  57   0.746  14.358   4.034
  447    H    ARG  58           H        ARG  58   3.408  10.572   7.289
  448    HA   ARG  58           HA       ARG  58   4.385   8.666   9.269
  449    HB2  ARG  58           HB2      ARG  58   4.009  11.600   9.153
  450    HB3  ARG  58           HB3      ARG  58   3.752  10.853  10.724
  451    HG2  ARG  58           HG2      ARG  58   6.093   9.697   9.916
  452    HG3  ARG  58           HG3      ARG  58   6.225  11.326   9.249
  453    HD2  ARG  58           HD2      ARG  58   5.419  10.834  12.100
  454    HD3  ARG  58           HD3      ARG  58   7.111  10.935  11.616
  455    HE   ARG  58           HE       ARG  58   5.603  13.169  10.688
  456   HH11  ARG  58          HH11      ARG  58   7.196  11.843  13.495
  457   HH12  ARG  58          HH12      ARG  58   7.476  13.390  14.222
  458   HH21  ARG  58          HH21      ARG  58   5.970  15.204  11.642
  459   HH22  ARG  58          HH22      ARG  58   6.779  15.298  13.170
  460    HA   PRO  59           HA       PRO  59   0.471   7.515  10.922
  461    HB2  PRO  59           HB2      PRO  59   0.804   7.751  13.617
  462    HB3  PRO  59           HB3      PRO  59   1.523   6.450  12.662
  463    HG2  PRO  59           HG2      PRO  59   2.767   8.990  13.644
  464    HG3  PRO  59           HG3      PRO  59   3.438   7.348  13.630
  465    HD2  PRO  59           HD2      PRO  59   4.111   9.193  11.778
  466    HD3  PRO  59           HD3      PRO  59   4.002   7.463  11.392
  467    H    GLY  60           H        GLY  60  -1.419   8.540  10.996
  468    HA2  GLY  60           HA2      GLY  60  -3.026  10.032  11.820
  469    HA3  GLY  60           HA3      GLY  60  -1.750  10.920  12.639
  470    H    ALA  61           H        ALA  61  -0.345  10.718   9.836
  471    HA   ALA  61           HA       ALA  61  -0.797  13.338   9.030
  472    HB1  ALA  61           HB1      ALA  61   1.191  12.114   8.388
  473    HB2  ALA  61           HB2      ALA  61   0.365  12.716   6.950
  474    HB3  ALA  61           HB3      ALA  61   0.227  11.016   7.401
  475    H    VAL  62           H        VAL  62  -1.926  14.258   7.296
  476    HA   VAL  62           HA       VAL  62  -4.474  13.038   6.757
  477    HB   VAL  62           HB       VAL  62  -3.361  15.570   5.546
  478   HG11  VAL  62          HG11      VAL  62  -6.178  14.567   5.934
  479   HG12  VAL  62          HG12      VAL  62  -5.319  14.733   4.403
  480   HG13  VAL  62          HG13      VAL  62  -5.746  16.168   5.334
  481   HG21  VAL  62          HG21      VAL  62  -3.223  15.740   7.958
  482   HG22  VAL  62          HG22      VAL  62  -4.894  15.201   8.117
  483   HG23  VAL  62          HG23      VAL  62  -4.537  16.753   7.360
  484    H    LEU  63           H        LEU  63  -4.971  11.789   5.082
  485    HA   LEU  63           HA       LEU  63  -3.014  11.310   3.011
  486    HB2  LEU  63           HB2      LEU  63  -5.485  10.012   3.977
  487    HB3  LEU  63           HB3      LEU  63  -5.155   9.831   2.264
  488    HG   LEU  63           HG       LEU  63  -3.043   8.767   2.715
  489   HD11  LEU  63          HD11      LEU  63  -3.615   9.243   5.637
  490   HD12  LEU  63          HD12      LEU  63  -2.402  10.088   4.675
  491   HD13  LEU  63          HD13      LEU  63  -2.242   8.357   4.973
  492   HD21  LEU  63          HD21      LEU  63  -3.925   6.760   3.228
  493   HD22  LEU  63          HD22      LEU  63  -5.452   7.639   3.171
  494   HD23  LEU  63          HD23      LEU  63  -4.661   7.345   4.719
  495    H    GLU  64           H        GLU  64  -3.189  11.802   0.865
  496    HA   GLU  64           HA       GLU  64  -5.464  13.507   0.088
  497    HB2  GLU  64           HB2      GLU  64  -2.682  13.743  -1.047
  498    HB3  GLU  64           HB3      GLU  64  -4.018  14.874  -1.212
  499    HG2  GLU  64           HG2      GLU  64  -2.689  14.244   1.409
  500    HG3  GLU  64           HG3      GLU  64  -2.202  15.574   0.358
  501    H    ALA  65           H        ALA  65  -6.316  13.251  -1.968
  502    HA   ALA  65           HA       ALA  65  -6.250  10.669  -3.066
  503    HB1  ALA  65           HB1      ALA  65  -7.145  13.147  -4.521
  504    HB2  ALA  65           HB2      ALA  65  -8.107  12.357  -3.272
  505    HB3  ALA  65           HB3      ALA  65  -7.702  11.489  -4.753
  506    H    GLY  66           H        GLY  66  -4.404   9.847  -3.867
  507    HA2  GLY  66           HA2      GLY  66  -3.177   9.642  -5.970
  508    HA3  GLY  66           HA3      GLY  66  -3.068  11.395  -6.000
  509    H    CYS  67           H        CYS  67  -2.498  11.354  -3.032
  510    HA   CYS  67           HA       CYS  67   0.316  11.425  -3.213
  511    HB2  CYS  67           HB2      CYS  67  -0.955  12.754  -1.580
  512    HB3  CYS  67           HB3      CYS  67  -1.430  11.278  -0.746
  513    HG   CYS  67           HG       CYS  67   0.834  11.097   0.286
  514    H    VAL  68           H        VAL  68   1.892  10.078  -2.282
  515    HA   VAL  68           HA       VAL  68   1.234   7.271  -2.393
  516    HB   VAL  68           HB       VAL  68   3.891   8.516  -1.683
  517   HG11  VAL  68          HG11      VAL  68   4.829   6.401  -2.375
  518   HG12  VAL  68          HG12      VAL  68   3.232   5.804  -2.827
  519   HG13  VAL  68          HG13      VAL  68   3.608   6.123  -1.134
  520   HG21  VAL  68          HG21      VAL  68   4.156   7.718  -4.258
  521   HG22  VAL  68          HG22      VAL  68   3.780   9.369  -3.764
  522   HG23  VAL  68          HG23      VAL  68   2.484   8.278  -4.253
  523    H    VAL  69           H        VAL  69   0.106   6.587  -0.652
  524    HA   VAL  69           HA       VAL  69   0.781   7.439   2.022
  525    HB   VAL  69           HB       VAL  69  -1.148   5.260   1.229
  526   HG11  VAL  69          HG11      VAL  69  -0.514   5.304   3.592
  527   HG12  VAL  69          HG12      VAL  69  -2.202   5.763   3.369
  528   HG13  VAL  69          HG13      VAL  69  -0.987   7.000   3.688
  529   HG21  VAL  69          HG21      VAL  69  -1.597   8.231   1.471
  530   HG22  VAL  69          HG22      VAL  69  -2.890   7.033   1.398
  531   HG23  VAL  69          HG23      VAL  69  -1.794   7.233   0.030
  532    H    ALA  70           H        ALA  70   1.706   4.884  -0.077
  533    HA   ALA  70           HA       ALA  70   3.514   3.826   1.867
  534    HB1  ALA  70           HB1      ALA  70   1.100   2.786   2.230
  535    HB2  ALA  70           HB2      ALA  70   2.570   1.833   2.430
  536    HB3  ALA  70           HB3      ALA  70   1.644   1.722   0.933
  537    H    ARG  71           H        ARG  71   4.022   1.345   0.778
  538    HA   ARG  71           HA       ARG  71   4.458   1.772  -2.082
  539    HB2  ARG  71           HB2      ARG  71   6.557   1.584   0.017
  540    HB3  ARG  71           HB3      ARG  71   6.855   0.740  -1.496
  541    HG2  ARG  71           HG2      ARG  71   5.998   3.598  -1.538
  542    HG3  ARG  71           HG3      ARG  71   7.676   3.182  -1.182
  543    HD2  ARG  71           HD2      ARG  71   6.476   1.834  -3.514
  544    HD3  ARG  71           HD3      ARG  71   6.716   3.574  -3.672
  545    HE   ARG  71           HE       ARG  71   8.714   1.594  -3.811
  546   HH11  ARG  71          HH11      ARG  71   8.147   4.769  -2.477
  547   HH12  ARG  71          HH12      ARG  71   9.817   5.222  -2.521
  548   HH21  ARG  71          HH21      ARG  71  10.911   2.189  -3.870
  549   HH22  ARG  71          HH22      ARG  71  11.387   3.759  -3.312
  550    H    LEU  72           H        LEU  72   5.829  -0.356  -2.824
  551    HA   LEU  72           HA       LEU  72   4.718  -2.719  -1.518
  552    HB2  LEU  72           HB2      LEU  72   3.700  -1.599  -3.944
  553    HB3  LEU  72           HB3      LEU  72   4.452  -3.139  -4.311
  554    HG   LEU  72           HG       LEU  72   2.029  -3.315  -3.846
  555   HD11  LEU  72          HD11      LEU  72   3.776  -5.128  -3.363
  556   HD12  LEU  72          HD12      LEU  72   2.179  -5.300  -2.635
  557   HD13  LEU  72          HD13      LEU  72   3.531  -4.716  -1.666
  558   HD21  LEU  72          HD21      LEU  72   2.244  -1.472  -2.016
  559   HD22  LEU  72          HD22      LEU  72   2.596  -2.837  -0.955
  560   HD23  LEU  72          HD23      LEU  72   1.064  -2.770  -1.827
  561    H    GLU  73           H        GLU  73   5.728  -4.712  -2.185
  562    HA   GLU  73           HA       GLU  73   8.208  -4.455  -3.707
  563    HB2  GLU  73           HB2      GLU  73   8.596  -4.133  -1.183
  564    HB3  GLU  73           HB3      GLU  73   8.224  -5.845  -1.038
  565    HG2  GLU  73           HG2      GLU  73  10.064  -6.367  -2.567
  566    HG3  GLU  73           HG3      GLU  73  10.444  -4.649  -2.682
  567    H    LEU  74           H        LEU  74   7.382  -5.751  -5.318
  568    HA   LEU  74           HA       LEU  74   5.976  -8.151  -4.918
  569    HB2  LEU  74           HB2      LEU  74   7.356  -6.838  -7.186
  570    HB3  LEU  74           HB3      LEU  74   7.086  -8.564  -7.332
  571    HG   LEU  74           HG       LEU  74   5.309  -7.186  -8.381
  572   HD11  LEU  74          HD11      LEU  74   4.816  -9.184  -6.250
  573   HD12  LEU  74          HD12      LEU  74   4.454  -9.249  -7.975
  574   HD13  LEU  74          HD13      LEU  74   3.421  -8.317  -6.892
  575   HD21  LEU  74          HD21      LEU  74   4.729  -6.370  -5.537
  576   HD22  LEU  74          HD22      LEU  74   3.708  -6.027  -6.933
  577   HD23  LEU  74          HD23      LEU  74   5.319  -5.318  -6.823
  578    H    ASP  75           H        ASP  75   6.667  -9.977  -4.054
  579    HA   ASP  75           HA       ASP  75   9.437 -10.514  -3.618
  580    HB2  ASP  75           HB2      ASP  75   7.322 -11.247  -2.242
  581    HB3  ASP  75           HB3      ASP  75   7.331 -12.624  -3.340
  582    H    ASP  76           H        ASP  76   7.114 -11.398  -6.047
  583    HA   ASP  76           HA       ASP  76   8.620 -13.607  -7.090
  584    HB2  ASP  76           HB2      ASP  76   6.075 -13.143  -7.303
  585    HB3  ASP  76           HB3      ASP  76   6.535 -12.095  -8.642
  586    H    LEU  77           H        LEU  77  10.152 -13.615  -8.625
  587    HA   LEU  77           HA       LEU  77  11.190 -11.062  -9.525
  588    HB2  LEU  77           HB2      LEU  77  12.170 -13.894  -9.859
  589    HB3  LEU  77           HB3      LEU  77  12.991 -12.501 -10.538
  590    HG   LEU  77           HG       LEU  77  13.292 -11.599  -8.247
  591   HD11  LEU  77          HD11      LEU  77  11.652 -12.453  -6.891
  592   HD12  LEU  77          HD12      LEU  77  13.015 -13.482  -6.450
  593   HD13  LEU  77          HD13      LEU  77  11.786 -14.077  -7.567
  594   HD21  LEU  77          HD21      LEU  77  14.934 -13.133  -9.473
  595   HD22  LEU  77          HD22      LEU  77  14.383 -14.391  -8.367
  596   HD23  LEU  77          HD23      LEU  77  15.143 -12.931  -7.734
  597    H    GLU  78           H        GLU  78   9.735 -13.961 -10.916
  598    HA   GLU  78           HA       GLU  78   8.746 -12.508 -13.161
  599    HB2  GLU  78           HB2      GLU  78  11.183 -14.208 -13.466
  600    HB3  GLU  78           HB3      GLU  78   9.995 -14.200 -14.763
  601    HG2  GLU  78           HG2      GLU  78  10.212 -11.604 -14.535
  602    HG3  GLU  78           HG3      GLU  78  11.757 -12.009 -13.789
  603    H    HIS  79           H        HIS  79   7.319 -13.761 -14.478
  604    HA   HIS  79           HA       HIS  79   6.414 -16.212 -13.131
  605    HB2  HIS  79           HB2      HIS  79   4.821 -14.274 -13.284
  606    HB3  HIS  79           HB3      HIS  79   4.842 -14.466 -15.033
  607    HD1  HIS  79           HD1      HIS  79   2.168 -14.809 -14.421
  608    HD2  HIS  79           HD2      HIS  79   4.782 -17.902 -13.488
  609    HE1  HIS  79           HE1      HIS  79   0.724 -16.849 -14.141
  610    HE2  HIS  79           HE2      HIS  79   2.336 -18.725 -13.663
  611    H    HIS  80           H        HIS  80   7.458 -14.876 -16.172
  612    HA   HIS  80           HA       HIS  80   6.855 -17.354 -17.591
  613    HB2  HIS  80           HB2      HIS  80   7.689 -16.106 -19.589
  614    HB3  HIS  80           HB3      HIS  80   6.324 -15.332 -18.790
  615    HD1  HIS  80           HD1      HIS  80   6.606 -12.917 -18.326
  616    HD2  HIS  80           HD2      HIS  80  10.259 -14.848 -18.765
  617    HE1  HIS  80           HE1      HIS  80   8.344 -11.104 -18.202
  618    HE2  HIS  80           HE2      HIS  80  10.550 -12.307 -18.383
  619    H    HIS  81           H        HIS  81   8.441 -18.598 -18.642
  620    HA   HIS  81           HA       HIS  81  10.424 -19.698 -18.810
  621    HB2  HIS  81           HB2      HIS  81  11.453 -16.896 -18.355
  622    HB3  HIS  81           HB3      HIS  81  12.508 -18.259 -18.710
  623    HD1  HIS  81           HD1      HIS  81  10.067 -19.295 -20.770
  624    HD2  HIS  81           HD2      HIS  81  12.369 -15.837 -20.870
  625    HE1  HIS  81           HE1      HIS  81  10.000 -18.511 -23.159
  626    HE2  HIS  81           HE2      HIS  81  11.470 -16.466 -23.212
  627    H    HIS  82           H        HIS  82   9.094 -19.645 -16.270
  628    HA   HIS  82           HA       HIS  82  11.362 -19.735 -14.398
  629    HB2  HIS  82           HB2      HIS  82   9.343 -18.271 -13.878
  630    HB3  HIS  82           HB3      HIS  82   8.436 -19.764 -13.658
  631    HD1  HIS  82           HD1      HIS  82  11.959 -19.680 -12.476
  632    HD2  HIS  82           HD2      HIS  82   8.146 -19.154 -10.912
  633    HE1  HIS  82           HE1      HIS  82  12.244 -19.738  -9.979
  634    HE2  HIS  82           HE2      HIS  82   9.936 -19.331  -9.053
  635    H    HIS  83           H        HIS  83  12.197 -21.707 -14.236
  636    HA   HIS  83           HA       HIS  83  10.408 -24.031 -14.411
  637    HB2  HIS  83           HB2      HIS  83  12.377 -23.883 -15.968
  638    HB3  HIS  83           HB3      HIS  83  13.427 -24.004 -14.560
  639    HD1  HIS  83           HD1      HIS  83  13.814 -26.308 -13.587
  640    HD2  HIS  83           HD2      HIS  83  10.906 -26.264 -16.555
  641    HE1  HIS  83           HE1      HIS  83  13.328 -28.724 -14.087
  642    HE2  HIS  83           HE2      HIS  83  11.503 -28.672 -15.824
  643    H    HIS  84           H        HIS  84  10.291 -25.541 -12.797
  644    HA   HIS  84           HA       HIS  84  11.075 -24.665 -10.171
  645    HB2  HIS  84           HB2      HIS  84   9.769 -27.265 -10.999
  646    HB3  HIS  84           HB3      HIS  84   9.852 -26.609  -9.368
  647    HD1  HIS  84           HD1      HIS  84   8.133 -26.091 -12.668
  648    HD2  HIS  84           HD2      HIS  84   7.944 -24.688  -8.762
  649    HE1  HIS  84           HE1      HIS  84   6.008 -24.753 -12.537
  650    HE2  HIS  84           HE2      HIS  84   5.871 -23.986 -10.141
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1   2.187  12.760 -13.261
    2    H2   MET   1           H2       MET   1   3.508  11.745 -13.665
    3    H3   MET   1           H3       MET   1   1.937  11.381 -14.252
    4    HA   MET   1           HA       MET   1   2.797  11.369 -11.437
    5    HB2  MET   1           HB2      MET   1   0.184  11.223 -12.839
    6    HB3  MET   1           HB3      MET   1   0.420  10.105 -11.502
    7    HG2  MET   1           HG2      MET   1   0.983  12.016 -10.048
    8    HG3  MET   1           HG3      MET   1   0.635  13.104 -11.391
    9    HE1  MET   1           HE1      MET   1  -1.446  14.509 -10.845
   10    HE2  MET   1           HE2      MET   1  -0.827  14.118  -9.240
   11    HE3  MET   1           HE3      MET   1  -2.555  13.998  -9.572
   12    H    GLU   2           H        GLU   2   4.518   9.929 -11.952
   13    HA   GLU   2           HA       GLU   2   4.185   7.546 -13.424
   14    HB2  GLU   2           HB2      GLU   2   6.194   8.209 -11.263
   15    HB3  GLU   2           HB3      GLU   2   6.306   6.843 -12.365
   16    HG2  GLU   2           HG2      GLU   2   6.111   8.753 -14.179
   17    HG3  GLU   2           HG3      GLU   2   6.758   9.731 -12.862
   18    H    ASN   3           H        ASN   3   2.385   6.412 -12.761
   19    HA   ASN   3           HA       ASN   3   2.170   5.602  -9.971
   20    HB2  ASN   3           HB2      ASN   3   0.209   6.359 -11.494
   21    HB3  ASN   3           HB3      ASN   3   0.302   4.731 -12.159
   22   HD21  ASN   3          HD21      ASN   3  -1.265   3.556 -11.342
   23   HD22  ASN   3          HD22      ASN   3  -1.750   3.513  -9.684
   24    H    ASP   4           H        ASP   4   3.972   4.214  -9.831
   25    HA   ASP   4           HA       ASP   4   4.180   1.927 -11.577
   26    HB2  ASP   4           HB2      ASP   4   5.780   3.115  -9.391
   27    HB3  ASP   4           HB3      ASP   4   5.898   1.366  -9.558
   28    HA   PRO   5           HA       PRO   5   1.821  -0.952  -9.219
   29    HB2  PRO   5           HB2      PRO   5   3.196  -3.257  -9.537
   30    HB3  PRO   5           HB3      PRO   5   2.305  -2.495 -10.860
   31    HG2  PRO   5           HG2      PRO   5   5.235  -2.404 -10.250
   32    HG3  PRO   5           HG3      PRO   5   4.424  -2.619 -11.812
   33    HD2  PRO   5           HD2      PRO   5   5.447  -0.238 -10.993
   34    HD3  PRO   5           HD3      PRO   5   4.035  -0.366 -12.062
   35    H    THR   6           H        THR   6   5.175  -0.497  -8.424
   36    HA   THR   6           HA       THR   6   4.947  -1.951  -5.915
   37    HB   THR   6           HB       THR   6   7.318  -1.444  -5.634
   38    HG1  THR   6           HG1      THR   6   7.139  -0.032  -8.082
   39   HG21  THR   6          HG21      THR   6   8.175  -2.327  -7.902
   40   HG22  THR   6          HG22      THR   6   6.463  -2.528  -8.277
   41   HG23  THR   6          HG23      THR   6   7.167  -3.365  -6.893
   42    H    VAL   7           H        VAL   7   3.177   0.177  -6.023
   43    HA   VAL   7           HA       VAL   7   4.164   1.794  -3.827
   44    HB   VAL   7           HB       VAL   7   3.475   3.900  -4.766
   45   HG11  VAL   7          HG11      VAL   7   5.302   4.262  -6.140
   46   HG12  VAL   7          HG12      VAL   7   5.157   2.687  -6.921
   47   HG13  VAL   7          HG13      VAL   7   5.778   2.802  -5.275
   48   HG21  VAL   7          HG21      VAL   7   2.145   2.186  -6.618
   49   HG22  VAL   7          HG22      VAL   7   3.145   3.348  -7.489
   50   HG23  VAL   7          HG23      VAL   7   1.927   3.911  -6.344
   51    H    LEU   8           H        LEU   8   2.294   3.294  -3.039
   52    HA   LEU   8           HA       LEU   8  -0.334   2.132  -3.479
   53    HB2  LEU   8           HB2      LEU   8   1.176   1.174  -1.394
   54    HB3  LEU   8           HB3      LEU   8   0.231   2.437  -0.630
   55    HG   LEU   8           HG       LEU   8  -0.963   0.395  -0.358
   56   HD11  LEU   8          HD11      LEU   8  -2.074   2.610  -1.441
   57   HD12  LEU   8          HD12      LEU   8  -2.987   1.189  -0.931
   58   HD13  LEU   8          HD13      LEU   8  -2.545   1.391  -2.626
   59   HD21  LEU   8          HD21      LEU   8  -1.319  -0.125  -3.243
   60   HD22  LEU   8          HD22      LEU   8  -1.172  -1.251  -1.893
   61   HD23  LEU   8          HD23      LEU   8   0.269  -0.491  -2.569
   62    H    ARG   9           H        ARG   9  -0.969   4.101  -4.281
   63    HA   ARG   9           HA       ARG   9  -0.731   6.467  -2.598
   64    HB2  ARG   9           HB2      ARG   9  -2.039   6.258  -5.311
   65    HB3  ARG   9           HB3      ARG   9  -1.500   7.719  -4.493
   66    HG2  ARG   9           HG2      ARG   9   0.793   6.208  -4.630
   67    HG3  ARG   9           HG3      ARG   9  -0.017   5.853  -6.157
   68    HD2  ARG   9           HD2      ARG   9  -0.297   8.352  -6.436
   69    HD3  ARG   9           HD3      ARG   9   0.807   8.536  -5.074
   70    HE   ARG   9           HE       ARG   9   2.178   6.925  -6.751
   71   HH11  ARG   9          HH11      ARG   9   0.563   9.987  -7.193
   72   HH12  ARG   9          HH12      ARG   9   1.635  10.514  -8.446
   73   HH21  ARG   9          HH21      ARG   9   3.591   7.617  -8.398
   74   HH22  ARG   9          HH22      ARG   9   3.354   9.168  -9.131
   75    H    SER  10           H        SER  10  -2.499   7.638  -1.822
   76    HA   SER  10           HA       SER  10  -4.712   6.089  -0.975
   77    HB2  SER  10           HB2      SER  10  -3.706   8.799  -0.552
   78    HB3  SER  10           HB3      SER  10  -5.467   8.730  -0.598
   79    HG   SER  10           HG       SER  10  -3.942   8.123   1.419
   80    HA   PRO  11           HA       PRO  11  -7.480   6.587  -4.381
   81    HB2  PRO  11           HB2      PRO  11  -9.860   6.257  -3.136
   82    HB3  PRO  11           HB3      PRO  11  -8.735   4.921  -3.407
   83    HG2  PRO  11           HG2      PRO  11  -9.189   6.543  -0.932
   84    HG3  PRO  11           HG3      PRO  11  -8.978   4.790  -1.097
   85    HD2  PRO  11           HD2      PRO  11  -6.974   6.444  -0.316
   86    HD3  PRO  11           HD3      PRO  11  -6.686   4.952  -1.233
   87    H    SER  12           H        SER  12  -8.210   8.429  -1.440
   88    HA   SER  12           HA       SER  12  -8.716  10.792  -3.035
   89    HB2  SER  12           HB2      SER  12 -10.938  11.199  -2.328
   90    HB3  SER  12           HB3      SER  12 -10.922   9.503  -2.812
   91    HG   SER  12           HG       SER  12 -11.950   9.996  -0.740
   92    H    ALA  13           H        ALA  13  -9.729  12.487  -1.199
   93    HA   ALA  13           HA       ALA  13  -7.495  12.889   0.549
   94    HB1  ALA  13           HB1      ALA  13  -8.556  14.787  -0.517
   95    HB2  ALA  13           HB2      ALA  13  -8.690  14.929   1.235
   96    HB3  ALA  13           HB3      ALA  13 -10.083  14.414   0.283
   97    H    GLY  14           H        GLY  14  -7.259  11.971   2.472
   98    HA2  GLY  14           HA2      GLY  14  -9.570  11.753   4.247
   99    HA3  GLY  14           HA3      GLY  14  -8.736  10.261   3.842
  100    H    LYS  15           H        LYS  15  -7.896   9.754   5.805
  101    HA   LYS  15           HA       LYS  15  -5.573  11.205   6.650
  102    HB2  LYS  15           HB2      LYS  15  -7.575  12.421   7.693
  103    HB3  LYS  15           HB3      LYS  15  -7.776  10.988   8.692
  104    HG2  LYS  15           HG2      LYS  15  -5.057  12.091   8.650
  105    HG3  LYS  15           HG3      LYS  15  -6.282  13.140   9.367
  106    HD2  LYS  15           HD2      LYS  15  -6.137  10.254  10.143
  107    HD3  LYS  15           HD3      LYS  15  -5.021  11.419  10.859
  108    HE2  LYS  15           HE2      LYS  15  -7.943  12.022  10.814
  109    HE3  LYS  15           HE3      LYS  15  -7.314  10.887  12.008
  110    HZ1  LYS  15           HZ1      LYS  15  -6.391  13.685  11.626
  111    HZ2  LYS  15           HZ2      LYS  15  -5.782  12.597  12.769
  112    HZ3  LYS  15           HZ3      LYS  15  -7.382  13.134  12.882
  113    H    LEU  16           H        LEU  16  -4.196   9.954   7.860
  114    HA   LEU  16           HA       LEU  16  -4.606   7.150   7.810
  115    HB2  LEU  16           HB2      LEU  16  -2.401   8.480   7.739
  116    HB3  LEU  16           HB3      LEU  16  -2.538   8.546   9.483
  117    HG   LEU  16           HG       LEU  16  -2.380   6.155   9.663
  118   HD11  LEU  16          HD11      LEU  16  -1.964   4.804   7.571
  119   HD12  LEU  16          HD12      LEU  16  -2.549   6.197   6.661
  120   HD13  LEU  16          HD13      LEU  16  -3.615   5.379   7.804
  121   HD21  LEU  16          HD21      LEU  16  -0.149   6.020   9.313
  122   HD22  LEU  16          HD22      LEU  16  -0.333   7.747   9.005
  123   HD23  LEU  16          HD23      LEU  16  -0.260   6.614   7.656
  124    H    THR  17           H        THR  17  -6.302   6.447   9.029
  125    HA   THR  17           HA       THR  17  -6.765   7.384  11.697
  126    HB   THR  17           HB       THR  17  -8.592   6.633  10.197
  127    HG1  THR  17           HG1      THR  17  -9.654   6.173  11.932
  128   HG21  THR  17          HG21      THR  17  -7.983   3.798  10.821
  129   HG22  THR  17          HG22      THR  17  -7.183   4.557   9.444
  130   HG23  THR  17          HG23      THR  17  -8.944   4.492   9.516
  131    H    GLN  18           H        GLN  18  -5.389   4.440  10.270
  132    HA   GLN  18           HA       GLN  18  -3.821   3.945  12.599
  133    HB2  GLN  18           HB2      GLN  18  -6.366   3.027  12.868
  134    HB3  GLN  18           HB3      GLN  18  -5.588   1.624  12.147
  135    HG2  GLN  18           HG2      GLN  18  -4.469   1.134  14.015
  136    HG3  GLN  18           HG3      GLN  18  -4.067   2.821  14.333
  137   HE21  GLN  18          HE21      GLN  18  -5.757   0.214  15.428
  138   HE22  GLN  18          HE22      GLN  18  -6.894   1.018  16.450
  139    H    TYR  19           H        TYR  19  -3.491   1.134  12.219
  140    HA   TYR  19           HA       TYR  19  -2.748   0.778   9.431
  141    HB2  TYR  19           HB2      TYR  19  -0.407   0.143  10.066
  142    HB3  TYR  19           HB3      TYR  19  -0.766   1.856  10.257
  143    HD1  TYR  19           HD2      TYR  19  -0.346  -1.328  12.100
  144    HD2  TYR  19           HD1      TYR  19  -0.574   2.912  12.367
  145    HE1  TYR  19           HE2      TYR  19   0.410  -1.440  14.437
  146    HE2  TYR  19           HE1      TYR  19   0.182   2.812  14.705
  147    HH   TYR  19           HH       TYR  19   0.024   0.394  16.587
  148    H    THR  20           H        THR  20  -2.544  -1.364   8.822
  149    HA   THR  20           HA       THR  20  -3.555  -3.289  10.774
  150    HB   THR  20           HB       THR  20  -4.226  -4.635   8.940
  151    HG1  THR  20           HG1      THR  20  -3.194  -4.658   7.119
  152   HG21  THR  20          HG21      THR  20  -5.454  -3.117   7.427
  153   HG22  THR  20          HG22      THR  20  -4.621  -1.755   8.177
  154   HG23  THR  20          HG23      THR  20  -5.702  -2.765   9.137
  155    H    VAL  21           H        VAL  21  -0.646  -2.448   9.152
  156    HA   VAL  21           HA       VAL  21   0.696  -4.703  10.408
  157    HB   VAL  21           HB       VAL  21   1.923  -5.321   8.376
  158   HG11  VAL  21          HG11      VAL  21   0.092  -6.492   7.230
  159   HG12  VAL  21          HG12      VAL  21  -1.074  -5.487   8.092
  160   HG13  VAL  21          HG13      VAL  21  -0.042  -6.605   8.985
  161   HG21  VAL  21          HG21      VAL  21   1.105  -2.917   7.372
  162   HG22  VAL  21          HG22      VAL  21   0.047  -4.044   6.524
  163   HG23  VAL  21          HG23      VAL  21   1.798  -4.229   6.419
  164    H    GLU  22           H        GLU  22   2.873  -4.368  10.818
  165    HA   GLU  22           HA       GLU  22   3.688  -1.667  11.096
  166    HB2  GLU  22           HB2      GLU  22   5.736  -2.565  12.019
  167    HB3  GLU  22           HB3      GLU  22   4.374  -3.493  12.628
  168    HG2  GLU  22           HG2      GLU  22   5.104  -4.883  10.374
  169    HG3  GLU  22           HG3      GLU  22   6.648  -4.338  11.028
  170    H    ASP  23           H        ASP  23   6.352  -1.588  10.453
  171    HA   ASP  23           HA       ASP  23   6.324  -0.814   7.769
  172    HB2  ASP  23           HB2      ASP  23   8.763  -0.608   7.982
  173    HB3  ASP  23           HB3      ASP  23   7.942   0.062   9.389
  174    H    GLY  24           H        GLY  24   6.794  -1.814   5.889
  175    HA2  GLY  24           HA2      GLY  24   7.167  -3.519   4.401
  176    HA3  GLY  24           HA3      GLY  24   8.344  -4.118   5.559
  177    H    GLY  25           H        GLY  25   5.005  -3.771   6.474
  178    HA2  GLY  25           HA2      GLY  25   4.760  -6.424   7.342
  179    HA3  GLY  25           HA3      GLY  25   3.420  -5.324   7.064
  180    H    HIS  26           H        HIS  26   4.886  -8.159   6.087
  181    HA   HIS  26           HA       HIS  26   4.346  -8.217   3.332
  182    HB2  HIS  26           HB2      HIS  26   4.465 -10.679   3.563
  183    HB3  HIS  26           HB3      HIS  26   5.798  -9.865   4.374
  184    HD1  HIS  26           HD1      HIS  26   2.601 -11.715   5.112
  185    HD2  HIS  26           HD2      HIS  26   5.970 -10.303   7.094
  186    HE1  HIS  26           HE1      HIS  26   2.487 -12.705   7.421
  187    HE2  HIS  26           HE2      HIS  26   4.488 -11.765   8.630
  188    H    VAL  27           H        VAL  27   2.495  -8.266   2.252
  189    HA   VAL  27           HA       VAL  27   0.160  -9.580   3.406
  190    HB   VAL  27           HB       VAL  27  -1.313  -7.669   2.840
  191   HG11  VAL  27          HG11      VAL  27  -0.449  -8.070   5.141
  192   HG12  VAL  27          HG12      VAL  27  -0.852  -6.385   4.811
  193   HG13  VAL  27          HG13      VAL  27   0.834  -6.905   4.812
  194   HG21  VAL  27          HG21      VAL  27  -0.432  -6.172   1.422
  195   HG22  VAL  27          HG22      VAL  27   1.224  -6.574   1.874
  196   HG23  VAL  27          HG23      VAL  27   0.287  -5.455   2.863
  197    H    GLU  28           H        GLU  28  -1.107 -10.556   1.910
  198    HA   GLU  28           HA       GLU  28  -0.156 -10.578  -0.823
  199    HB2  GLU  28           HB2      GLU  28  -1.598 -12.457  -1.149
  200    HB3  GLU  28           HB3      GLU  28  -0.823 -12.655   0.416
  201    HG2  GLU  28           HG2      GLU  28  -3.227 -11.254   0.862
  202    HG3  GLU  28           HG3      GLU  28  -3.598 -12.589  -0.227
  203    H    ALA  29           H        ALA  29  -1.673 -10.409  -2.651
  204    HA   ALA  29           HA       ALA  29  -2.906  -7.973  -2.850
  205    HB1  ALA  29           HB1      ALA  29  -2.371  -9.814  -4.638
  206    HB2  ALA  29           HB2      ALA  29  -3.632  -8.615  -4.928
  207    HB3  ALA  29           HB3      ALA  29  -4.066 -10.240  -4.395
  208    H    GLY  30           H        GLY  30  -4.704  -7.084  -2.067
  209    HA2  GLY  30           HA2      GLY  30  -7.045  -7.067  -1.642
  210    HA3  GLY  30           HA3      GLY  30  -6.991  -8.811  -1.432
  211    H    SER  31           H        SER  31  -4.534  -8.475   0.292
  212    HA   SER  31           HA       SER  31  -5.908  -8.355   2.785
  213    HB2  SER  31           HB2      SER  31  -2.978  -8.549   2.073
  214    HB3  SER  31           HB3      SER  31  -3.560  -8.540   3.738
  215    HG   SER  31           HG       SER  31  -3.413 -10.657   3.136
  216    H    SER  32           H        SER  32  -6.216  -6.693   4.125
  217    HA   SER  32           HA       SER  32  -5.636  -4.046   3.312
  218    HB2  SER  32           HB2      SER  32  -6.406  -3.504   5.706
  219    HB3  SER  32           HB3      SER  32  -7.565  -4.307   4.646
  220    HG   SER  32           HG       SER  32  -6.152  -5.320   6.843
  221    H    TYR  33           H        TYR  33  -4.032  -2.673   3.840
  222    HA   TYR  33           HA       TYR  33  -1.891  -3.718   5.572
  223    HB2  TYR  33           HB2      TYR  33  -0.304  -2.477   4.265
  224    HB3  TYR  33           HB3      TYR  33  -1.315  -3.396   3.155
  225    HD1  TYR  33           HD1      TYR  33  -0.462  -0.050   4.380
  226    HD2  TYR  33           HD2      TYR  33  -2.863  -2.273   1.661
  227    HE1  TYR  33           HE1      TYR  33  -0.986   2.020   3.160
  228    HE2  TYR  33           HE2      TYR  33  -3.394  -0.210   0.433
  229    HH   TYR  33           HH       TYR  33  -1.709   2.565   0.684
  230    H    ALA  34           H        ALA  34  -4.259  -1.316   5.285
  231    HA   ALA  34           HA       ALA  34  -3.564  -0.103   7.744
  232    HB1  ALA  34           HB1      ALA  34  -3.291   1.836   5.485
  233    HB2  ALA  34           HB2      ALA  34  -1.901   0.889   6.016
  234    HB3  ALA  34           HB3      ALA  34  -2.719   1.966   7.149
  235    H    GLU  35           H        GLU  35  -4.804   2.285   7.633
  236    HA   GLU  35           HA       GLU  35  -7.377   1.945   6.309
  237    HB2  GLU  35           HB2      GLU  35  -7.234   2.427   9.285
  238    HB3  GLU  35           HB3      GLU  35  -8.674   2.148   8.316
  239    HG2  GLU  35           HG2      GLU  35  -7.499  -0.128   7.784
  240    HG3  GLU  35           HG3      GLU  35  -6.625   0.217   9.275
  241    H    MET  36           H        MET  36  -8.746   3.906   6.531
  242    HA   MET  36           HA       MET  36  -7.393   6.326   7.369
  243    HB2  MET  36           HB2      MET  36  -7.489   7.435   5.236
  244    HB3  MET  36           HB3      MET  36  -6.593   5.935   5.046
  245    HG2  MET  36           HG2      MET  36  -9.111   5.124   4.441
  246    HG3  MET  36           HG3      MET  36  -9.128   6.786   3.852
  247    HE1  MET  36           HE1      MET  36  -9.735   5.143   1.608
  248    HE2  MET  36           HE2      MET  36  -9.161   3.653   2.358
  249    HE3  MET  36           HE3      MET  36  -8.494   4.176   0.811
  250    H    GLU  37           H        GLU  37  -8.843   7.478   8.426
  251    HA   GLU  37           HA       GLU  37 -11.679   7.031   7.956
  252    HB2  GLU  37           HB2      GLU  37 -10.731   7.066  10.265
  253    HB3  GLU  37           HB3      GLU  37 -10.346   8.767  10.040
  254    HG2  GLU  37           HG2      GLU  37 -12.671   9.324   9.836
  255    HG3  GLU  37           HG3      GLU  37 -13.122   7.620   9.871
  256    H    VAL  38           H        VAL  38 -12.412   8.126   6.233
  257    HA   VAL  38           HA       VAL  38 -11.549  10.870   5.762
  258    HB   VAL  38           HB       VAL  38 -11.688   9.283   3.864
  259   HG11  VAL  38          HG11      VAL  38 -14.594   9.246   4.607
  260   HG12  VAL  38          HG12      VAL  38 -13.498   7.885   4.374
  261   HG13  VAL  38          HG13      VAL  38 -14.037   8.832   2.987
  262   HG21  VAL  38          HG21      VAL  38 -13.726  11.461   3.499
  263   HG22  VAL  38          HG22      VAL  38 -12.596  10.806   2.314
  264   HG23  VAL  38          HG23      VAL  38 -12.000  11.790   3.651
  265    H    MET  39           H        MET  39 -13.300  12.483   5.162
  266    HA   MET  39           HA       MET  39 -14.965  12.960   7.325
  267    HB2  MET  39           HB2      MET  39 -15.518  13.982   4.544
  268    HB3  MET  39           HB3      MET  39 -15.891  14.760   6.076
  269    HG2  MET  39           HG2      MET  39 -13.226  14.554   6.308
  270    HG3  MET  39           HG3      MET  39 -13.371  14.670   4.556
  271    HE1  MET  39           HE1      MET  39 -13.478  16.309   7.910
  272    HE2  MET  39           HE2      MET  39 -13.377  18.015   7.478
  273    HE3  MET  39           HE3      MET  39 -12.107  16.901   6.973
  274    H    LYS  40           H        LYS  40 -15.516  10.990   4.522
  275    HA   LYS  40           HA       LYS  40 -18.364  10.902   4.777
  276    HB2  LYS  40           HB2      LYS  40 -17.299  10.522   2.622
  277    HB3  LYS  40           HB3      LYS  40 -16.427   9.140   3.267
  278    HG2  LYS  40           HG2      LYS  40 -18.110   8.034   2.256
  279    HG3  LYS  40           HG3      LYS  40 -18.897   8.334   3.805
  280    HD2  LYS  40           HD2      LYS  40 -19.604  10.579   2.592
  281    HD3  LYS  40           HD3      LYS  40 -19.377   9.585   1.152
  282    HE2  LYS  40           HE2      LYS  40 -21.007   8.588   3.458
  283    HE3  LYS  40           HE3      LYS  40 -21.713   9.680   2.267
  284    HZ1  LYS  40           HZ1      LYS  40 -22.150   7.417   1.649
  285    HZ2  LYS  40           HZ2      LYS  40 -20.507   7.022   1.724
  286    HZ3  LYS  40           HZ3      LYS  40 -21.067   8.083   0.533
  287    H    MET  41           H        MET  41 -16.126   8.144   4.914
  288    HA   MET  41           HA       MET  41 -17.134   7.349   7.513
  289    HB2  MET  41           HB2      MET  41 -17.839   5.951   4.973
  290    HB3  MET  41           HB3      MET  41 -17.517   4.972   6.397
  291    HG2  MET  41           HG2      MET  41 -19.205   6.752   7.464
  292    HG3  MET  41           HG3      MET  41 -19.777   6.768   5.796
  293    HE1  MET  41           HE1      MET  41 -20.171   4.713   9.218
  294    HE2  MET  41           HE2      MET  41 -21.783   4.431   8.558
  295    HE3  MET  41           HE3      MET  41 -21.089   6.052   8.528
  296    H    ILE  42           H        ILE  42 -16.167   4.930   7.867
  297    HA   ILE  42           HA       ILE  42 -13.308   5.311   7.688
  298    HB   ILE  42           HB       ILE  42 -14.272   4.449   9.760
  299   HG12  ILE  42          HG12      ILE  42 -12.775   2.531  10.092
  300   HG13  ILE  42          HG13      ILE  42 -12.592   2.362   8.349
  301   HG21  ILE  42          HG21      ILE  42 -16.174   3.258   9.087
  302   HG22  ILE  42          HG22      ILE  42 -15.081   2.032   9.730
  303   HG23  ILE  42          HG23      ILE  42 -15.251   2.235   7.986
  304   HD11  ILE  42          HD11      ILE  42 -11.929   5.029   9.076
  305   HD12  ILE  42          HD12      ILE  42 -10.901   3.778   8.378
  306   HD13  ILE  42          HD13      ILE  42 -11.060   3.914  10.129
  307    H    MET  43           H        MET  43 -11.839   3.950   6.643
  308    HA   MET  43           HA       MET  43 -12.895   1.848   4.918
  309    HB2  MET  43           HB2      MET  43 -11.521   4.337   3.946
  310    HB3  MET  43           HB3      MET  43 -11.431   2.840   3.029
  311    HG2  MET  43           HG2      MET  43 -14.069   3.965   3.878
  312    HG3  MET  43           HG3      MET  43 -13.246   4.559   2.437
  313    HE1  MET  43           HE1      MET  43 -14.774   4.027   0.668
  314    HE2  MET  43           HE2      MET  43 -16.066   3.470   1.731
  315    HE3  MET  43           HE3      MET  43 -15.571   2.486   0.354
  316    H    THR  44           H        THR  44 -11.205   0.504   3.967
  317    HA   THR  44           HA       THR  44  -8.720   0.558   5.552
  318    HB   THR  44           HB       THR  44  -9.469  -2.060   4.484
  319    HG1  THR  44           HG1      THR  44 -11.557  -1.333   4.959
  320   HG21  THR  44          HG21      THR  44  -7.725  -1.580   6.235
  321   HG22  THR  44          HG22      THR  44  -8.870  -2.868   6.606
  322   HG23  THR  44          HG23      THR  44  -9.058  -1.280   7.350
  323    H    LEU  45           H        LEU  45  -6.848   0.510   4.460
  324    HA   LEU  45           HA       LEU  45  -6.974   0.438   1.548
  325    HB2  LEU  45           HB2      LEU  45  -4.618   1.053   3.332
  326    HB3  LEU  45           HB3      LEU  45  -4.719   1.324   1.602
  327    HG   LEU  45           HG       LEU  45  -6.763   2.849   2.288
  328   HD11  LEU  45          HD11      LEU  45  -5.336   2.334   4.820
  329   HD12  LEU  45          HD12      LEU  45  -7.022   2.761   4.529
  330   HD13  LEU  45          HD13      LEU  45  -5.777   4.009   4.490
  331   HD21  LEU  45          HD21      LEU  45  -5.032   3.856   1.122
  332   HD22  LEU  45          HD22      LEU  45  -3.832   3.447   2.348
  333   HD23  LEU  45          HD23      LEU  45  -5.013   4.719   2.660
  334    H    ASN  46           H        ASN  46  -6.149  -1.159   0.312
  335    HA   ASN  46           HA       ASN  46  -4.604  -3.276   1.651
  336    HB2  ASN  46           HB2      ASN  46  -5.810  -4.949   0.279
  337    HB3  ASN  46           HB3      ASN  46  -6.879  -4.089   1.381
  338   HD21  ASN  46          HD21      ASN  46  -8.210  -2.404   0.514
  339   HD22  ASN  46          HD22      ASN  46  -8.700  -2.457  -1.142
  340    H    VAL  47           H        VAL  47  -3.631  -4.800  -0.075
  341    HA   VAL  47           HA       VAL  47  -2.209  -3.100  -1.975
  342    HB   VAL  47           HB       VAL  47  -0.688  -5.034  -2.244
  343   HG11  VAL  47          HG11      VAL  47   0.341  -4.891  -0.046
  344   HG12  VAL  47          HG12      VAL  47  -1.155  -4.247   0.630
  345   HG13  VAL  47          HG13      VAL  47  -0.248  -3.308  -0.555
  346   HG21  VAL  47          HG21      VAL  47  -2.714  -6.588  -1.450
  347   HG22  VAL  47          HG22      VAL  47  -1.870  -6.420   0.088
  348   HG23  VAL  47          HG23      VAL  47  -1.025  -7.075  -1.314
  349    H    GLN  48           H        GLN  48  -2.071  -3.532  -4.176
  350    HA   GLN  48           HA       GLN  48  -4.354  -4.940  -5.271
  351    HB2  GLN  48           HB2      GLN  48  -3.882  -3.862  -7.323
  352    HB3  GLN  48           HB3      GLN  48  -3.576  -2.668  -6.071
  353    HG2  GLN  48           HG2      GLN  48  -1.369  -4.329  -7.242
  354    HG3  GLN  48           HG3      GLN  48  -1.916  -2.833  -7.995
  355   HE21  GLN  48          HE21      GLN  48  -0.063  -4.246  -5.503
  356   HE22  GLN  48          HE22      GLN  48   0.503  -2.782  -4.780
  357    H    GLU  49           H        GLU  49  -1.209  -5.769  -4.474
  358    HA   GLU  49           HA       GLU  49  -1.422  -8.242  -5.958
  359    HB2  GLU  49           HB2      GLU  49   0.764  -6.237  -6.471
  360    HB3  GLU  49           HB3      GLU  49   0.985  -7.951  -6.792
  361    HG2  GLU  49           HG2      GLU  49  -0.950  -7.886  -8.315
  362    HG3  GLU  49           HG3      GLU  49  -1.082  -6.150  -8.034
  363    H    ARG  50           H        ARG  50   0.336  -9.774  -5.360
  364    HA   ARG  50           HA       ARG  50   0.643  -9.844  -2.540
  365    HB2  ARG  50           HB2      ARG  50   1.546 -11.549  -4.820
  366    HB3  ARG  50           HB3      ARG  50   2.285 -11.789  -3.243
  367    HG2  ARG  50           HG2      ARG  50   0.561 -13.308  -3.204
  368    HG3  ARG  50           HG3      ARG  50  -0.164 -11.915  -2.399
  369    HD2  ARG  50           HD2      ARG  50  -1.805 -12.580  -3.909
  370    HD3  ARG  50           HD3      ARG  50  -0.991 -11.257  -4.744
  371    HE   ARG  50           HE       ARG  50  -0.368 -12.738  -6.358
  372   HH11  ARG  50          HH11      ARG  50  -1.134 -14.534  -3.466
  373   HH12  ARG  50          HH12      ARG  50  -0.948 -16.079  -4.226
  374   HH21  ARG  50          HH21      ARG  50  -0.123 -14.769  -7.359
  375   HH22  ARG  50          HH22      ARG  50  -0.374 -16.213  -6.436
  376    H    GLY  51           H        GLY  51   2.305  -9.274  -1.251
  377    HA2  GLY  51           HA2      GLY  51   4.971  -9.169  -1.704
  378    HA3  GLY  51           HA3      GLY  51   4.407  -7.658  -2.400
  379    H    ARG  52           H        ARG  52   5.900  -6.803  -0.724
  380    HA   ARG  52           HA       ARG  52   4.834  -6.864   1.991
  381    HB2  ARG  52           HB2      ARG  52   7.434  -6.181   0.756
  382    HB3  ARG  52           HB3      ARG  52   6.985  -5.234   2.168
  383    HG2  ARG  52           HG2      ARG  52   8.293  -7.073   2.908
  384    HG3  ARG  52           HG3      ARG  52   6.624  -7.375   3.396
  385    HD2  ARG  52           HD2      ARG  52   7.241  -9.426   2.542
  386    HD3  ARG  52           HD3      ARG  52   6.484  -8.667   1.143
  387    HE   ARG  52           HE       ARG  52   8.496  -8.760   0.080
  388   HH11  ARG  52          HH11      ARG  52   9.064  -8.986   3.516
  389   HH12  ARG  52          HH12      ARG  52  10.764  -9.267   3.343
  390   HH21  ARG  52          HH21      ARG  52  10.732  -9.129  -0.150
  391   HH22  ARG  52          HH22      ARG  52  11.712  -9.347   1.262
  392   HG21  VAL  53          HG21      VAL  53   2.214  -3.661   0.866
  393   HG22  VAL  53          HG22      VAL  53   0.940  -3.741   2.083
  394   HG23  VAL  53          HG23      VAL  53   2.306  -4.853   2.162
  395    H    LYS  54           H        LYS  54   5.466  -0.645   1.914
  396    HA   LYS  54           HA       LYS  54   6.357  -0.340   4.707
  397    HB2  LYS  54           HB2      LYS  54   7.735   0.858   2.310
  398    HB3  LYS  54           HB3      LYS  54   8.356   0.692   3.947
  399    HG2  LYS  54           HG2      LYS  54   8.354  -1.766   3.649
  400    HG3  LYS  54           HG3      LYS  54   7.860  -1.525   1.972
  401    HD2  LYS  54           HD2      LYS  54  10.079  -1.562   1.576
  402    HD3  LYS  54           HD3      LYS  54  10.004   0.120   2.105
  403    HE2  LYS  54           HE2      LYS  54  10.506  -0.640   4.414
  404    HE3  LYS  54           HE3      LYS  54  10.706  -2.278   3.792
  405    HZ1  LYS  54           HZ1      LYS  54  12.319   0.086   2.997
  406    HZ2  LYS  54           HZ2      LYS  54  12.508  -1.480   2.388
  407    HZ3  LYS  54           HZ3      LYS  54  12.830  -1.163   4.018
  408    H    TYR  55           H        TYR  55   5.320   1.219   5.731
  409    HA   TYR  55           HA       TYR  55   3.641   3.105   4.548
  410    HB2  TYR  55           HB2      TYR  55   4.891   2.845   7.258
  411    HB3  TYR  55           HB3      TYR  55   4.002   4.308   6.848
  412    HD1  TYR  55           HD1      TYR  55   3.305   0.764   5.932
  413    HD2  TYR  55           HD2      TYR  55   2.039   4.206   8.087
  414    HE1  TYR  55           HE1      TYR  55   1.195  -0.370   6.491
  415    HE2  TYR  55           HE2      TYR  55  -0.074   3.082   8.652
  416    HH   TYR  55           HH       TYR  55  -0.575  -0.267   8.116
  417    H    ILE  56           H        ILE  56   3.881   5.152   3.842
  418    HA   ILE  56           HA       ILE  56   6.617   6.226   3.767
  419    HB   ILE  56           HB       ILE  56   4.345   6.348   1.842
  420   HG12  ILE  56          HG12      ILE  56   6.096   5.986   0.212
  421   HG13  ILE  56          HG13      ILE  56   7.339   6.293   1.420
  422   HG21  ILE  56          HG21      ILE  56   5.496   8.298   0.704
  423   HG22  ILE  56          HG22      ILE  56   6.335   8.569   2.232
  424   HG23  ILE  56          HG23      ILE  56   4.576   8.675   2.161
  425   HD11  ILE  56          HD11      ILE  56   6.702   4.277   2.609
  426   HD12  ILE  56          HD12      ILE  56   7.100   3.918   0.929
  427   HD13  ILE  56          HD13      ILE  56   5.415   3.981   1.442
  428    H    LYS  57           H        LYS  57   3.231   7.211   4.076
  429    HA   LYS  57           HA       LYS  57   3.838   9.843   4.986
  430    HB2  LYS  57           HB2      LYS  57   1.475   8.222   4.445
  431    HB3  LYS  57           HB3      LYS  57   1.260   9.294   5.823
  432    HG2  LYS  57           HG2      LYS  57   2.079  10.111   3.041
  433    HG3  LYS  57           HG3      LYS  57   0.494  10.349   3.780
  434    HD2  LYS  57           HD2      LYS  57   1.281  12.366   4.363
  435    HD3  LYS  57           HD3      LYS  57   2.161  11.494   5.620
  436    HE2  LYS  57           HE2      LYS  57   3.967  12.477   4.714
  437    HE3  LYS  57           HE3      LYS  57   3.839  11.193   3.513
  438    HZ1  LYS  57           HZ1      LYS  57   2.547  13.848   3.225
  439    HZ2  LYS  57           HZ2      LYS  57   2.681  12.642   2.047
  440    HZ3  LYS  57           HZ3      LYS  57   4.061  13.466   2.574
  441    H    ARG  58           H        ARG  58   3.080  10.658   7.136
  442    HA   ARG  58           HA       ARG  58   4.087   8.890   9.224
  443    HB2  ARG  58           HB2      ARG  58   3.765  11.818   8.892
  444    HB3  ARG  58           HB3      ARG  58   3.591  11.196  10.527
  445    HG2  ARG  58           HG2      ARG  58   5.842  11.749  10.369
  446    HG3  ARG  58           HG3      ARG  58   5.817  10.003  10.108
  447    HD2  ARG  58           HD2      ARG  58   7.292  11.171   8.520
  448    HD3  ARG  58           HD3      ARG  58   5.971  10.325   7.716
  449    HE   ARG  58           HE       ARG  58   5.239  12.333   6.926
  450   HH11  ARG  58          HH11      ARG  58   7.307  12.924   9.674
  451   HH12  ARG  58          HH12      ARG  58   7.278  14.645   9.484
  452   HH21  ARG  58          HH21      ARG  58   5.199  14.596   6.674
  453   HH22  ARG  58          HH22      ARG  58   6.081  15.595   7.782
  454    HA   PRO  59           HA       PRO  59   0.247   7.953  11.157
  455    HB2  PRO  59           HB2      PRO  59   0.689   8.537  13.796
  456    HB3  PRO  59           HB3      PRO  59   1.315   7.095  12.990
  457    HG2  PRO  59           HG2      PRO  59   2.695   9.682  13.587
  458    HG3  PRO  59           HG3      PRO  59   3.307   8.024  13.742
  459    HD2  PRO  59           HD2      PRO  59   3.964   9.592  11.655
  460    HD3  PRO  59           HD3      PRO  59   3.742   7.839  11.477
  461    H    GLY  60           H        GLY  60  -1.614   9.026  11.082
  462    HA2  GLY  60           HA2      GLY  60  -3.202  10.614  11.735
  463    HA3  GLY  60           HA3      GLY  60  -1.924  11.544  12.503
  464    H    ALA  61           H        ALA  61  -0.504  11.053   9.721
  465    HA   ALA  61           HA       ALA  61  -0.866  13.617   8.707
  466    HB1  ALA  61           HB1      ALA  61   1.073  12.206   8.197
  467    HB2  ALA  61           HB2      ALA  61   0.325  12.844   6.733
  468    HB3  ALA  61           HB3      ALA  61   0.051  11.167   7.205
  469    H    VAL  62           H        VAL  62  -2.127  14.509   7.132
  470    HA   VAL  62           HA       VAL  62  -4.610  13.181   6.551
  471    HB   VAL  62           HB       VAL  62  -5.222  15.240   5.365
  472   HG11  VAL  62          HG11      VAL  62  -5.573  15.143   7.759
  473   HG12  VAL  62          HG12      VAL  62  -5.104  16.776   7.286
  474   HG13  VAL  62          HG13      VAL  62  -3.927  15.706   8.049
  475   HG21  VAL  62          HG21      VAL  62  -2.355  15.998   5.887
  476   HG22  VAL  62          HG22      VAL  62  -3.606  17.174   5.488
  477   HG23  VAL  62          HG23      VAL  62  -3.191  15.905   4.337
  478    H    LEU  63           H        LEU  63  -4.989  11.901   4.874
  479    HA   LEU  63           HA       LEU  63  -3.046  11.668   2.748
  480    HB2  LEU  63           HB2      LEU  63  -5.584  10.196   3.414
  481    HB3  LEU  63           HB3      LEU  63  -4.698   9.896   1.931
  482    HG   LEU  63           HG       LEU  63  -4.119   8.224   3.574
  483   HD11  LEU  63          HD11      LEU  63  -1.735  10.023   3.545
  484   HD12  LEU  63          HD12      LEU  63  -2.368   9.369   2.034
  485   HD13  LEU  63          HD13      LEU  63  -1.828   8.277   3.310
  486   HD21  LEU  63          HD21      LEU  63  -3.070  10.421   5.340
  487   HD22  LEU  63          HD22      LEU  63  -3.229   8.705   5.712
  488   HD23  LEU  63          HD23      LEU  63  -4.670   9.706   5.540
  489    H    GLU  64           H        GLU  64  -3.359  12.119   0.589
  490    HA   GLU  64           HA       GLU  64  -5.773  13.675  -0.062
  491    HB2  GLU  64           HB2      GLU  64  -4.553  15.335  -1.028
  492    HB3  GLU  64           HB3      GLU  64  -3.337  14.776   0.108
  493    HG2  GLU  64           HG2      GLU  64  -2.760  13.188  -1.974
  494    HG3  GLU  64           HG3      GLU  64  -3.425  14.578  -2.831
  495    H    ALA  65           H        ALA  65  -6.430  13.626  -2.320
  496    HA   ALA  65           HA       ALA  65  -6.525  11.018  -3.358
  497    HB1  ALA  65           HB1      ALA  65  -7.023  13.437  -5.054
  498    HB2  ALA  65           HB2      ALA  65  -8.123  13.007  -3.743
  499    HB3  ALA  65           HB3      ALA  65  -7.846  11.877  -5.069
  500    H    GLY  66           H        GLY  66  -4.381  10.283  -3.559
  501    HA2  GLY  66           HA2      GLY  66  -3.066   9.795  -5.654
  502    HA3  GLY  66           HA3      GLY  66  -2.848  11.535  -5.752
  503    H    CYS  67           H        CYS  67  -2.706  11.285  -2.614
  504    HA   CYS  67           HA       CYS  67   0.105  11.460  -2.456
  505    HB2  CYS  67           HB2      CYS  67  -1.347  12.573  -0.835
  506    HB3  CYS  67           HB3      CYS  67  -1.932  11.015  -0.262
  507    HG   CYS  67           HG       CYS  67   0.929  10.909   0.232
  508    H    VAL  68           H        VAL  68   1.638  10.048  -1.594
  509    HA   VAL  68           HA       VAL  68   1.071   7.254  -2.031
  510    HB   VAL  68           HB       VAL  68   3.638   8.412  -0.955
  511   HG11  VAL  68          HG11      VAL  68   4.652   6.440  -1.922
  512   HG12  VAL  68          HG12      VAL  68   3.098   5.930  -2.581
  513   HG13  VAL  68          HG13      VAL  68   3.347   5.965  -0.835
  514   HG21  VAL  68          HG21      VAL  68   3.107   9.636  -2.967
  515   HG22  VAL  68          HG22      VAL  68   2.761   8.137  -3.828
  516   HG23  VAL  68          HG23      VAL  68   4.407   8.494  -3.306
  517    H    VAL  69           H        VAL  69   0.041   6.147  -0.500
  518    HA   VAL  69           HA       VAL  69   0.267   6.849   2.292
  519    HB   VAL  69           HB       VAL  69  -1.142   4.449   1.129
  520   HG11  VAL  69          HG11      VAL  69  -0.897   4.280   3.495
  521   HG12  VAL  69          HG12      VAL  69  -2.564   4.755   3.169
  522   HG13  VAL  69          HG13      VAL  69  -1.398   5.955   3.725
  523   HG21  VAL  69          HG21      VAL  69  -2.138   7.272   1.481
  524   HG22  VAL  69          HG22      VAL  69  -3.186   5.882   1.200
  525   HG23  VAL  69          HG23      VAL  69  -2.009   6.360  -0.023
  526    H    ALA  70           H        ALA  70   1.616   4.471   0.131
  527    HA   ALA  70           HA       ALA  70   3.565   3.696   2.067
  528    HB1  ALA  70           HB1      ALA  70   1.463   2.385   2.696
  529    HB2  ALA  70           HB2      ALA  70   2.963   1.477   2.502
  530    HB3  ALA  70           HB3      ALA  70   1.750   1.461   1.221
  531    H    ARG  71           H        ARG  71   4.378   1.274   1.029
  532    HA   ARG  71           HA       ARG  71   4.709   1.663  -1.850
  533    HB2  ARG  71           HB2      ARG  71   6.872   1.790   0.207
  534    HB3  ARG  71           HB3      ARG  71   7.233   1.044  -1.344
  535    HG2  ARG  71           HG2      ARG  71   6.254   3.854  -0.889
  536    HG3  ARG  71           HG3      ARG  71   7.878   3.364  -1.376
  537    HD2  ARG  71           HD2      ARG  71   6.067   2.186  -3.197
  538    HD3  ARG  71           HD3      ARG  71   5.587   3.871  -3.004
  539    HE   ARG  71           HE       ARG  71   7.843   2.916  -4.410
  540   HH11  ARG  71          HH11      ARG  71   6.846   5.508  -2.296
  541   HH12  ARG  71          HH12      ARG  71   8.007   6.631  -2.921
  542   HH21  ARG  71          HH21      ARG  71   9.370   4.391  -5.232
  543   HH22  ARG  71          HH22      ARG  71   9.440   5.998  -4.588
  544    H    LEU  72           H        LEU  72   4.850  -0.218  -2.979
  545    HA   LEU  72           HA       LEU  72   4.566  -2.679  -1.434
  546    HB2  LEU  72           HB2      LEU  72   3.464  -1.698  -3.866
  547    HB3  LEU  72           HB3      LEU  72   4.380  -3.148  -4.235
  548    HG   LEU  72           HG       LEU  72   2.003  -3.619  -3.791
  549   HD11  LEU  72          HD11      LEU  72   3.276  -5.492  -3.397
  550   HD12  LEU  72          HD12      LEU  72   2.488  -5.275  -1.834
  551   HD13  LEU  72          HD13      LEU  72   4.155  -4.747  -2.062
  552   HD21  LEU  72          HD21      LEU  72   2.592  -2.041  -1.390
  553   HD22  LEU  72          HD22      LEU  72   1.672  -3.516  -1.095
  554   HD23  LEU  72          HD23      LEU  72   1.064  -2.311  -2.228
  555    H    GLU  73           H        GLU  73   6.180  -4.036  -1.161
  556    HA   GLU  73           HA       GLU  73   8.625  -3.703  -2.717
  557    HB2  GLU  73           HB2      GLU  73   8.017  -4.457  -0.023
  558    HB3  GLU  73           HB3      GLU  73   8.909  -5.767  -0.784
  559    HG2  GLU  73           HG2      GLU  73   9.948  -3.027  -1.176
  560    HG3  GLU  73           HG3      GLU  73  10.093  -3.725   0.437
  561    H    LEU  74           H        LEU  74   7.677  -4.609  -4.672
  562    HA   LEU  74           HA       LEU  74   6.657  -7.225  -4.823
  563    HB2  LEU  74           HB2      LEU  74   8.005  -5.513  -6.904
  564    HB3  LEU  74           HB3      LEU  74   7.254  -7.058  -7.254
  565    HG   LEU  74           HG       LEU  74   5.815  -4.645  -6.148
  566   HD11  LEU  74          HD11      LEU  74   5.037  -4.175  -8.267
  567   HD12  LEU  74          HD12      LEU  74   5.392  -5.794  -8.871
  568   HD13  LEU  74          HD13      LEU  74   6.705  -4.651  -8.589
  569   HD21  LEU  74          HD21      LEU  74   4.838  -7.356  -7.031
  570   HD22  LEU  74          HD22      LEU  74   3.790  -5.972  -6.718
  571   HD23  LEU  74          HD23      LEU  74   4.751  -6.664  -5.411
  572    H    ASP  75           H        ASP  75   7.721  -8.956  -4.167
  573    HA   ASP  75           HA       ASP  75  10.577  -9.148  -4.202
  574    HB2  ASP  75           HB2      ASP  75   8.425 -11.177  -3.575
  575    HB3  ASP  75           HB3      ASP  75  10.149 -11.493  -3.410
  576    H    ASP  76           H        ASP  76  10.394  -8.647  -6.673
  577    HA   ASP  76           HA       ASP  76  11.107 -11.068  -8.027
  578    HB2  ASP  76           HB2      ASP  76   8.520 -10.877  -8.116
  579    HB3  ASP  76           HB3      ASP  76   8.813  -9.595  -9.287
  580    H    LEU  77           H        LEU  77  12.600 -10.648  -9.518
  581    HA   LEU  77           HA       LEU  77  13.254  -7.877 -10.083
  582    HB2  LEU  77           HB2      LEU  77  14.640 -10.480 -10.699
  583    HB3  LEU  77           HB3      LEU  77  15.233  -8.929 -11.261
  584    HG   LEU  77           HG       LEU  77  15.482  -8.182  -8.927
  585   HD11  LEU  77          HD11      LEU  77  13.882  -9.347  -7.702
  586   HD12  LEU  77          HD12      LEU  77  15.405 -10.080  -7.199
  587   HD13  LEU  77          HD13      LEU  77  14.371 -10.907  -8.364
  588   HD21  LEU  77          HD21      LEU  77  17.303  -9.363 -10.207
  589   HD22  LEU  77          HD22      LEU  77  16.860 -10.827  -9.328
  590   HD23  LEU  77          HD23      LEU  77  17.449  -9.415  -8.450
  591    H    GLU  78           H        GLU  78  12.521 -10.829 -11.924
  592    HA   GLU  78           HA       GLU  78  11.093  -9.378 -13.917
  593    HB2  GLU  78           HB2      GLU  78  13.375  -8.836 -14.639
  594    HB3  GLU  78           HB3      GLU  78  13.769 -10.549 -14.700
  595    HG2  GLU  78           HG2      GLU  78  13.366  -9.846 -16.919
  596    HG3  GLU  78           HG3      GLU  78  11.976 -10.811 -16.424
  597    H    HIS  79           H        HIS  79   9.523 -10.694 -14.548
  598    HA   HIS  79           HA       HIS  79   9.352 -13.383 -13.810
  599    HB2  HIS  79           HB2      HIS  79   7.392 -11.986 -14.320
  600    HB3  HIS  79           HB3      HIS  79   7.859 -11.950 -16.017
  601    HD1  HIS  79           HD1      HIS  79   6.610 -14.344 -13.378
  602    HD2  HIS  79           HD2      HIS  79   7.026 -14.105 -17.505
  603    HE1  HIS  79           HE1      HIS  79   5.386 -16.341 -14.294
  604    HE2  HIS  79           HE2      HIS  79   5.722 -16.220 -16.788
  605    H    HIS  80           H        HIS  80   9.936 -15.254 -14.744
  606    HA   HIS  80           HA       HIS  80  10.528 -15.470 -17.542
  607    HB2  HIS  80           HB2      HIS  80  12.605 -14.431 -16.354
  608    HB3  HIS  80           HB3      HIS  80  12.860 -16.065 -15.748
  609    HD1  HIS  80           HD1      HIS  80  12.252 -14.443 -19.145
  610    HD2  HIS  80           HD2      HIS  80  14.441 -17.507 -17.388
  611    HE1  HIS  80           HE1      HIS  80  13.641 -15.424 -20.997
  612    HE2  HIS  80           HE2      HIS  80  14.892 -17.332 -19.929
  613    H    HIS  81           H        HIS  81  10.691 -17.610 -18.240
  614    HA   HIS  81           HA       HIS  81   9.375 -19.529 -16.637
  615    HB2  HIS  81           HB2      HIS  81  10.876 -19.754 -19.246
  616    HB3  HIS  81           HB3      HIS  81  10.056 -21.120 -18.496
  617    HD1  HIS  81           HD1      HIS  81   7.475 -21.128 -18.546
  618    HD2  HIS  81           HD2      HIS  81   9.196 -17.839 -20.413
  619    HE1  HIS  81           HE1      HIS  81   5.614 -20.041 -19.842
  620    HE2  HIS  81           HE2      HIS  81   6.699 -18.102 -21.032
  621    H    HIS  82           H        HIS  82  10.334 -21.801 -16.365
  622    HA   HIS  82           HA       HIS  82  13.162 -21.969 -15.905
  623    HB2  HIS  82           HB2      HIS  82  12.890 -22.489 -13.446
  624    HB3  HIS  82           HB3      HIS  82  12.677 -20.797 -13.885
  625    HD1  HIS  82           HD1      HIS  82  10.313 -19.795 -13.635
  626    HD2  HIS  82           HD2      HIS  82  10.586 -23.786 -12.512
  627    HE1  HIS  82           HE1      HIS  82   8.173 -20.298 -12.413
  628    HE2  HIS  82           HE2      HIS  82   8.398 -22.695 -11.670
  629    H    HIS  83           H        HIS  83  13.710 -24.119 -14.824
  630    HA   HIS  83           HA       HIS  83  11.958 -26.158 -15.984
  631    HB2  HIS  83           HB2      HIS  83  13.887 -27.657 -15.805
  632    HB3  HIS  83           HB3      HIS  83  14.319 -26.184 -16.667
  633    HD1  HIS  83           HD1      HIS  83  16.393 -25.080 -15.889
  634    HD2  HIS  83           HD2      HIS  83  14.739 -27.514 -12.955
  635    HE1  HIS  83           HE1      HIS  83  18.025 -25.032 -13.976
  636    HE2  HIS  83           HE2      HIS  83  16.962 -26.444 -12.180
  637    H    HIS  84           H        HIS  84  12.404 -28.376 -14.632
  638    HA   HIS  84           HA       HIS  84  10.833 -28.135 -12.323
  639    HB2  HIS  84           HB2      HIS  84  12.535 -30.342 -13.444
  640    HB3  HIS  84           HB3      HIS  84  11.747 -30.526 -11.881
  641    HD1  HIS  84           HD1      HIS  84  11.196 -31.098 -15.377
  642    HD2  HIS  84           HD2      HIS  84   8.799 -30.073 -12.140
  643    HE1  HIS  84           HE1      HIS  84   8.845 -31.647 -16.080
  644    HE2  HIS  84           HE2      HIS  84   7.423 -31.100 -14.074
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1   5.000  12.544 -15.008
    2    H2   MET   1           H2       MET   1   6.671  12.881 -14.829
    3    H3   MET   1           H3       MET   1   5.943  12.953 -16.382
    4    HA   MET   1           HA       MET   1   5.422  10.591 -16.185
    5    HB2  MET   1           HB2      MET   1   8.149  11.789 -16.316
    6    HB3  MET   1           HB3      MET   1   8.027  10.035 -16.291
    7    HG2  MET   1           HG2      MET   1   6.610  11.810 -18.263
    8    HG3  MET   1           HG3      MET   1   8.151  11.009 -18.562
    9    HE1  MET   1           HE1      MET   1   6.330   8.553 -20.760
   10    HE2  MET   1           HE2      MET   1   7.892   9.265 -20.354
   11    HE3  MET   1           HE3      MET   1   6.533  10.305 -20.779
   12    H    GLU   2           H        GLU   2   4.806  11.150 -13.588
   13    HA   GLU   2           HA       GLU   2   6.615   9.447 -12.010
   14    HB2  GLU   2           HB2      GLU   2   4.502  11.316 -10.937
   15    HB3  GLU   2           HB3      GLU   2   5.786  10.522 -10.036
   16    HG2  GLU   2           HG2      GLU   2   7.388  11.844 -11.534
   17    HG3  GLU   2           HG3      GLU   2   5.977  12.817 -11.948
   18    H    ASN   3           H        ASN   3   5.857   7.419 -12.410
   19    HA   ASN   3           HA       ASN   3   3.554   6.548 -11.031
   20    HB2  ASN   3           HB2      ASN   3   2.742   7.659 -13.311
   21    HB3  ASN   3           HB3      ASN   3   3.173   6.076 -13.950
   22   HD21  ASN   3          HD21      ASN   3   0.674   6.599 -14.265
   23   HD22  ASN   3          HD22      ASN   3  -0.339   5.819 -13.103
   24    H    ASP   4           H        ASP   4   3.814   4.462 -10.520
   25    HA   ASP   4           HA       ASP   4   5.094   2.597 -12.300
   26    HB2  ASP   4           HB2      ASP   4   6.569   3.845 -10.065
   27    HB3  ASP   4           HB3      ASP   4   6.693   2.091 -10.163
   28    HA   PRO   5           HA       PRO   5   2.651  -0.249  -9.984
   29    HB2  PRO   5           HB2      PRO   5   4.007  -2.560 -10.241
   30    HB3  PRO   5           HB3      PRO   5   3.213  -1.782 -11.616
   31    HG2  PRO   5           HG2      PRO   5   6.100  -1.739 -10.823
   32    HG3  PRO   5           HG3      PRO   5   5.386  -1.938 -12.433
   33    HD2  PRO   5           HD2      PRO   5   6.389   0.429 -11.517
   34    HD3  PRO   5           HD3      PRO   5   5.080   0.320 -12.711
   35    H    THR   6           H        THR   6   5.977   0.186  -9.054
   36    HA   THR   6           HA       THR   6   5.631  -1.255  -6.551
   37    HB   THR   6           HB       THR   6   7.967  -0.944  -6.205
   38    HG1  THR   6           HG1      THR   6   9.169   0.526  -7.316
   39   HG21  THR   6          HG21      THR   6   7.666  -1.263  -9.179
   40   HG22  THR   6          HG22      THR   6   7.413  -2.552  -8.001
   41   HG23  THR   6          HG23      THR   6   9.005  -1.813  -8.173
   42    H    VAL   7           H        VAL   7   3.887   0.889  -6.737
   43    HA   VAL   7           HA       VAL   7   4.804   2.510  -4.511
   44    HB   VAL   7           HB       VAL   7   4.090   4.611  -5.507
   45   HG11  VAL   7          HG11      VAL   7   6.050   5.017  -6.622
   46   HG12  VAL   7          HG12      VAL   7   5.982   3.501  -7.520
   47   HG13  VAL   7          HG13      VAL   7   6.460   3.500  -5.823
   48   HG21  VAL   7          HG21      VAL   7   2.954   2.847  -7.417
   49   HG22  VAL   7          HG22      VAL   7   4.040   3.961  -8.245
   50   HG23  VAL   7          HG23      VAL   7   2.728   4.585  -7.246
   51    H    LEU   8           H        LEU   8   2.939   3.983  -3.739
   52    HA   LEU   8           HA       LEU   8   0.304   2.887  -4.299
   53    HB2  LEU   8           HB2      LEU   8   1.727   1.834  -2.202
   54    HB3  LEU   8           HB3      LEU   8   0.786   3.094  -1.426
   55    HG   LEU   8           HG       LEU   8  -0.425   1.028  -1.271
   56   HD11  LEU   8          HD11      LEU   8  -2.432   1.909  -1.775
   57   HD12  LEU   8          HD12      LEU   8  -1.988   2.234  -3.450
   58   HD13  LEU   8          HD13      LEU   8  -1.485   3.343  -2.174
   59   HD21  LEU   8          HD21      LEU   8  -0.817   0.728  -4.180
   60   HD22  LEU   8          HD22      LEU   8  -0.667  -0.496  -2.919
   61   HD23  LEU   8          HD23      LEU   8   0.775   0.291  -3.559
   62    H    ARG   9           H        ARG   9  -0.254   4.898  -5.064
   63    HA   ARG   9           HA       ARG   9  -0.043   7.202  -3.292
   64    HB2  ARG   9           HB2      ARG   9  -0.787   6.841  -6.179
   65    HB3  ARG   9           HB3      ARG   9  -1.174   8.335  -5.337
   66    HG2  ARG   9           HG2      ARG   9   0.844   8.878  -6.252
   67    HG3  ARG   9           HG3      ARG   9   1.362   8.260  -4.683
   68    HD2  ARG   9           HD2      ARG   9   1.979   6.165  -5.619
   69    HD3  ARG   9           HD3      ARG   9   1.198   6.548  -7.152
   70    HE   ARG   9           HE       ARG   9   3.838   7.238  -6.371
   71   HH11  ARG   9          HH11      ARG   9   1.096   8.418  -8.180
   72   HH12  ARG   9          HH12      ARG   9   2.056   9.404  -9.232
   73   HH21  ARG   9          HH21      ARG   9   5.101   8.534  -7.754
   74   HH22  ARG   9          HH22      ARG   9   4.330   9.469  -8.990
   75    H    SER  10           H        SER  10  -1.825   8.387  -2.559
   76    HA   SER  10           HA       SER  10  -4.103   6.849  -1.869
   77    HB2  SER  10           HB2      SER  10  -2.955   9.248  -1.004
   78    HB3  SER  10           HB3      SER  10  -4.539   9.710  -1.623
   79    HG   SER  10           HG       SER  10  -5.003   9.110   0.388
   80    HA   PRO  11           HA       PRO  11  -6.651   7.568  -5.415
   81    HB2  PRO  11           HB2      PRO  11  -9.079   7.025  -4.373
   82    HB3  PRO  11           HB3      PRO  11  -7.875   5.764  -4.663
   83    HG2  PRO  11           HG2      PRO  11  -8.580   7.158  -2.109
   84    HG3  PRO  11           HG3      PRO  11  -8.273   5.435  -2.394
   85    HD2  PRO  11           HD2      PRO  11  -6.413   7.125  -1.348
   86    HD3  PRO  11           HD3      PRO  11  -5.992   5.702  -2.321
   87    H    SER  12           H        SER  12  -7.380   9.198  -2.383
   88    HA   SER  12           HA       SER  12  -8.078  11.604  -3.833
   89    HB2  SER  12           HB2      SER  12 -10.068  10.529  -1.833
   90    HB3  SER  12           HB3      SER  12 -10.262  11.896  -2.930
   91    HG   SER  12           HG       SER  12 -11.340  10.091  -3.748
   92    H    ALA  13           H        ALA  13  -8.896  13.278  -1.996
   93    HA   ALA  13           HA       ALA  13  -6.630  13.565  -0.265
   94    HB1  ALA  13           HB1      ALA  13  -7.650  15.673   0.397
   95    HB2  ALA  13           HB2      ALA  13  -9.144  15.224  -0.427
   96    HB3  ALA  13           HB3      ALA  13  -7.671  15.496  -1.358
   97    H    GLY  14           H        GLY  14  -6.446  12.481   1.580
   98    HA2  GLY  14           HA2      GLY  14  -8.779  12.368   3.365
   99    HA3  GLY  14           HA3      GLY  14  -7.917  10.883   2.993
  100    H    LYS  15           H        LYS  15  -7.156  10.429   5.011
  101    HA   LYS  15           HA       LYS  15  -4.843  11.882   5.873
  102    HB2  LYS  15           HB2      LYS  15  -6.920  13.108   6.824
  103    HB3  LYS  15           HB3      LYS  15  -7.044  11.731   7.910
  104    HG2  LYS  15           HG2      LYS  15  -4.353  12.793   7.830
  105    HG3  LYS  15           HG3      LYS  15  -5.536  14.018   8.295
  106    HD2  LYS  15           HD2      LYS  15  -5.516  11.292   9.554
  107    HD3  LYS  15           HD3      LYS  15  -4.484  12.593  10.153
  108    HE2  LYS  15           HE2      LYS  15  -6.946  13.803   9.920
  109    HE3  LYS  15           HE3      LYS  15  -7.353  12.177  10.469
  110    HZ1  LYS  15           HZ1      LYS  15  -5.480  14.066  11.791
  111    HZ2  LYS  15           HZ2      LYS  15  -5.759  12.476  12.296
  112    HZ3  LYS  15           HZ3      LYS  15  -7.012  13.611  12.349
  113    H    LEU  16           H        LEU  16  -3.493  10.633   7.089
  114    HA   LEU  16           HA       LEU  16  -3.976   7.840   7.151
  115    HB2  LEU  16           HB2      LEU  16  -1.741   9.195   7.055
  116    HB3  LEU  16           HB3      LEU  16  -1.855   9.157   8.802
  117    HG   LEU  16           HG       LEU  16  -1.774   6.743   8.817
  118   HD11  LEU  16          HD11      LEU  16  -1.293   5.596   6.579
  119   HD12  LEU  16          HD12      LEU  16  -1.975   7.045   5.840
  120   HD13  LEU  16          HD13      LEU  16  -2.959   6.062   6.924
  121   HD21  LEU  16          HD21      LEU  16   0.460   6.593   8.501
  122   HD22  LEU  16          HD22      LEU  16   0.316   8.340   8.310
  123   HD23  LEU  16          HD23      LEU  16   0.391   7.301   6.887
  124    H    THR  17           H        THR  17  -5.682   7.241   8.408
  125    HA   THR  17           HA       THR  17  -6.094   8.286  11.042
  126    HB   THR  17           HB       THR  17  -7.947   7.514   9.574
  127    HG1  THR  17           HG1      THR  17  -9.037   7.118  11.315
  128   HG21  THR  17          HG21      THR  17  -7.392   4.699  10.340
  129   HG22  THR  17          HG22      THR  17  -6.604   5.372   8.913
  130   HG23  THR  17          HG23      THR  17  -8.364   5.343   9.018
  131    H    GLN  18           H        GLN  18  -4.800   5.270   9.710
  132    HA   GLN  18           HA       GLN  18  -3.214   4.816  12.033
  133    HB2  GLN  18           HB2      GLN  18  -5.836   3.848  12.181
  134    HB3  GLN  18           HB3      GLN  18  -4.857   2.441  11.792
  135    HG2  GLN  18           HG2      GLN  18  -4.443   2.284  13.963
  136    HG3  GLN  18           HG3      GLN  18  -3.412   3.701  13.773
  137   HE21  GLN  18          HE21      GLN  18  -3.796   4.488  15.813
  138   HE22  GLN  18          HE22      GLN  18  -5.319   5.143  16.299
  139    H    TYR  19           H        TYR  19  -2.871   2.029  11.763
  140    HA   TYR  19           HA       TYR  19  -2.251   1.514   8.974
  141    HB2  TYR  19           HB2      TYR  19   0.133   0.975   9.512
  142    HB3  TYR  19           HB3      TYR  19  -0.256   2.689   9.624
  143    HD1  TYR  19           HD1      TYR  19   0.547  -0.343  11.543
  144    HD2  TYR  19           HD2      TYR  19  -0.180   3.845  11.734
  145    HE1  TYR  19           HE1      TYR  19   1.432  -0.300  13.837
  146    HE2  TYR  19           HE2      TYR  19   0.705   3.900  14.027
  147    HH   TYR  19           HH       TYR  19   0.991   1.410  15.949
  148    H    THR  20           H        THR  20  -2.278  -0.618   8.484
  149    HA   THR  20           HA       THR  20  -2.944  -2.451  10.659
  150    HB   THR  20           HB       THR  20  -3.960  -3.835   9.061
  151    HG1  THR  20           HG1      THR  20  -2.318  -2.509   7.189
  152   HG21  THR  20          HG21      THR  20  -5.227  -2.325   7.495
  153   HG22  THR  20          HG22      THR  20  -4.304  -0.988   8.182
  154   HG23  THR  20          HG23      THR  20  -5.361  -1.953   9.214
  155    H    VAL  21           H        VAL  21  -0.249  -1.582   8.834
  156    HA   VAL  21           HA       VAL  21   1.193  -3.920   9.786
  157    HB   VAL  21           HB       VAL  21   2.253  -4.350   7.607
  158   HG11  VAL  21          HG11      VAL  21   0.442  -5.585   6.629
  159   HG12  VAL  21          HG12      VAL  21  -0.749  -4.562   7.433
  160   HG13  VAL  21          HG13      VAL  21   0.274  -5.639   8.384
  161   HG21  VAL  21          HG21      VAL  21   1.744  -2.026   6.724
  162   HG22  VAL  21          HG22      VAL  21   0.124  -2.624   6.368
  163   HG23  VAL  21          HG23      VAL  21   1.526  -3.361   5.592
  164    H    GLU  22           H        GLU  22   3.346  -3.551  10.160
  165    HA   GLU  22           HA       GLU  22   4.169  -0.856  10.472
  166    HB2  GLU  22           HB2      GLU  22   6.286  -1.786  11.237
  167    HB3  GLU  22           HB3      GLU  22   4.940  -2.669  11.945
  168    HG2  GLU  22           HG2      GLU  22   5.525  -4.050   9.608
  169    HG3  GLU  22           HG3      GLU  22   7.097  -3.613  10.277
  170    H    ASP  23           H        ASP  23   6.622  -0.431   9.704
  171    HA   ASP  23           HA       ASP  23   6.472   0.145   6.970
  172    HB2  ASP  23           HB2      ASP  23   8.847   0.018   8.835
  173    HB3  ASP  23           HB3      ASP  23   8.941   0.620   7.183
  174    H    GLY  24           H        GLY  24   6.837  -1.034   5.205
  175    HA2  GLY  24           HA2      GLY  24   7.684  -2.677   3.825
  176    HA3  GLY  24           HA3      GLY  24   8.817  -3.097   5.100
  177    H    GLY  25           H        GLY  25   5.382  -3.031   5.688
  178    HA2  GLY  25           HA2      GLY  25   5.380  -5.719   6.614
  179    HA3  GLY  25           HA3      GLY  25   3.967  -4.696   6.407
  180    H    HIS  26           H        HIS  26   5.500  -7.446   5.347
  181    HA   HIS  26           HA       HIS  26   4.937  -7.476   2.595
  182    HB2  HIS  26           HB2      HIS  26   5.031  -9.975   2.851
  183    HB3  HIS  26           HB3      HIS  26   6.427  -9.121   3.499
  184    HD1  HIS  26           HD1      HIS  26   6.751  -9.149   6.062
  185    HD2  HIS  26           HD2      HIS  26   3.440 -11.287   4.746
  186    HE1  HIS  26           HE1      HIS  26   6.008 -10.519   8.035
  187    HE2  HIS  26           HE2      HIS  26   4.054 -11.867   7.190
  188    H    VAL  27           H        VAL  27   3.066  -7.499   1.551
  189    HA   VAL  27           HA       VAL  27   0.778  -8.907   2.688
  190    HB   VAL  27           HB       VAL  27  -0.751  -7.026   2.251
  191   HG11  VAL  27          HG11      VAL  27   0.286  -7.441   4.498
  192   HG12  VAL  27          HG12      VAL  27  -0.267  -5.788   4.226
  193   HG13  VAL  27          HG13      VAL  27   1.451  -6.172   4.119
  194   HG21  VAL  27          HG21      VAL  27   0.061  -5.536   0.762
  195   HG22  VAL  27          HG22      VAL  27   1.735  -5.797   1.253
  196   HG23  VAL  27          HG23      VAL  27   0.689  -4.746   2.208
  197    H    GLU  28           H        GLU  28  -0.463  -9.882   1.179
  198    HA   GLU  28           HA       GLU  28   0.427  -9.754  -1.571
  199    HB2  GLU  28           HB2      GLU  28  -0.973 -11.668  -1.946
  200    HB3  GLU  28           HB3      GLU  28  -0.111 -11.911  -0.433
  201    HG2  GLU  28           HG2      GLU  28  -2.565 -10.626   0.161
  202    HG3  GLU  28           HG3      GLU  28  -2.902 -11.976  -0.922
  203    H    ALA  29           H        ALA  29  -1.189  -9.629  -3.347
  204    HA   ALA  29           HA       ALA  29  -2.490  -7.225  -3.456
  205    HB1  ALA  29           HB1      ALA  29  -2.033  -9.146  -5.252
  206    HB2  ALA  29           HB2      ALA  29  -3.184  -7.838  -5.525
  207    HB3  ALA  29           HB3      ALA  29  -3.755  -9.417  -4.987
  208    H    GLY  30           H        GLY  30  -4.337  -6.387  -2.707
  209    HA2  GLY  30           HA2      GLY  30  -6.643  -6.451  -2.155
  210    HA3  GLY  30           HA3      GLY  30  -6.510  -8.185  -1.910
  211    H    SER  31           H        SER  31  -4.032  -7.800  -0.288
  212    HA   SER  31           HA       SER  31  -5.312  -7.600   2.251
  213    HB2  SER  31           HB2      SER  31  -2.406  -7.830   1.452
  214    HB3  SER  31           HB3      SER  31  -2.949  -7.811   3.129
  215    HG   SER  31           HG       SER  31  -3.894  -9.741   2.866
  216    H    SER  32           H        SER  32  -5.661  -5.858   3.456
  217    HA   SER  32           HA       SER  32  -4.959  -3.263   2.572
  218    HB2  SER  32           HB2      SER  32  -5.752  -2.679   5.002
  219    HB3  SER  32           HB3      SER  32  -6.916  -3.281   3.822
  220    HG   SER  32           HG       SER  32  -7.018  -4.342   5.888
  221    H    TYR  33           H        TYR  33  -3.437  -1.824   3.285
  222    HA   TYR  33           HA       TYR  33  -1.349  -2.922   5.051
  223    HB2  TYR  33           HB2      TYR  33   0.293  -1.646   3.807
  224    HB3  TYR  33           HB3      TYR  33  -0.633  -2.646   2.693
  225    HD1  TYR  33           HD1      TYR  33   0.055   0.777   3.803
  226    HD2  TYR  33           HD2      TYR  33  -2.140  -1.643   1.078
  227    HE1  TYR  33           HE1      TYR  33  -0.473   2.773   2.466
  228    HE2  TYR  33           HE2      TYR  33  -2.673   0.346  -0.267
  229    HH   TYR  33           HH       TYR  33  -1.130   3.361   0.216
  230    H    ALA  34           H        ALA  34  -3.698  -0.529   4.739
  231    HA   ALA  34           HA       ALA  34  -3.019   0.703   7.190
  232    HB1  ALA  34           HB1      ALA  34  -2.743   2.640   4.930
  233    HB2  ALA  34           HB2      ALA  34  -1.353   1.690   5.452
  234    HB3  ALA  34           HB3      ALA  34  -2.165   2.765   6.591
  235    H    GLU  35           H        GLU  35  -4.284   3.064   7.103
  236    HA   GLU  35           HA       GLU  35  -6.831   2.729   5.729
  237    HB2  GLU  35           HB2      GLU  35  -6.837   3.229   8.696
  238    HB3  GLU  35           HB3      GLU  35  -8.181   2.766   7.663
  239    HG2  GLU  35           HG2      GLU  35  -6.814   0.598   7.285
  240    HG3  GLU  35           HG3      GLU  35  -5.968   1.087   8.752
  241    H    MET  36           H        MET  36  -8.214   4.664   5.934
  242    HA   MET  36           HA       MET  36  -6.930   7.086   6.871
  243    HB2  MET  36           HB2      MET  36  -6.989   8.236   4.746
  244    HB3  MET  36           HB3      MET  36  -6.028   6.773   4.584
  245    HG2  MET  36           HG2      MET  36  -8.435   5.835   3.839
  246    HG3  MET  36           HG3      MET  36  -8.580   7.515   3.324
  247    HE1  MET  36           HE1      MET  36  -8.710   7.082   0.709
  248    HE2  MET  36           HE2      MET  36  -8.917   5.407   1.221
  249    HE3  MET  36           HE3      MET  36  -7.774   5.801  -0.062
  250    H    GLU  37           H        GLU  37  -8.422   8.305   7.807
  251    HA   GLU  37           HA       GLU  37 -11.235   7.757   7.304
  252    HB2  GLU  37           HB2      GLU  37 -10.161   8.007   9.626
  253    HB3  GLU  37           HB3      GLU  37 -10.147   9.734   9.296
  254    HG2  GLU  37           HG2      GLU  37 -12.483   9.860   9.248
  255    HG3  GLU  37           HG3      GLU  37 -12.659   8.112   9.097
  256    H    VAL  38           H        VAL  38 -12.147   8.802   5.668
  257    HA   VAL  38           HA       VAL  38 -11.245  11.478   4.939
  258    HB   VAL  38           HB       VAL  38 -13.477  10.092   3.510
  259   HG11  VAL  38          HG11      VAL  38 -13.108  12.091   2.483
  260   HG12  VAL  38          HG12      VAL  38 -11.953  11.100   1.592
  261   HG13  VAL  38          HG13      VAL  38 -11.399  12.126   2.915
  262   HG21  VAL  38          HG21      VAL  38 -10.563   9.349   3.281
  263   HG22  VAL  38          HG22      VAL  38 -11.797   8.912   2.099
  264   HG23  VAL  38          HG23      VAL  38 -11.899   8.298   3.749
  265    H    MET  39           H        MET  39 -13.080  13.027   4.253
  266    HA   MET  39           HA       MET  39 -14.537  13.756   6.518
  267    HB2  MET  39           HB2      MET  39 -15.287  14.520   3.699
  268    HB3  MET  39           HB3      MET  39 -15.549  15.442   5.173
  269    HG2  MET  39           HG2      MET  39 -12.761  14.923   4.896
  270    HG3  MET  39           HG3      MET  39 -13.377  15.575   3.379
  271    HE1  MET  39           HE1      MET  39 -14.658  19.043   4.224
  272    HE2  MET  39           HE2      MET  39 -15.164  17.540   3.453
  273    HE3  MET  39           HE3      MET  39 -13.607  18.260   3.044
  274    H    LYS  40           H        LYS  40 -15.340  11.632   3.875
  275    HA   LYS  40           HA       LYS  40 -18.147  11.549   4.427
  276    HB2  LYS  40           HB2      LYS  40 -17.293  11.114   2.183
  277    HB3  LYS  40           HB3      LYS  40 -16.377   9.737   2.777
  278    HG2  LYS  40           HG2      LYS  40 -18.145   8.585   2.030
  279    HG3  LYS  40           HG3      LYS  40 -18.839   9.041   3.586
  280    HD2  LYS  40           HD2      LYS  40 -19.476  11.212   2.122
  281    HD3  LYS  40           HD3      LYS  40 -19.498   9.972   0.866
  282    HE2  LYS  40           HE2      LYS  40 -20.908   9.522   3.468
  283    HE3  LYS  40           HE3      LYS  40 -21.667  10.482   2.198
  284    HZ1  LYS  40           HZ1      LYS  40 -22.376   8.236   1.969
  285    HZ2  LYS  40           HZ2      LYS  40 -20.789   7.654   2.016
  286    HZ3  LYS  40           HZ3      LYS  40 -21.317   8.561   0.691
  287    H    MET  41           H        MET  41 -15.817   8.853   4.453
  288    HA   MET  41           HA       MET  41 -16.632   8.094   7.131
  289    HB2  MET  41           HB2      MET  41 -17.479   6.640   4.680
  290    HB3  MET  41           HB3      MET  41 -16.963   5.668   6.051
  291    HG2  MET  41           HG2      MET  41 -18.608   6.970   7.443
  292    HG3  MET  41           HG3      MET  41 -19.223   7.642   5.934
  293    HE1  MET  41           HE1      MET  41 -21.315   6.883   5.211
  294    HE2  MET  41           HE2      MET  41 -21.722   5.217   4.799
  295    HE3  MET  41           HE3      MET  41 -20.392   6.030   3.974
  296    H    ILE  42           H        ILE  42 -15.564   5.711   7.471
  297    HA   ILE  42           HA       ILE  42 -12.736   6.192   7.137
  298    HB   ILE  42           HB       ILE  42 -13.559   5.332   9.269
  299   HG12  ILE  42          HG12      ILE  42 -11.978   3.472   9.552
  300   HG13  ILE  42          HG13      ILE  42 -11.875   3.284   7.805
  301   HG21  ILE  42          HG21      ILE  42 -15.244   3.784   7.771
  302   HG22  ILE  42          HG22      ILE  42 -14.958   3.603   9.502
  303   HG23  ILE  42          HG23      ILE  42 -14.068   2.606   8.352
  304   HD11  ILE  42          HD11      ILE  42 -11.272   5.979   8.422
  305   HD12  ILE  42          HD12      ILE  42 -10.214   4.734   7.759
  306   HD13  ILE  42          HD13      ILE  42 -10.341   4.945   9.505
  307    H    MET  43           H        MET  43 -11.260   4.798   6.109
  308    HA   MET  43           HA       MET  43 -12.337   2.678   4.422
  309    HB2  MET  43           HB2      MET  43 -11.074   5.200   3.426
  310    HB3  MET  43           HB3      MET  43 -10.813   3.704   2.540
  311    HG2  MET  43           HG2      MET  43 -13.231   3.428   2.303
  312    HG3  MET  43           HG3      MET  43 -13.484   4.937   3.178
  313    HE1  MET  43           HE1      MET  43 -15.037   5.625   0.956
  314    HE2  MET  43           HE2      MET  43 -14.574   4.076   0.252
  315    HE3  MET  43           HE3      MET  43 -14.376   5.561  -0.677
  316    H    THR  44           H        THR  44 -10.637   1.344   3.439
  317    HA   THR  44           HA       THR  44  -8.155   1.401   5.028
  318    HB   THR  44           HB       THR  44  -8.876  -1.210   3.928
  319    HG1  THR  44           HG1      THR  44 -10.972  -0.565   4.383
  320   HG21  THR  44          HG21      THR  44  -7.144  -0.796   5.669
  321   HG22  THR  44          HG22      THR  44  -8.340  -2.022   6.091
  322   HG23  THR  44          HG23      THR  44  -8.449  -0.406   6.790
  323    H    LEU  45           H        LEU  45  -6.265   1.311   3.957
  324    HA   LEU  45           HA       LEU  45  -6.372   1.320   1.042
  325    HB2  LEU  45           HB2      LEU  45  -4.064   1.893   2.903
  326    HB3  LEU  45           HB3      LEU  45  -4.060   2.120   1.165
  327    HG   LEU  45           HG       LEU  45  -6.124   3.694   1.723
  328   HD11  LEU  45          HD11      LEU  45  -4.724   3.294   4.304
  329   HD12  LEU  45          HD12      LEU  45  -6.421   3.640   3.974
  330   HD13  LEU  45          HD13      LEU  45  -5.225   4.934   3.892
  331   HD21  LEU  45          HD21      LEU  45  -4.364   4.645   0.565
  332   HD22  LEU  45          HD22      LEU  45  -3.185   4.235   1.812
  333   HD23  LEU  45          HD23      LEU  45  -4.336   5.543   2.082
  334    H    ASN  46           H        ASN  46  -5.582  -0.265  -0.223
  335    HA   ASN  46           HA       ASN  46  -4.014  -2.405   1.045
  336    HB2  ASN  46           HB2      ASN  46  -5.349  -3.915  -0.667
  337    HB3  ASN  46           HB3      ASN  46  -6.008  -3.550   0.923
  338   HD21  ASN  46          HD21      ASN  46  -5.873  -1.931  -2.237
  339   HD22  ASN  46          HD22      ASN  46  -7.556  -1.547  -2.300
  340    H    VAL  47           H        VAL  47  -3.036  -3.883  -0.672
  341    HA   VAL  47           HA       VAL  47  -1.772  -2.172  -2.669
  342    HB   VAL  47           HB       VAL  47  -0.187  -4.054  -2.966
  343   HG11  VAL  47          HG11      VAL  47  -0.455  -3.375  -0.049
  344   HG12  VAL  47          HG12      VAL  47   0.088  -2.208  -1.255
  345   HG13  VAL  47          HG13      VAL  47   1.018  -3.679  -0.970
  346   HG21  VAL  47          HG21      VAL  47  -1.981  -5.750  -2.201
  347   HG22  VAL  47          HG22      VAL  47  -1.418  -5.368  -0.574
  348   HG23  VAL  47          HG23      VAL  47  -0.298  -6.036  -1.760
  349    H    GLN  48           H        GLN  48  -1.518  -2.844  -4.862
  350    HA   GLN  48           HA       GLN  48  -3.882  -4.164  -5.887
  351    HB2  GLN  48           HB2      GLN  48  -3.241  -3.343  -8.034
  352    HB3  GLN  48           HB3      GLN  48  -2.962  -2.050  -6.877
  353    HG2  GLN  48           HG2      GLN  48  -0.730  -3.880  -7.652
  354    HG3  GLN  48           HG3      GLN  48  -1.199  -2.544  -8.701
  355   HE21  GLN  48          HE21      GLN  48   0.568  -3.485  -5.984
  356   HE22  GLN  48          HE22      GLN  48   1.050  -1.915  -5.447
  357    H    GLU  49           H        GLU  49  -0.641  -5.001  -5.185
  358    HA   GLU  49           HA       GLU  49  -1.080  -7.672  -6.205
  359    HB2  GLU  49           HB2      GLU  49   1.174  -5.941  -7.233
  360    HB3  GLU  49           HB3      GLU  49   1.098  -7.685  -7.441
  361    HG2  GLU  49           HG2      GLU  49  -0.977  -7.445  -8.707
  362    HG3  GLU  49           HG3      GLU  49  -0.895  -5.696  -8.502
  363    H    ARG  50           H        ARG  50   1.058  -8.993  -5.783
  364    HA   ARG  50           HA       ARG  50   1.519  -8.869  -2.987
  365    HB2  ARG  50           HB2      ARG  50   2.756 -10.497  -5.201
  366    HB3  ARG  50           HB3      ARG  50   3.263 -10.656  -3.525
  367    HG2  ARG  50           HG2      ARG  50   1.717 -12.359  -3.784
  368    HG3  ARG  50           HG3      ARG  50   0.774 -11.071  -3.031
  369    HD2  ARG  50           HD2      ARG  50  -0.403 -12.175  -4.907
  370    HD3  ARG  50           HD3      ARG  50  -0.165 -10.446  -5.155
  371    HE   ARG  50           HE       ARG  50   1.946 -11.941  -6.321
  372   HH11  ARG  50          HH11      ARG  50  -1.390 -11.038  -6.804
  373   HH12  ARG  50          HH12      ARG  50  -1.309 -11.179  -8.528
  374   HH21  ARG  50          HH21      ARG  50   2.055 -12.127  -8.588
  375   HH22  ARG  50          HH22      ARG  50   0.646 -11.798  -9.541
  376    H    GLY  51           H        GLY  51   3.321  -8.262  -1.825
  377    HA2  GLY  51           HA2      GLY  51   5.849  -7.687  -2.559
  378    HA3  GLY  51           HA3      GLY  51   4.982  -6.253  -3.088
  379    H    ARG  52           H        ARG  52   6.895  -5.795  -1.329
  380    HA   ARG  52           HA       ARG  52   5.743  -5.806   1.355
  381    HB2  ARG  52           HB2      ARG  52   8.464  -5.479   0.222
  382    HB3  ARG  52           HB3      ARG  52   8.117  -4.587   1.697
  383    HG2  ARG  52           HG2      ARG  52   8.949  -6.537   2.551
  384    HG3  ARG  52           HG3      ARG  52   7.222  -6.896   2.531
  385    HD2  ARG  52           HD2      ARG  52   8.118  -8.799   1.578
  386    HD3  ARG  52           HD3      ARG  52   7.711  -7.835   0.159
  387    HE   ARG  52           HE       ARG  52   9.944  -7.660  -0.323
  388   HH11  ARG  52          HH11      ARG  52   9.578  -8.807   2.952
  389   HH12  ARG  52          HH12      ARG  52  11.263  -9.152   3.152
  390   HH21  ARG  52          HH21      ARG  52  12.160  -8.114  -0.063
  391   HH22  ARG  52          HH22      ARG  52  12.729  -8.759   1.441
  392    H    VAL  53           H        VAL  53   4.598  -4.137   2.047
  393    HA   VAL  53           HA       VAL  53   4.573  -1.649   0.585
  394    HB   VAL  53           HB       VAL  53   3.119  -2.300   3.150
  395   HG11  VAL  53          HG11      VAL  53   2.714  -0.199   1.029
  396   HG12  VAL  53          HG12      VAL  53   3.132   0.050   2.724
  397   HG13  VAL  53          HG13      VAL  53   1.537  -0.565   2.291
  398   HG21  VAL  53          HG21      VAL  53   2.569  -3.965   1.468
  399   HG22  VAL  53          HG22      VAL  53   2.221  -2.693   0.297
  400   HG23  VAL  53          HG23      VAL  53   1.203  -2.879   1.725
  401    H    LYS  54           H        LYS  54   5.732   0.102   1.034
  402    HA   LYS  54           HA       LYS  54   7.021   0.284   3.679
  403    HB2  LYS  54           HB2      LYS  54   8.039   1.594   1.162
  404    HB3  LYS  54           HB3      LYS  54   8.894   1.346   2.678
  405    HG2  LYS  54           HG2      LYS  54   8.748  -1.121   2.245
  406    HG3  LYS  54           HG3      LYS  54   8.139  -0.726   0.636
  407    HD2  LYS  54           HD2      LYS  54  10.257   0.751   0.459
  408    HD3  LYS  54           HD3      LYS  54  10.848  -0.217   1.811
  409    HE2  LYS  54           HE2      LYS  54  10.202  -2.244   0.366
  410    HE3  LYS  54           HE3      LYS  54  10.142  -1.094  -0.969
  411    HZ1  LYS  54           HZ1      LYS  54  12.444  -0.497  -0.495
  412    HZ2  LYS  54           HZ2      LYS  54  12.300  -2.147  -0.836
  413    HZ3  LYS  54           HZ3      LYS  54  12.496  -1.629   0.762
  414    H    TYR  55           H        TYR  55   5.986   1.723   4.888
  415    HA   TYR  55           HA       TYR  55   4.254   3.706   3.978
  416    HB2  TYR  55           HB2      TYR  55   5.628   3.135   6.558
  417    HB3  TYR  55           HB3      TYR  55   4.887   4.719   6.357
  418    HD1  TYR  55           HD1      TYR  55   3.747   1.392   5.129
  419    HD2  TYR  55           HD2      TYR  55   2.995   4.687   7.713
  420    HE1  TYR  55           HE1      TYR  55   1.556   0.434   5.703
  421    HE2  TYR  55           HE2      TYR  55   0.803   3.737   8.295
  422    HH   TYR  55           HH       TYR  55  -0.078   0.562   7.564
  423    H    ILE  56           H        ILE  56   4.498   5.722   3.253
  424    HA   ILE  56           HA       ILE  56   7.218   6.827   3.159
  425    HB   ILE  56           HB       ILE  56   4.889   6.988   1.317
  426   HG12  ILE  56          HG12      ILE  56   6.590   6.759  -0.380
  427   HG13  ILE  56          HG13      ILE  56   7.865   7.077   0.792
  428   HG21  ILE  56          HG21      ILE  56   5.933   9.031   0.240
  429   HG22  ILE  56          HG22      ILE  56   6.804   9.264   1.756
  430   HG23  ILE  56          HG23      ILE  56   5.040   9.304   1.736
  431   HD11  ILE  56          HD11      ILE  56   7.220   4.985   1.962
  432   HD12  ILE  56          HD12      ILE  56   7.819   4.742   0.321
  433   HD13  ILE  56          HD13      ILE  56   6.088   4.658   0.650
  434    H    LYS  57           H        LYS  57   3.852   7.903   3.487
  435    HA   LYS  57           HA       LYS  57   4.553  10.436   4.583
  436    HB2  LYS  57           HB2      LYS  57   2.139   8.978   3.858
  437    HB3  LYS  57           HB3      LYS  57   1.922   9.955   5.304
  438    HG2  LYS  57           HG2      LYS  57   2.871  10.930   2.617
  439    HG3  LYS  57           HG3      LYS  57   1.277  11.195   3.327
  440    HD2  LYS  57           HD2      LYS  57   2.144  13.122   4.077
  441    HD3  LYS  57           HD3      LYS  57   2.939  12.119   5.291
  442    HE2  LYS  57           HE2      LYS  57   4.822  13.065   4.511
  443    HE3  LYS  57           HE3      LYS  57   4.664  11.884   3.211
  444    HZ1  LYS  57           HZ1      LYS  57   3.540  14.629   3.105
  445    HZ2  LYS  57           HZ2      LYS  57   3.607  13.507   1.841
  446    HZ3  LYS  57           HZ3      LYS  57   5.033  14.191   2.440
  447    H    ARG  58           H        ARG  58   3.849  11.169   6.750
  448    HA   ARG  58           HA       ARG  58   4.638   9.205   8.754
  449    HB2  ARG  58           HB2      ARG  58   4.614  12.157   8.565
  450    HB3  ARG  58           HB3      ARG  58   4.294  11.493  10.161
  451    HG2  ARG  58           HG2      ARG  58   6.584  11.783  10.171
  452    HG3  ARG  58           HG3      ARG  58   6.412  10.078   9.747
  453    HD2  ARG  58           HD2      ARG  58   7.142  10.392   7.618
  454    HD3  ARG  58           HD3      ARG  58   6.471  12.019   7.513
  455    HE   ARG  58           HE       ARG  58   8.490  12.839   8.185
  456   HH11  ARG  58          HH11      ARG  58   8.324   9.467   9.067
  457   HH12  ARG  58          HH12      ARG  58   9.967   9.399   9.609
  458   HH21  ARG  58          HH21      ARG  58  10.652  12.752   8.897
  459   HH22  ARG  58          HH22      ARG  58  11.289  11.264   9.513
  460    HA   PRO  59           HA       PRO  59   0.703   8.497  10.588
  461    HB2  PRO  59           HB2      PRO  59   1.109   9.058  13.248
  462    HB3  PRO  59           HB3      PRO  59   1.623   7.564  12.459
  463    HG2  PRO  59           HG2      PRO  59   3.214  10.014  13.099
  464    HG3  PRO  59           HG3      PRO  59   3.672   8.308  13.254
  465    HD2  PRO  59           HD2      PRO  59   4.523   9.815  11.200
  466    HD3  PRO  59           HD3      PRO  59   4.130   8.096  10.993
  467    H    GLY  60           H        GLY  60  -1.095   9.675  10.494
  468    HA2  GLY  60           HA2      GLY  60  -2.587  11.360  11.158
  469    HA3  GLY  60           HA3      GLY  60  -1.244  12.237  11.875
  470    H    ALA  61           H        ALA  61   0.171  11.663   9.157
  471    HA   ALA  61           HA       ALA  61  -0.148  14.192   8.046
  472    HB1  ALA  61           HB1      ALA  61   1.786  12.728   7.637
  473    HB2  ALA  61           HB2      ALA  61   1.095  13.358   6.142
  474    HB3  ALA  61           HB3      ALA  61   0.773  11.694   6.629
  475    H    VAL  62           H        VAL  62  -1.516  15.083   6.634
  476    HA   VAL  62           HA       VAL  62  -3.897  13.650   5.903
  477    HB   VAL  62           HB       VAL  62  -3.998  16.021   6.537
  478   HG11  VAL  62          HG11      VAL  62  -2.616  16.621   3.930
  479   HG12  VAL  62          HG12      VAL  62  -1.804  16.629   5.495
  480   HG13  VAL  62          HG13      VAL  62  -3.114  17.765   5.176
  481   HG21  VAL  62          HG21      VAL  62  -5.303  16.814   4.488
  482   HG22  VAL  62          HG22      VAL  62  -5.836  15.321   5.261
  483   HG23  VAL  62          HG23      VAL  62  -4.890  15.255   3.774
  484    H    LEU  63           H        LEU  63  -4.147  12.463   4.136
  485    HA   LEU  63           HA       LEU  63  -2.160  12.518   2.040
  486    HB2  LEU  63           HB2      LEU  63  -4.656  10.892   1.859
  487    HB3  LEU  63           HB3      LEU  63  -3.035  10.504   1.318
  488    HG   LEU  63           HG       LEU  63  -4.047  10.461   4.161
  489   HD11  LEU  63          HD11      LEU  63  -3.583   8.080   4.030
  490   HD12  LEU  63          HD12      LEU  63  -3.046   8.262   2.360
  491   HD13  LEU  63          HD13      LEU  63  -4.732   8.559   2.781
  492   HD21  LEU  63          HD21      LEU  63  -1.666  11.298   3.834
  493   HD22  LEU  63          HD22      LEU  63  -1.295   9.676   3.250
  494   HD23  LEU  63          HD23      LEU  63  -1.886   9.907   4.895
  495    H    GLU  64           H        GLU  64  -2.474  13.079  -0.092
  496    HA   GLU  64           HA       GLU  64  -4.955  14.559  -0.667
  497    HB2  GLU  64           HB2      GLU  64  -3.785  16.281  -1.574
  498    HB3  GLU  64           HB3      GLU  64  -2.518  15.686  -0.514
  499    HG2  GLU  64           HG2      GLU  64  -1.969  14.212  -2.664
  500    HG3  GLU  64           HG3      GLU  64  -2.736  15.585  -3.460
  501    H    ALA  65           H        ALA  65  -5.632  14.585  -2.930
  502    HA   ALA  65           HA       ALA  65  -5.714  12.006  -4.041
  503    HB1  ALA  65           HB1      ALA  65  -6.240  14.338  -5.799
  504    HB2  ALA  65           HB2      ALA  65  -7.244  14.151  -4.361
  505    HB3  ALA  65           HB3      ALA  65  -7.177  12.862  -5.563
  506    H    GLY  66           H        GLY  66  -3.580  11.287  -4.298
  507    HA2  GLY  66           HA2      GLY  66  -2.294  10.881  -6.433
  508    HA3  GLY  66           HA3      GLY  66  -2.066  12.623  -6.453
  509    H    CYS  67           H        CYS  67  -1.879  12.344  -3.364
  510    HA   CYS  67           HA       CYS  67   0.941  12.402  -3.234
  511    HB2  CYS  67           HB2      CYS  67  -0.475  13.590  -1.618
  512    HB3  CYS  67           HB3      CYS  67  -1.075  12.053  -1.004
  513    HG   CYS  67           HG       CYS  67   0.740  12.530   0.636
  514    H    VAL  68           H        VAL  68   2.407  10.946  -2.296
  515    HA   VAL  68           HA       VAL  68   1.737   8.171  -2.729
  516    HB   VAL  68           HB       VAL  68   4.332   9.239  -1.622
  517   HG11  VAL  68          HG11      VAL  68   5.246   7.210  -2.721
  518   HG12  VAL  68          HG12      VAL  68   3.597   6.725  -3.115
  519   HG13  VAL  68          HG13      VAL  68   4.099   6.853  -1.429
  520   HG21  VAL  68          HG21      VAL  68   4.163  10.473  -3.581
  521   HG22  VAL  68          HG22      VAL  68   3.309   9.188  -4.436
  522   HG23  VAL  68          HG23      VAL  68   5.034   9.032  -4.105
  523    H    VAL  69           H        VAL  69   0.625   7.137  -1.201
  524    HA   VAL  69           HA       VAL  69   0.848   7.846   1.588
  525    HB   VAL  69           HB       VAL  69  -0.644   5.493   0.433
  526   HG11  VAL  69          HG11      VAL  69  -0.355   5.459   2.850
  527   HG12  VAL  69          HG12      VAL  69  -2.042   5.756   2.428
  528   HG13  VAL  69          HG13      VAL  69  -1.020   7.089   2.965
  529   HG21  VAL  69          HG21      VAL  69  -1.580   8.341   0.766
  530   HG22  VAL  69          HG22      VAL  69  -2.621   6.971   0.381
  531   HG23  VAL  69          HG23      VAL  69  -1.367   7.472  -0.754
  532    H    ALA  70           H        ALA  70   2.144   5.426  -0.544
  533    HA   ALA  70           HA       ALA  70   4.027   4.568   1.419
  534    HB1  ALA  70           HB1      ALA  70   1.845   3.327   1.977
  535    HB2  ALA  70           HB2      ALA  70   3.333   2.386   1.857
  536    HB3  ALA  70           HB3      ALA  70   2.178   2.385   0.524
  537    H    ARG  71           H        ARG  71   4.787   2.135   0.375
  538    HA   ARG  71           HA       ARG  71   5.149   2.532  -2.498
  539    HB2  ARG  71           HB2      ARG  71   7.324   2.540  -0.437
  540    HB3  ARG  71           HB3      ARG  71   7.650   1.903  -2.043
  541    HG2  ARG  71           HG2      ARG  71   6.582   4.663  -1.495
  542    HG3  ARG  71           HG3      ARG  71   8.285   4.278  -1.755
  543    HD2  ARG  71           HD2      ARG  71   6.552   3.191  -3.824
  544    HD3  ARG  71           HD3      ARG  71   6.444   4.946  -3.700
  545    HE   ARG  71           HE       ARG  71   8.682   3.406  -4.638
  546   HH11  ARG  71          HH11      ARG  71   7.684   6.446  -3.246
  547   HH12  ARG  71          HH12      ARG  71   9.059   7.313  -3.843
  548   HH21  ARG  71          HH21      ARG  71  10.491   4.545  -5.425
  549   HH22  ARG  71          HH22      ARG  71  10.652   6.235  -5.080
  550    H    LEU  72           H        LEU  72   5.273   0.665  -3.638
  551    HA   LEU  72           HA       LEU  72   4.940  -1.812  -2.124
  552    HB2  LEU  72           HB2      LEU  72   3.805  -0.777  -4.496
  553    HB3  LEU  72           HB3      LEU  72   4.751  -2.176  -4.966
  554    HG   LEU  72           HG       LEU  72   2.522  -2.916  -4.567
  555   HD11  LEU  72          HD11      LEU  72   4.398  -4.321  -3.700
  556   HD12  LEU  72          HD12      LEU  72   2.846  -4.594  -2.907
  557   HD13  LEU  72          HD13      LEU  72   4.091  -3.638  -2.102
  558   HD21  LEU  72          HD21      LEU  72   2.286  -0.829  -2.862
  559   HD22  LEU  72          HD22      LEU  72   2.406  -2.173  -1.726
  560   HD23  LEU  72          HD23      LEU  72   1.143  -2.168  -2.957
  561    H    GLU  73           H        GLU  73   6.108  -3.727  -2.680
  562    HA   GLU  73           HA       GLU  73   8.554  -3.365  -4.237
  563    HB2  GLU  73           HB2      GLU  73   8.795  -2.976  -1.629
  564    HB3  GLU  73           HB3      GLU  73   8.813  -4.733  -1.596
  565    HG2  GLU  73           HG2      GLU  73  10.679  -3.020  -3.219
  566    HG3  GLU  73           HG3      GLU  73  11.062  -3.744  -1.658
  567    H    LEU  74           H        LEU  74   7.512  -4.753  -5.736
  568    HA   LEU  74           HA       LEU  74   6.484  -7.292  -5.109
  569    HB2  LEU  74           HB2      LEU  74   7.368  -5.905  -7.581
  570    HB3  LEU  74           HB3      LEU  74   7.223  -7.651  -7.653
  571    HG   LEU  74           HG       LEU  74   4.871  -7.488  -6.960
  572   HD11  LEU  74          HD11      LEU  74   3.761  -5.336  -6.835
  573   HD12  LEU  74          HD12      LEU  74   5.290  -4.508  -7.135
  574   HD13  LEU  74          HD13      LEU  74   5.060  -5.424  -5.646
  575   HD21  LEU  74          HD21      LEU  74   5.500  -5.703  -9.308
  576   HD22  LEU  74          HD22      LEU  74   4.004  -6.594  -9.027
  577   HD23  LEU  74          HD23      LEU  74   5.502  -7.466  -9.349
  578    H    ASP  75           H        ASP  75   7.523  -8.993  -4.336
  579    HA   ASP  75           HA       ASP  75  10.371  -9.181  -4.335
  580    HB2  ASP  75           HB2      ASP  75   8.559 -10.138  -2.659
  581    HB3  ASP  75           HB3      ASP  75   8.651 -11.544  -3.715
  582    H    ASP  76           H        ASP  76   7.810 -10.497  -6.305
  583    HA   ASP  76           HA       ASP  76   7.815 -11.657  -8.258
  584    HB2  ASP  76           HB2      ASP  76   9.575  -9.925  -8.764
  585    HB3  ASP  76           HB3      ASP  76  10.777 -11.135  -8.351
  586    H    LEU  77           H        LEU  77   8.795 -12.828  -5.559
  587    HA   LEU  77           HA       LEU  77  10.331 -15.123  -6.429
  588    HB2  LEU  77           HB2      LEU  77  10.131 -13.765  -4.057
  589    HB3  LEU  77           HB3      LEU  77   9.168 -15.194  -3.741
  590    HG   LEU  77           HG       LEU  77  11.860 -15.588  -4.943
  591   HD11  LEU  77          HD11      LEU  77  11.788 -15.439  -2.000
  592   HD12  LEU  77          HD12      LEU  77  11.760 -13.899  -2.858
  593   HD13  LEU  77          HD13      LEU  77  13.081 -15.036  -3.130
  594   HD21  LEU  77          HD21      LEU  77  10.392 -17.488  -4.560
  595   HD22  LEU  77          HD22      LEU  77  10.249 -17.054  -2.856
  596   HD23  LEU  77          HD23      LEU  77  11.804 -17.574  -3.507
  597    H    GLU  78           H        GLU  78   8.451 -15.563  -7.964
  598    HA   GLU  78           HA       GLU  78   7.006 -17.809  -6.959
  599    HB2  GLU  78           HB2      GLU  78   4.805 -17.030  -7.081
  600    HB3  GLU  78           HB3      GLU  78   5.669 -15.726  -6.281
  601    HG2  GLU  78           HG2      GLU  78   5.834 -14.573  -8.480
  602    HG3  GLU  78           HG3      GLU  78   4.799 -15.830  -9.158
  603    H    HIS  79           H        HIS  79   6.767 -19.250  -8.550
  604    HA   HIS  79           HA       HIS  79   6.366 -18.400 -11.291
  605    HB2  HIS  79           HB2      HIS  79   8.856 -18.410 -10.932
  606    HB3  HIS  79           HB3      HIS  79   8.744 -20.136 -10.607
  607    HD1  HIS  79           HD1      HIS  79   9.048 -21.600 -12.580
  608    HD2  HIS  79           HD2      HIS  79   7.845 -17.772 -13.660
  609    HE1  HIS  79           HE1      HIS  79   9.076 -21.571 -15.094
  610    HE2  HIS  79           HE2      HIS  79   8.429 -19.219 -15.723
  611    H    HIS  80           H        HIS  80   5.608 -20.062 -12.657
  612    HA   HIS  80           HA       HIS  80   4.046 -22.032 -11.362
  613    HB2  HIS  80           HB2      HIS  80   3.472 -22.787 -13.623
  614    HB3  HIS  80           HB3      HIS  80   3.392 -21.032 -13.507
  615    HD1  HIS  80           HD1      HIS  80   5.105 -23.780 -15.282
  616    HD2  HIS  80           HD2      HIS  80   5.498 -19.664 -14.874
  617    HE1  HIS  80           HE1      HIS  80   6.653 -23.066 -17.131
  618    HE2  HIS  80           HE2      HIS  80   6.807 -20.561 -16.917
  619    H    HIS  81           H        HIS  81   4.475 -24.078 -10.823
  620    HA   HIS  81           HA       HIS  81   6.643 -25.523 -12.119
  621    HB2  HIS  81           HB2      HIS  81   7.720 -26.126 -10.003
  622    HB3  HIS  81           HB3      HIS  81   7.747 -24.382 -10.244
  623    HD1  HIS  81           HD1      HIS  81   7.371 -26.598  -7.612
  624    HD2  HIS  81           HD2      HIS  81   5.124 -23.341  -8.877
  625    HE1  HIS  81           HE1      HIS  81   6.050 -25.871  -5.600
  626    HE2  HIS  81           HE2      HIS  81   4.633 -23.953  -6.413
  627    H    HIS  82           H        HIS  82   6.659 -27.821 -11.556
  628    HA   HIS  82           HA       HIS  82   3.972 -28.831 -11.352
  629    HB2  HIS  82           HB2      HIS  82   6.030 -29.706 -12.766
  630    HB3  HIS  82           HB3      HIS  82   6.355 -30.634 -11.305
  631    HD1  HIS  82           HD1      HIS  82   4.915 -32.664 -10.871
  632    HD2  HIS  82           HD2      HIS  82   3.554 -30.363 -14.052
  633    HE1  HIS  82           HE1      HIS  82   3.118 -34.036 -11.972
  634    HE2  HIS  82           HE2      HIS  82   2.370 -32.660 -13.945
  635    H    HIS  83           H        HIS  83   3.507 -30.730  -9.907
  636    HA   HIS  83           HA       HIS  83   4.038 -29.972  -7.192
  637    HB2  HIS  83           HB2      HIS  83   1.847 -30.896  -8.021
  638    HB3  HIS  83           HB3      HIS  83   2.635 -32.463  -8.174
  639    HD1  HIS  83           HD1      HIS  83   2.278 -33.924  -6.222
  640    HD2  HIS  83           HD2      HIS  83   2.170 -29.906  -5.170
  641    HE1  HIS  83           HE1      HIS  83   1.770 -33.888  -3.759
  642    HE2  HIS  83           HE2      HIS  83   1.797 -31.449  -3.128
  643    H    HIS  84           H        HIS  84   4.893 -31.408  -5.556
  644    HA   HIS  84           HA       HIS  84   7.244 -32.811  -6.518
  645    HB2  HIS  84           HB2      HIS  84   7.894 -32.914  -4.158
  646    HB3  HIS  84           HB3      HIS  84   7.450 -31.273  -4.614
  647    HD1  HIS  84           HD1      HIS  84   5.344 -30.268  -3.529
  648    HD2  HIS  84           HD2      HIS  84   6.170 -34.157  -2.320
  649    HE1  HIS  84           HE1      HIS  84   3.861 -30.683  -1.541
  650    HE2  HIS  84           HE2      HIS  84   4.316 -33.072  -0.880
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1   8.995  11.890 -12.599
    2    H2   MET   1           H2       MET   1  10.403  10.933 -12.794
    3    H3   MET   1           H3       MET   1   9.591  11.553 -14.173
    4    HA   MET   1           HA       MET   1   7.689  10.231 -13.691
    5    HB2  MET   1           HB2      MET   1  10.409   9.070 -14.059
    6    HB3  MET   1           HB3      MET   1   9.072   7.954 -13.820
    7    HG2  MET   1           HG2      MET   1   7.930   9.338 -15.698
    8    HG3  MET   1           HG3      MET   1   9.577   9.849 -16.065
    9    HE1  MET   1           HE1      MET   1   8.615   8.700 -18.517
   10    HE2  MET   1           HE2      MET   1   9.700   7.354 -18.865
   11    HE3  MET   1           HE3      MET   1  10.341   8.852 -18.190
   12    H    GLU   2           H        GLU   2   6.715  10.420 -11.678
   13    HA   GLU   2           HA       GLU   2   7.821   8.719  -9.542
   14    HB2  GLU   2           HB2      GLU   2   5.871  11.008  -9.242
   15    HB3  GLU   2           HB3      GLU   2   6.643  10.106  -7.945
   16    HG2  GLU   2           HG2      GLU   2   8.793  10.998  -8.531
   17    HG3  GLU   2           HG3      GLU   2   8.119  11.788  -9.956
   18    H    ASN   3           H        ASN   3   6.840   6.844 -10.470
   19    HA   ASN   3           HA       ASN   3   4.351   6.183  -9.362
   20    HB2  ASN   3           HB2      ASN   3   3.482   7.663 -11.145
   21    HB3  ASN   3           HB3      ASN   3   4.267   6.650 -12.352
   22   HD21  ASN   3          HD21      ASN   3   3.232   4.908 -13.090
   23   HD22  ASN   3          HD22      ASN   3   1.726   4.319 -12.482
   24    H    ASP   4           H        ASP   4   4.247   4.026  -9.178
   25    HA   ASP   4           HA       ASP   4   5.316   2.266 -11.188
   26    HB2  ASP   4           HB2      ASP   4   6.818   2.867  -8.701
   27    HB3  ASP   4           HB3      ASP   4   6.716   1.171  -9.165
   28    HA   PRO   5           HA       PRO   5   2.289  -0.454  -9.502
   29    HB2  PRO   5           HB2      PRO   5   3.361  -2.898  -9.981
   30    HB3  PRO   5           HB3      PRO   5   2.718  -1.867 -11.265
   31    HG2  PRO   5           HG2      PRO   5   5.558  -2.277 -10.409
   32    HG3  PRO   5           HG3      PRO   5   4.884  -2.191 -12.047
   33    HD2  PRO   5           HD2      PRO   5   6.136  -0.096 -10.871
   34    HD3  PRO   5           HD3      PRO   5   4.809   0.112 -12.031
   35    H    THR   6           H        THR   6   5.553  -0.637  -8.320
   36    HA   THR   6           HA       THR   6   4.814  -2.315  -6.060
   37    HB   THR   6           HB       THR   6   7.167  -2.279  -5.487
   38    HG1  THR   6           HG1      THR   6   7.884  -0.286  -5.921
   39   HG21  THR   6          HG21      THR   6   6.905  -2.546  -8.471
   40   HG22  THR   6          HG22      THR   6   6.552  -3.810  -7.292
   41   HG23  THR   6          HG23      THR   6   8.198  -3.201  -7.466
   42    H    VAL   7           H        VAL   7   3.380   0.029  -6.056
   43    HA   VAL   7           HA       VAL   7   4.386   1.298  -3.636
   44    HB   VAL   7           HB       VAL   7   4.046   3.521  -4.371
   45   HG11  VAL   7          HG11      VAL   7   5.909   3.735  -5.642
   46   HG12  VAL   7          HG12      VAL   7   5.373   2.540  -6.823
   47   HG13  VAL   7          HG13      VAL   7   6.069   2.016  -5.290
   48   HG21  VAL   7          HG21      VAL   7   3.482   3.460  -7.067
   49   HG22  VAL   7          HG22      VAL   7   2.354   3.850  -5.768
   50   HG23  VAL   7          HG23      VAL   7   2.450   2.204  -6.386
   51    H    LEU   8           H        LEU   8   2.551   3.072  -3.016
   52    HA   LEU   8           HA       LEU   8  -0.107   1.997  -3.498
   53    HB2  LEU   8           HB2      LEU   8   1.293   1.114  -1.300
   54    HB3  LEU   8           HB3      LEU   8   0.358   2.443  -0.642
   55    HG   LEU   8           HG       LEU   8  -0.889   0.432  -0.315
   56   HD11  LEU   8          HD11      LEU   8  -2.920   1.118  -1.122
   57   HD12  LEU   8          HD12      LEU   8  -2.271   1.552  -2.703
   58   HD13  LEU   8          HD13      LEU   8  -1.979   2.597  -1.314
   59   HD21  LEU   8          HD21      LEU   8  -1.145  -0.172  -3.203
   60   HD22  LEU   8          HD22      LEU   8  -1.144  -1.255  -1.812
   61   HD23  LEU   8          HD23      LEU   8   0.376  -0.599  -2.420
   62    H    ARG   9           H        ARG   9  -1.734   3.485  -3.219
   63    HA   ARG   9           HA       ARG   9  -1.157   6.045  -1.975
   64    HB2  ARG   9           HB2      ARG   9  -2.127   5.999  -4.828
   65    HB3  ARG   9           HB3      ARG   9  -1.597   7.387  -3.888
   66    HG2  ARG   9           HG2      ARG   9   0.689   6.373  -3.841
   67    HG3  ARG   9           HG3      ARG   9   0.102   5.157  -4.976
   68    HD2  ARG   9           HD2      ARG   9  -0.447   6.897  -6.584
   69    HD3  ARG   9           HD3      ARG   9   0.072   8.137  -5.443
   70    HE   ARG   9           HE       ARG   9   2.113   6.210  -6.047
   71   HH11  ARG   9          HH11      ARG   9   0.602   9.182  -7.076
   72   HH12  ARG   9          HH12      ARG   9   1.990   9.730  -7.954
   73   HH21  ARG   9          HH21      ARG   9   3.940   6.929  -7.202
   74   HH22  ARG   9          HH22      ARG   9   3.885   8.451  -8.026
   75    H    SER  10           H        SER  10  -2.971   7.123  -1.279
   76    HA   SER  10           HA       SER  10  -5.322   5.578  -0.926
   77    HB2  SER  10           HB2      SER  10  -4.417   8.305  -0.166
   78    HB3  SER  10           HB3      SER  10  -6.157   8.018  -0.184
   79    HG   SER  10           HG       SER  10  -5.252   7.533   1.850
   80    HA   PRO  11           HA       PRO  11  -7.591   6.655  -4.564
   81    HB2  PRO  11           HB2      PRO  11 -10.119   6.234  -3.706
   82    HB3  PRO  11           HB3      PRO  11  -8.989   4.910  -4.008
   83    HG2  PRO  11           HG2      PRO  11  -9.753   6.192  -1.413
   84    HG3  PRO  11           HG3      PRO  11  -9.549   4.472  -1.793
   85    HD2  PRO  11           HD2      PRO  11  -7.644   5.939  -0.528
   86    HD3  PRO  11           HD3      PRO  11  -7.260   4.569  -1.590
   87    H    SER  12           H        SER  12  -8.288   8.224  -1.516
   88    HA   SER  12           HA       SER  12  -8.836  10.707  -2.902
   89    HB2  SER  12           HB2      SER  12 -10.878   9.576  -0.974
   90    HB3  SER  12           HB3      SER  12 -10.973  11.120  -1.821
   91    HG   SER  12           HG       SER  12 -12.179   9.679  -2.983
   92    H    ALA  13           H        ALA  13  -9.425  12.433  -1.093
   93    HA   ALA  13           HA       ALA  13  -7.173  12.454   0.679
   94    HB1  ALA  13           HB1      ALA  13  -7.902  14.673   1.292
   95    HB2  ALA  13           HB2      ALA  13  -9.465  14.406   0.520
   96    HB3  ALA  13           HB3      ALA  13  -8.000  14.483  -0.459
   97    H    GLY  14           H        GLY  14  -7.124  11.465   2.582
   98    HA2  GLY  14           HA2      GLY  14  -9.537  11.543   4.265
   99    HA3  GLY  14           HA3      GLY  14  -8.728  10.009   3.988
  100    H    LYS  15           H        LYS  15  -7.872   9.497   5.910
  101    HA   LYS  15           HA       LYS  15  -5.668  11.038   6.898
  102    HB2  LYS  15           HB2      LYS  15  -7.777  12.130   7.866
  103    HB3  LYS  15           HB3      LYS  15  -7.952  10.667   8.826
  104    HG2  LYS  15           HG2      LYS  15  -5.305  11.958   8.918
  105    HG3  LYS  15           HG3      LYS  15  -6.636  12.852   9.657
  106    HD2  LYS  15           HD2      LYS  15  -6.198   9.949  10.267
  107    HD3  LYS  15           HD3      LYS  15  -5.290  11.202  11.116
  108    HE2  LYS  15           HE2      LYS  15  -7.162  12.034  12.167
  109    HE3  LYS  15           HE3      LYS  15  -8.257  11.434  10.921
  110    HZ1  LYS  15           HZ1      LYS  15  -8.481  10.181  12.972
  111    HZ2  LYS  15           HZ2      LYS  15  -6.843   9.764  12.930
  112    HZ3  LYS  15           HZ3      LYS  15  -7.892   9.188  11.735
  113    H    LEU  16           H        LEU  16  -4.263   9.796   8.052
  114    HA   LEU  16           HA       LEU  16  -4.589   6.981   7.975
  115    HB2  LEU  16           HB2      LEU  16  -2.429   8.436   7.964
  116    HB3  LEU  16           HB3      LEU  16  -2.572   8.362   9.708
  117    HG   LEU  16           HG       LEU  16  -2.348   5.962   9.692
  118   HD11  LEU  16          HD11      LEU  16  -1.830   4.828   7.486
  119   HD12  LEU  16          HD12      LEU  16  -2.482   6.268   6.705
  120   HD13  LEU  16          HD13      LEU  16  -3.510   5.292   7.755
  121   HD21  LEU  16          HD21      LEU  16  -0.109   5.946   9.399
  122   HD22  LEU  16          HD22      LEU  16  -0.347   7.682   9.202
  123   HD23  LEU  16          HD23      LEU  16  -0.204   6.645   7.783
  124    H    THR  17           H        THR  17  -6.249   6.195   9.184
  125    HA   THR  17           HA       THR  17  -6.776   7.104  11.849
  126    HB   THR  17           HB       THR  17  -8.589   6.302  10.420
  127    HG1  THR  17           HG1      THR  17  -9.393   5.871  12.299
  128   HG21  THR  17          HG21      THR  17  -7.748   3.475  10.768
  129   HG22  THR  17          HG22      THR  17  -7.080   4.413   9.433
  130   HG23  THR  17          HG23      THR  17  -8.824   4.198   9.573
  131    H    GLN  18           H        GLN  18  -5.455   4.089  10.474
  132    HA   GLN  18           HA       GLN  18  -3.707   3.722  12.691
  133    HB2  GLN  18           HB2      GLN  18  -4.667   1.780  13.698
  134    HB3  GLN  18           HB3      GLN  18  -5.917   3.014  13.653
  135    HG2  GLN  18           HG2      GLN  18  -6.821   1.935  11.605
  136    HG3  GLN  18           HG3      GLN  18  -5.645   0.641  11.824
  137   HE21  GLN  18          HE21      GLN  18  -8.355   2.294  13.349
  138   HE22  GLN  18          HE22      GLN  18  -8.884   0.946  14.291
  139    H    TYR  19           H        TYR  19  -3.396   0.913  12.496
  140    HA   TYR  19           HA       TYR  19  -2.964   0.312   9.689
  141    HB2  TYR  19           HB2      TYR  19  -0.551  -0.253  10.117
  142    HB3  TYR  19           HB3      TYR  19  -0.919   1.468  10.155
  143    HD1  TYR  19           HD1      TYR  19  -0.424  -1.482  12.369
  144    HD2  TYR  19           HD2      TYR  19  -0.322   2.756  12.011
  145    HE1  TYR  19           HE1      TYR  19   0.591  -1.323  14.603
  146    HE2  TYR  19           HE2      TYR  19   0.694   2.927  14.244
  147    HH   TYR  19           HH       TYR  19   0.589   1.086  16.459
  148    H    THR  20           H        THR  20  -2.917  -1.855   9.256
  149    HA   THR  20           HA       THR  20  -3.587  -3.606  11.493
  150    HB   THR  20           HB       THR  20  -4.491  -5.109   9.894
  151    HG1  THR  20           HG1      THR  20  -3.808  -5.239   7.906
  152   HG21  THR  20          HG21      THR  20  -5.831  -3.598   8.329
  153   HG22  THR  20          HG22      THR  20  -5.053  -2.261   9.177
  154   HG23  THR  20          HG23      THR  20  -6.058  -3.405  10.067
  155    H    VAL  21           H        VAL  21  -0.848  -2.758   9.767
  156    HA   VAL  21           HA       VAL  21   0.575  -5.076  10.786
  157    HB   VAL  21           HB       VAL  21   1.721  -5.511   8.651
  158   HG11  VAL  21          HG11      VAL  21  -0.067  -6.752   7.597
  159   HG12  VAL  21          HG12      VAL  21  -1.275  -5.772   8.429
  160   HG13  VAL  21          HG13      VAL  21  -0.228  -6.851   9.351
  161   HG21  VAL  21          HG21      VAL  21   1.388  -3.321   7.614
  162   HG22  VAL  21          HG22      VAL  21  -0.340  -3.648   7.473
  163   HG23  VAL  21          HG23      VAL  21   0.819  -4.619   6.564
  164    H    GLU  22           H        GLU  22   2.777  -4.731  11.098
  165    HA   GLU  22           HA       GLU  22   3.552  -2.039  11.532
  166    HB2  GLU  22           HB2      GLU  22   5.709  -2.969  12.201
  167    HB3  GLU  22           HB3      GLU  22   4.389  -3.889  12.909
  168    HG2  GLU  22           HG2      GLU  22   5.343  -5.720  12.121
  169    HG3  GLU  22           HG3      GLU  22   4.937  -5.165  10.497
  170    H    ASP  23           H        ASP  23   5.980  -1.523  10.746
  171    HA   ASP  23           HA       ASP  23   5.769  -0.812   8.049
  172    HB2  ASP  23           HB2      ASP  23   8.186  -0.229   8.229
  173    HB3  ASP  23           HB3      ASP  23   7.213   0.425   9.543
  174    H    GLY  24           H        GLY  24   5.962  -1.993   6.270
  175    HA2  GLY  24           HA2      GLY  24   6.863  -3.512   4.771
  176    HA3  GLY  24           HA3      GLY  24   8.043  -3.964   5.991
  177    H    GLY  25           H        GLY  25   4.605  -4.007   6.621
  178    HA2  GLY  25           HA2      GLY  25   4.677  -6.712   7.481
  179    HA3  GLY  25           HA3      GLY  25   3.233  -5.733   7.272
  180    H    HIS  26           H        HIS  26   4.847  -8.423   6.200
  181    HA   HIS  26           HA       HIS  26   4.352  -8.424   3.437
  182    HB2  HIS  26           HB2      HIS  26   4.559 -10.886   3.606
  183    HB3  HIS  26           HB3      HIS  26   5.850 -10.044   4.455
  184    HD1  HIS  26           HD1      HIS  26   3.003 -12.354   4.979
  185    HD2  HIS  26           HD2      HIS  26   5.716 -10.219   7.291
  186    HE1  HIS  26           HE1      HIS  26   2.824 -13.324   7.292
  187    HE2  HIS  26           HE2      HIS  26   4.536 -12.073   8.654
  188    H    VAL  27           H        VAL  27   2.501  -8.428   2.361
  189    HA   VAL  27           HA       VAL  27   0.213  -9.911   3.406
  190    HB   VAL  27           HB       VAL  27  -1.334  -8.037   2.959
  191   HG11  VAL  27          HG11      VAL  27  -0.449  -8.509   5.232
  192   HG12  VAL  27          HG12      VAL  27  -0.902  -6.822   4.986
  193   HG13  VAL  27          HG13      VAL  27   0.798  -7.292   4.956
  194   HG21  VAL  27          HG21      VAL  27  -0.515  -6.451   1.594
  195   HG22  VAL  27          HG22      VAL  27   1.155  -6.772   2.058
  196   HG23  VAL  27          HG23      VAL  27   0.138  -5.752   3.076
  197    H    GLU  28           H        GLU  28  -1.018 -10.831   1.842
  198    HA   GLU  28           HA       GLU  28  -0.039 -10.661  -0.875
  199    HB2  GLU  28           HB2      GLU  28  -1.429 -12.557  -1.331
  200    HB3  GLU  28           HB3      GLU  28  -0.642 -12.831   0.217
  201    HG2  GLU  28           HG2      GLU  28  -3.099 -11.533   0.735
  202    HG3  GLU  28           HG3      GLU  28  -3.414 -12.836  -0.409
  203    H    ALA  29           H        ALA  29  -1.562 -10.463  -2.704
  204    HA   ALA  29           HA       ALA  29  -2.856  -8.052  -2.797
  205    HB1  ALA  29           HB1      ALA  29  -2.281  -9.861  -4.645
  206    HB2  ALA  29           HB2      ALA  29  -3.487  -8.602  -4.915
  207    HB3  ALA  29           HB3      ALA  29  -3.996 -10.229  -4.460
  208    H    GLY  30           H        GLY  30  -4.739  -7.242  -2.110
  209    HA2  GLY  30           HA2      GLY  30  -7.062  -7.306  -1.669
  210    HA3  GLY  30           HA3      GLY  30  -6.963  -9.054  -1.530
  211    H    SER  31           H        SER  31  -4.558  -8.762   0.251
  212    HA   SER  31           HA       SER  31  -5.980  -8.749   2.720
  213    HB2  SER  31           HB2      SER  31  -3.027  -8.875   2.085
  214    HB3  SER  31           HB3      SER  31  -3.676  -8.998   3.720
  215    HG   SER  31           HG       SER  31  -3.617 -11.059   3.120
  216    H    SER  32           H        SER  32  -6.344  -7.134   4.100
  217    HA   SER  32           HA       SER  32  -5.724  -4.457   3.418
  218    HB2  SER  32           HB2      SER  32  -6.512  -4.117   5.914
  219    HB3  SER  32           HB3      SER  32  -7.667  -4.595   4.670
  220    HG   SER  32           HG       SER  32  -7.798  -5.881   6.583
  221    H    TYR  33           H        TYR  33  -4.176  -3.081   4.136
  222    HA   TYR  33           HA       TYR  33  -2.112  -4.222   5.905
  223    HB2  TYR  33           HB2      TYR  33  -0.451  -2.925   4.704
  224    HB3  TYR  33           HB3      TYR  33  -1.361  -3.912   3.565
  225    HD1  TYR  33           HD2      TYR  33  -1.176  -0.469   4.966
  226    HD2  TYR  33           HD1      TYR  33  -2.360  -2.925   1.701
  227    HE1  TYR  33           HE2      TYR  33  -1.684   1.543   3.646
  228    HE2  TYR  33           HE1      TYR  33  -2.870  -0.920   0.371
  229    HH   TYR  33           HH       TYR  33  -1.867   2.180   1.258
  230    H    ALA  34           H        ALA  34  -4.368  -1.703   5.482
  231    HA   ALA  34           HA       ALA  34  -3.827  -0.574   8.016
  232    HB1  ALA  34           HB1      ALA  34  -3.132   1.262   5.735
  233    HB2  ALA  34           HB2      ALA  34  -1.924   0.363   6.653
  234    HB3  ALA  34           HB3      ALA  34  -2.942   1.553   7.464
  235    H    GLU  35           H        GLU  35  -4.919   1.891   7.846
  236    HA   GLU  35           HA       GLU  35  -7.384   1.698   6.296
  237    HB2  GLU  35           HB2      GLU  35  -7.295   1.888   9.310
  238    HB3  GLU  35           HB3      GLU  35  -8.725   2.254   8.356
  239    HG2  GLU  35           HG2      GLU  35  -9.094   0.063   7.811
  240    HG3  GLU  35           HG3      GLU  35  -7.399  -0.383   7.992
  241    H    MET  36           H        MET  36  -8.726   3.731   6.603
  242    HA   MET  36           HA       MET  36  -7.250   6.075   7.443
  243    HB2  MET  36           HB2      MET  36  -7.352   7.211   5.308
  244    HB3  MET  36           HB3      MET  36  -6.472   5.700   5.124
  245    HG2  MET  36           HG2      MET  36  -8.706   4.718   4.351
  246    HG3  MET  36           HG3      MET  36  -9.228   6.393   4.183
  247    HE1  MET  36           HE1      MET  36  -8.563   7.174   0.877
  248    HE2  MET  36           HE2      MET  36  -9.692   6.846   2.191
  249    HE3  MET  36           HE3      MET  36  -9.352   5.601   0.990
  250    H    GLU  37           H        GLU  37  -8.631   7.346   8.473
  251    HA   GLU  37           HA       GLU  37 -11.487   6.974   8.083
  252    HB2  GLU  37           HB2      GLU  37 -10.430   7.092  10.363
  253    HB3  GLU  37           HB3      GLU  37 -10.091   8.789  10.052
  254    HG2  GLU  37           HG2      GLU  37 -12.536   9.143   9.728
  255    HG3  GLU  37           HG3      GLU  37 -12.789   7.478  10.250
  256    H    VAL  38           H        VAL  38 -12.228   8.013   6.331
  257    HA   VAL  38           HA       VAL  38 -11.319  10.719   5.733
  258    HB   VAL  38           HB       VAL  38 -11.520   9.081   3.893
  259   HG11  VAL  38          HG11      VAL  38 -14.404   9.071   4.718
  260   HG12  VAL  38          HG12      VAL  38 -13.314   7.702   4.503
  261   HG13  VAL  38          HG13      VAL  38 -13.892   8.599   3.099
  262   HG21  VAL  38          HG21      VAL  38 -13.599  11.192   3.442
  263   HG22  VAL  38          HG22      VAL  38 -12.387  10.566   2.323
  264   HG23  VAL  38          HG23      VAL  38 -11.899  11.612   3.656
  265    H    MET  39           H        MET  39 -13.047  12.345   5.113
  266    HA   MET  39           HA       MET  39 -14.670  12.916   7.288
  267    HB2  MET  39           HB2      MET  39 -15.249  13.875   4.491
  268    HB3  MET  39           HB3      MET  39 -15.573  14.704   6.008
  269    HG2  MET  39           HG2      MET  39 -12.914  14.455   6.199
  270    HG3  MET  39           HG3      MET  39 -13.082  14.504   4.445
  271    HE1  MET  39           HE1      MET  39 -13.972  17.983   3.555
  272    HE2  MET  39           HE2      MET  39 -14.171  16.282   3.133
  273    HE3  MET  39           HE3      MET  39 -12.558  16.941   3.404
  274    H    LYS  40           H        LYS  40 -15.276  10.848   4.585
  275    HA   LYS  40           HA       LYS  40 -18.134  10.833   4.860
  276    HB2  LYS  40           HB2      LYS  40 -16.192   9.090   3.350
  277    HB3  LYS  40           HB3      LYS  40 -17.921   8.774   3.369
  278    HG2  LYS  40           HG2      LYS  40 -16.921  11.473   2.584
  279    HG3  LYS  40           HG3      LYS  40 -16.863  10.139   1.429
  280    HD2  LYS  40           HD2      LYS  40 -19.228   9.830   1.557
  281    HD3  LYS  40           HD3      LYS  40 -19.357  10.953   2.913
  282    HE2  LYS  40           HE2      LYS  40 -18.334  11.778   0.208
  283    HE3  LYS  40           HE3      LYS  40 -20.043  11.836   0.636
  284    HZ1  LYS  40           HZ1      LYS  40 -19.593  13.397   2.349
  285    HZ2  LYS  40           HZ2      LYS  40 -18.816  13.960   0.956
  286    HZ3  LYS  40           HZ3      LYS  40 -17.919  13.215   2.182
  287    H    MET  41           H        MET  41 -15.973   8.027   5.072
  288    HA   MET  41           HA       MET  41 -16.920   7.372   7.727
  289    HB2  MET  41           HB2      MET  41 -17.913   6.029   5.293
  290    HB3  MET  41           HB3      MET  41 -17.382   4.952   6.577
  291    HG2  MET  41           HG2      MET  41 -19.442   7.129   6.837
  292    HG3  MET  41           HG3      MET  41 -19.764   5.400   6.721
  293    HE1  MET  41           HE1      MET  41 -19.487   3.720   8.481
  294    HE2  MET  41           HE2      MET  41 -20.884   4.667   8.992
  295    HE3  MET  41           HE3      MET  41 -19.678   4.166  10.177
  296    H    ILE  42           H        ILE  42 -15.990   5.064   8.303
  297    HA   ILE  42           HA       ILE  42 -13.144   5.248   7.830
  298    HB   ILE  42           HB       ILE  42 -13.971   4.745  10.080
  299   HG12  ILE  42          HG12      ILE  42 -12.496   2.855  10.574
  300   HG13  ILE  42          HG13      ILE  42 -12.478   2.404   8.872
  301   HG21  ILE  42          HG21      ILE  42 -15.812   3.159   8.853
  302   HG22  ILE  42          HG22      ILE  42 -15.451   3.139  10.579
  303   HG23  ILE  42          HG23      ILE  42 -14.690   1.965   9.506
  304   HD11  ILE  42          HD11      ILE  42 -11.679   5.138   9.166
  305   HD12  ILE  42          HD12      ILE  42 -10.790   3.775   8.485
  306   HD13  ILE  42          HD13      ILE  42 -10.713   4.102  10.216
  307    H    MET  43           H        MET  43 -11.853   3.732   6.810
  308    HA   MET  43           HA       MET  43 -13.122   1.425   5.556
  309    HB2  MET  43           HB2      MET  43 -11.751   3.642   4.038
  310    HB3  MET  43           HB3      MET  43 -11.994   2.037   3.363
  311    HG2  MET  43           HG2      MET  43 -14.480   2.430   3.965
  312    HG3  MET  43           HG3      MET  43 -14.014   4.129   4.035
  313    HE1  MET  43           HE1      MET  43 -16.244   3.766   1.714
  314    HE2  MET  43           HE2      MET  43 -15.944   2.135   2.313
  315    HE3  MET  43           HE3      MET  43 -15.797   2.483   0.590
  316    H    THR  44           H        THR  44 -11.408   0.106   4.335
  317    HA   THR  44           HA       THR  44  -8.883   0.180   5.855
  318    HB   THR  44           HB       THR  44  -9.612  -2.431   4.755
  319    HG1  THR  44           HG1      THR  44 -11.697  -1.754   5.305
  320   HG21  THR  44          HG21      THR  44  -8.725  -3.273   6.669
  321   HG22  THR  44          HG22      THR  44  -9.281  -1.922   7.657
  322   HG23  THR  44          HG23      THR  44  -7.884  -1.725   6.600
  323    H    LEU  45           H        LEU  45  -7.020   0.105   4.735
  324    HA   LEU  45           HA       LEU  45  -7.209   0.156   1.825
  325    HB2  LEU  45           HB2      LEU  45  -5.007   0.863   3.755
  326    HB3  LEU  45           HB3      LEU  45  -4.766   0.823   2.019
  327    HG   LEU  45           HG       LEU  45  -7.048   2.459   2.908
  328   HD11  LEU  45          HD11      LEU  45  -5.885   3.390   4.604
  329   HD12  LEU  45          HD12      LEU  45  -5.137   4.302   3.292
  330   HD13  LEU  45          HD13      LEU  45  -4.324   2.885   3.957
  331   HD21  LEU  45          HD21      LEU  45  -6.251   2.302   0.574
  332   HD22  LEU  45          HD22      LEU  45  -4.722   3.025   1.075
  333   HD23  LEU  45          HD23      LEU  45  -6.218   3.949   1.202
  334    H    ASN  46           H        ASN  46  -6.256  -1.306   0.479
  335    HA   ASN  46           HA       ASN  46  -4.788  -3.534   1.715
  336    HB2  ASN  46           HB2      ASN  46  -5.969  -5.117   0.250
  337    HB3  ASN  46           HB3      ASN  46  -7.089  -4.273   1.315
  338   HD21  ASN  46          HD21      ASN  46  -8.340  -2.542   0.427
  339   HD22  ASN  46          HD22      ASN  46  -8.733  -2.534  -1.256
  340    H    VAL  47           H        VAL  47  -3.629  -4.873   0.036
  341    HA   VAL  47           HA       VAL  47  -2.268  -3.054  -1.793
  342    HB   VAL  47           HB       VAL  47  -0.640  -4.918  -2.066
  343   HG11  VAL  47          HG11      VAL  47  -1.049  -4.364   0.856
  344   HG12  VAL  47          HG12      VAL  47  -0.547  -3.100  -0.267
  345   HG13  VAL  47          HG13      VAL  47   0.462  -4.528  -0.038
  346   HG21  VAL  47          HG21      VAL  47  -2.472  -6.642  -1.428
  347   HG22  VAL  47          HG22      VAL  47  -1.969  -6.305   0.228
  348   HG23  VAL  47          HG23      VAL  47  -0.803  -6.933  -0.937
  349    H    GLN  48           H        GLN  48  -1.835  -3.632  -3.991
  350    HA   GLN  48           HA       GLN  48  -4.098  -4.936  -5.241
  351    HB2  GLN  48           HB2      GLN  48  -3.304  -4.026  -7.302
  352    HB3  GLN  48           HB3      GLN  48  -3.141  -2.775  -6.079
  353    HG2  GLN  48           HG2      GLN  48  -0.819  -4.537  -6.727
  354    HG3  GLN  48           HG3      GLN  48  -1.231  -3.187  -7.781
  355   HE21  GLN  48          HE21      GLN  48   0.341  -4.155  -4.959
  356   HE22  GLN  48          HE22      GLN  48   0.740  -2.589  -4.347
  357    H    GLU  49           H        GLU  49  -0.868  -5.728  -4.384
  358    HA   GLU  49           HA       GLU  49  -1.205  -8.384  -5.482
  359    HB2  GLU  49           HB2      GLU  49   1.069  -6.596  -6.359
  360    HB3  GLU  49           HB3      GLU  49   1.014  -8.332  -6.628
  361    HG2  GLU  49           HG2      GLU  49  -1.017  -8.052  -7.968
  362    HG3  GLU  49           HG3      GLU  49  -0.933  -6.310  -7.714
  363    H    ARG  50           H        ARG  50   0.973  -9.650  -5.012
  364    HA   ARG  50           HA       ARG  50   1.289  -9.617  -2.193
  365    HB2  ARG  50           HB2      ARG  50   2.670 -11.116  -4.409
  366    HB3  ARG  50           HB3      ARG  50   3.148 -11.304  -2.728
  367    HG2  ARG  50           HG2      ARG  50   1.684 -13.068  -3.094
  368    HG3  ARG  50           HG3      ARG  50   0.685 -11.856  -2.290
  369    HD2  ARG  50           HD2      ARG  50  -0.478 -12.873  -4.191
  370    HD3  ARG  50           HD3      ARG  50  -0.215 -11.146  -4.433
  371    HE   ARG  50           HE       ARG  50   1.140 -11.632  -6.216
  372   HH11  ARG  50          HH11      ARG  50   0.604 -14.544  -4.368
  373   HH12  ARG  50          HH12      ARG  50   1.342 -15.577  -5.546
  374   HH21  ARG  50          HH21      ARG  50   2.112 -12.989  -7.766
  375   HH22  ARG  50          HH22      ARG  50   2.199 -14.694  -7.474
  376    H    GLY  51           H        GLY  51   3.062  -9.062  -0.927
  377    HA2  GLY  51           HA2      GLY  51   5.577  -8.356  -1.470
  378    HA3  GLY  51           HA3      GLY  51   4.710  -6.940  -2.046
  379    H    ARG  52           H        ARG  52   6.474  -6.436  -0.157
  380    HA   ARG  52           HA       ARG  52   5.146  -6.520   2.442
  381    HB2  ARG  52           HB2      ARG  52   7.922  -6.092   1.499
  382    HB3  ARG  52           HB3      ARG  52   7.448  -5.206   2.941
  383    HG2  ARG  52           HG2      ARG  52   7.981  -7.030   4.086
  384    HG3  ARG  52           HG3      ARG  52   6.522  -7.764   3.417
  385    HD2  ARG  52           HD2      ARG  52   8.093  -9.322   2.814
  386    HD3  ARG  52           HD3      ARG  52   8.094  -8.289   1.385
  387    HE   ARG  52           HE       ARG  52  10.027  -7.198   2.923
  388   HH11  ARG  52          HH11      ARG  52   9.414 -10.458   1.839
  389   HH12  ARG  52          HH12      ARG  52  11.088 -10.899   1.817
  390   HH21  ARG  52          HH21      ARG  52  12.229  -7.776   2.894
  391   HH22  ARG  52          HH22      ARG  52  12.687  -9.376   2.416
  392    H    VAL  53           H        VAL  53   3.972  -4.878   3.162
  393    HA   VAL  53           HA       VAL  53   3.864  -2.405   1.679
  394    HB   VAL  53           HB       VAL  53   2.412  -3.086   4.236
  395   HG11  VAL  53          HG11      VAL  53   2.297  -0.756   3.819
  396   HG12  VAL  53          HG12      VAL  53   0.759  -1.436   3.287
  397   HG13  VAL  53          HG13      VAL  53   1.992  -1.008   2.100
  398   HG21  VAL  53          HG21      VAL  53   1.678  -3.644   1.370
  399   HG22  VAL  53          HG22      VAL  53   0.511  -3.657   2.692
  400   HG23  VAL  53          HG23      VAL  53   1.853  -4.802   2.689
  401    H    LYS  54           H        LYS  54   5.246  -0.808   2.031
  402    HA   LYS  54           HA       LYS  54   6.286  -0.409   4.751
  403    HB2  LYS  54           HB2      LYS  54   7.977   1.024   3.160
  404    HB3  LYS  54           HB3      LYS  54   8.271  -0.616   3.716
  405    HG2  LYS  54           HG2      LYS  54   7.464  -1.527   1.662
  406    HG3  LYS  54           HG3      LYS  54   6.927   0.061   1.114
  407    HD2  LYS  54           HD2      LYS  54   9.786  -0.746   1.649
  408    HD3  LYS  54           HD3      LYS  54   9.041  -0.594   0.056
  409    HE2  LYS  54           HE2      LYS  54   8.519   1.812   0.715
  410    HE3  LYS  54           HE3      LYS  54   9.638   1.569   2.055
  411    HZ1  LYS  54           HZ1      LYS  54  10.729   2.575   0.145
  412    HZ2  LYS  54           HZ2      LYS  54  10.305   1.254  -0.822
  413    HZ3  LYS  54           HZ3      LYS  54  11.378   1.046   0.469
  414    H    TYR  55           H        TYR  55   5.122   1.142   5.698
  415    HA   TYR  55           HA       TYR  55   3.643   3.127   4.420
  416    HB2  TYR  55           HB2      TYR  55   4.815   3.215   7.207
  417    HB3  TYR  55           HB3      TYR  55   3.476   4.193   6.616
  418    HD1  TYR  55           HD2      TYR  55   1.792   2.319   5.207
  419    HD2  TYR  55           HD1      TYR  55   3.989   1.763   8.807
  420    HE1  TYR  55           HE2      TYR  55   0.206   0.573   5.898
  421    HE2  TYR  55           HE1      TYR  55   2.410   0.013   9.508
  422    HH   TYR  55           HH       TYR  55   0.812  -1.574   8.405
  423    H    ILE  56           H        ILE  56   4.008   5.223   3.861
  424    HA   ILE  56           HA       ILE  56   6.815   6.096   3.850
  425    HB   ILE  56           HB       ILE  56   4.519   6.605   1.996
  426   HG12  ILE  56          HG12      ILE  56   6.121   6.042   0.290
  427   HG13  ILE  56          HG13      ILE  56   7.451   6.124   1.441
  428   HG21  ILE  56          HG21      ILE  56   5.994   8.398   0.926
  429   HG22  ILE  56          HG22      ILE  56   6.821   8.470   2.482
  430   HG23  ILE  56          HG23      ILE  56   5.100   8.841   2.381
  431   HD11  ILE  56          HD11      ILE  56   6.647   4.162   2.571
  432   HD12  ILE  56          HD12      ILE  56   6.808   3.827   0.848
  433   HD13  ILE  56          HD13      ILE  56   5.214   4.117   1.545
  434    H    LYS  57           H        LYS  57   3.526   7.385   4.199
  435    HA   LYS  57           HA       LYS  57   4.385   9.865   5.304
  436    HB2  LYS  57           HB2      LYS  57   1.932   8.647   4.459
  437    HB3  LYS  57           HB3      LYS  57   1.701   9.364   6.048
  438    HG2  LYS  57           HG2      LYS  57   2.728  10.771   3.591
  439    HG3  LYS  57           HG3      LYS  57   1.122  10.939   4.303
  440    HD2  LYS  57           HD2      LYS  57   2.222  11.753   6.395
  441    HD3  LYS  57           HD3      LYS  57   3.758  11.747   5.525
  442    HE2  LYS  57           HE2      LYS  57   2.231  13.154   3.803
  443    HE3  LYS  57           HE3      LYS  57   1.470  13.597   5.331
  444    HZ1  LYS  57           HZ1      LYS  57   3.333  15.068   4.583
  445    HZ2  LYS  57           HZ2      LYS  57   4.392  13.782   4.872
  446    HZ3  LYS  57           HZ3      LYS  57   3.501  14.445   6.147
  447    H    ARG  58           H        ARG  58   3.404  10.573   7.492
  448    HA   ARG  58           HA       ARG  58   4.352   8.668   9.486
  449    HB2  ARG  58           HB2      ARG  58   3.977  11.611   9.372
  450    HB3  ARG  58           HB3      ARG  58   3.784  10.849  10.944
  451    HG2  ARG  58           HG2      ARG  58   6.062  11.671  10.576
  452    HG3  ARG  58           HG3      ARG  58   6.013   9.922  10.809
  453    HD2  ARG  58           HD2      ARG  58   7.523  10.467   9.000
  454    HD3  ARG  58           HD3      ARG  58   6.113   9.617   8.368
  455    HE   ARG  58           HE       ARG  58   5.549  12.312   8.160
  456   HH11  ARG  58          HH11      ARG  58   7.950  10.109   6.910
  457   HH12  ARG  58          HH12      ARG  58   8.188  11.002   5.446
  458   HH21  ARG  58          HH21      ARG  58   5.861  13.488   6.235
  459   HH22  ARG  58          HH22      ARG  58   7.003  12.921   5.062
  460    HA   PRO  59           HA       PRO  59   0.426   7.564  11.140
  461    HB2  PRO  59           HB2      PRO  59   0.762   7.840  13.837
  462    HB3  PRO  59           HB3      PRO  59   1.444   6.505  12.901
  463    HG2  PRO  59           HG2      PRO  59   2.757   9.025  13.842
  464    HG3  PRO  59           HG3      PRO  59   3.386   7.366  13.844
  465    HD2  PRO  59           HD2      PRO  59   4.103   9.167  11.970
  466    HD3  PRO  59           HD3      PRO  59   3.934   7.438  11.600
  467    H    GLY  60           H        GLY  60  -1.457   8.604  11.214
  468    HA2  GLY  60           HA2      GLY  60  -3.042  10.124  12.037
  469    HA3  GLY  60           HA3      GLY  60  -1.746  11.025  12.807
  470    H    ALA  61           H        ALA  61  -0.348  10.792  10.032
  471    HA   ALA  61           HA       ALA  61  -0.864  13.377   9.152
  472    HB1  ALA  61           HB1      ALA  61   1.171  12.300   8.534
  473    HB2  ALA  61           HB2      ALA  61   0.290  12.664   7.050
  474    HB3  ALA  61           HB3      ALA  61   0.303  11.019   7.687
  475    H    VAL  62           H        VAL  62  -2.135  14.267   7.571
  476    HA   VAL  62           HA       VAL  62  -4.547  12.843   6.915
  477    HB   VAL  62           HB       VAL  62  -3.688  15.556   5.907
  478   HG11  VAL  62          HG11      VAL  62  -6.454  14.429   6.301
  479   HG12  VAL  62          HG12      VAL  62  -5.593  14.418   4.762
  480   HG13  VAL  62          HG13      VAL  62  -6.015  15.951   5.526
  481   HG21  VAL  62          HG21      VAL  62  -3.574  15.570   8.322
  482   HG22  VAL  62          HG22      VAL  62  -5.176  14.840   8.431
  483   HG23  VAL  62          HG23      VAL  62  -4.993  16.474   7.792
  484    H    LEU  63           H        LEU  63  -4.849  11.618   5.178
  485    HA   LEU  63           HA       LEU  63  -2.869  11.559   3.075
  486    HB2  LEU  63           HB2      LEU  63  -5.373   9.958   3.574
  487    HB3  LEU  63           HB3      LEU  63  -4.354   9.728   2.166
  488    HG   LEU  63           HG       LEU  63  -3.774   8.043   3.742
  489   HD11  LEU  63          HD11      LEU  63  -1.677  10.193   3.976
  490   HD12  LEU  63          HD12      LEU  63  -1.909   9.177   2.553
  491   HD13  LEU  63          HD13      LEU  63  -1.438   8.449   4.089
  492   HD21  LEU  63          HD21      LEU  63  -3.641   8.289   5.984
  493   HD22  LEU  63          HD22      LEU  63  -4.660   9.693   5.663
  494   HD23  LEU  63          HD23      LEU  63  -2.921   9.895   5.875
  495    H    GLU  64           H        GLU  64  -3.156  12.114   0.945
  496    HA   GLU  64           HA       GLU  64  -5.605  13.636   0.334
  497    HB2  GLU  64           HB2      GLU  64  -2.918  14.083  -0.957
  498    HB3  GLU  64           HB3      GLU  64  -4.330  15.130  -1.005
  499    HG2  GLU  64           HG2      GLU  64  -3.936  15.118   1.623
  500    HG3  GLU  64           HG3      GLU  64  -2.283  14.793   1.102
  501    H    ALA  65           H        ALA  65  -6.416  13.532  -1.812
  502    HA   ALA  65           HA       ALA  65  -6.427  10.962  -2.937
  503    HB1  ALA  65           HB1      ALA  65  -7.202  13.456  -4.424
  504    HB2  ALA  65           HB2      ALA  65  -8.199  12.770  -3.141
  505    HB3  ALA  65           HB3      ALA  65  -7.859  11.828  -4.593
  506    H    GLY  66           H        GLY  66  -4.469  10.168  -3.568
  507    HA2  GLY  66           HA2      GLY  66  -3.264   9.920  -5.720
  508    HA3  GLY  66           HA3      GLY  66  -3.085  11.668  -5.707
  509    H    CYS  67           H        CYS  67  -2.587  11.556  -2.735
  510    HA   CYS  67           HA       CYS  67   0.231  11.504  -2.848
  511    HB2  CYS  67           HB2      CYS  67  -1.124  12.841  -1.226
  512    HB3  CYS  67           HB3      CYS  67  -1.507  11.347  -0.378
  513    HG   CYS  67           HG       CYS  67   0.645  11.474   0.778
  514    H    VAL  68           H        VAL  68   1.724  10.067  -1.931
  515    HA   VAL  68           HA       VAL  68   0.926   7.298  -2.065
  516    HB   VAL  68           HB       VAL  68   3.636   8.405  -1.330
  517   HG11  VAL  68          HG11      VAL  68   4.489   6.262  -1.940
  518   HG12  VAL  68          HG12      VAL  68   2.916   5.746  -2.549
  519   HG13  VAL  68          HG13      VAL  68   3.152   6.001  -0.820
  520   HG21  VAL  68          HG21      VAL  68   3.554   9.283  -3.407
  521   HG22  VAL  68          HG22      VAL  68   2.246   8.217  -3.922
  522   HG23  VAL  68          HG23      VAL  68   3.908   7.626  -3.896
  523    H    VAL  69           H        VAL  69  -0.128   6.496  -0.359
  524    HA   VAL  69           HA       VAL  69   0.429   7.380   2.331
  525    HB   VAL  69           HB       VAL  69  -1.346   5.083   1.514
  526   HG11  VAL  69          HG11      VAL  69  -0.802   6.551   4.006
  527   HG12  VAL  69          HG12      VAL  69  -1.363   4.898   3.759
  528   HG13  VAL  69          HG13      VAL  69  -2.504   6.240   3.663
  529   HG21  VAL  69          HG21      VAL  69  -1.646   7.802   0.804
  530   HG22  VAL  69          HG22      VAL  69  -2.826   7.462   2.069
  531   HG23  VAL  69          HG23      VAL  69  -2.803   6.487   0.600
  532    H    ALA  70           H        ALA  70   1.487   4.839   0.260
  533    HA   ALA  70           HA       ALA  70   3.349   3.902   2.211
  534    HB1  ALA  70           HB1      ALA  70   1.032   2.777   2.693
  535    HB2  ALA  70           HB2      ALA  70   2.520   1.834   2.768
  536    HB3  ALA  70           HB3      ALA  70   1.489   1.743   1.340
  537    H    ARG  71           H        ARG  71   3.951   1.416   1.179
  538    HA   ARG  71           HA       ARG  71   4.342   1.780  -1.696
  539    HB2  ARG  71           HB2      ARG  71   6.449   1.849   0.377
  540    HB3  ARG  71           HB3      ARG  71   6.795   0.841  -1.022
  541    HG2  ARG  71           HG2      ARG  71   5.964   3.727  -1.201
  542    HG3  ARG  71           HG3      ARG  71   7.641   3.178  -1.181
  543    HD2  ARG  71           HD2      ARG  71   6.258   1.648  -3.123
  544    HD3  ARG  71           HD3      ARG  71   5.838   3.340  -3.380
  545    HE   ARG  71           HE       ARG  71   8.295   2.115  -4.008
  546   HH11  ARG  71          HH11      ARG  71   7.014   5.066  -2.655
  547   HH12  ARG  71          HH12      ARG  71   8.360   6.030  -3.162
  548   HH21  ARG  71          HH21      ARG  71  10.066   3.381  -4.676
  549   HH22  ARG  71          HH22      ARG  71  10.092   5.074  -4.310
  550    H    LEU  72           H        LEU  72   5.823  -0.304  -2.375
  551    HA   LEU  72           HA       LEU  72   4.821  -2.676  -0.997
  552    HB2  LEU  72           HB2      LEU  72   3.770  -1.683  -3.466
  553    HB3  LEU  72           HB3      LEU  72   4.593  -3.200  -3.774
  554    HG   LEU  72           HG       LEU  72   2.181  -3.479  -3.323
  555   HD11  LEU  72          HD11      LEU  72   3.841  -4.692  -1.126
  556   HD12  LEU  72          HD12      LEU  72   3.898  -5.234  -2.804
  557   HD13  LEU  72          HD13      LEU  72   2.396  -5.358  -1.887
  558   HD21  LEU  72          HD21      LEU  72   2.309  -1.547  -1.558
  559   HD22  LEU  72          HD22      LEU  72   2.660  -2.870  -0.446
  560   HD23  LEU  72          HD23      LEU  72   1.155  -2.866  -1.364
  561    H    GLU  73           H        GLU  73   5.906  -4.657  -1.671
  562    HA   GLU  73           HA       GLU  73   8.409  -4.289  -3.134
  563    HB2  GLU  73           HB2      GLU  73   8.974  -3.905  -0.776
  564    HB3  GLU  73           HB3      GLU  73   8.261  -5.454  -0.347
  565    HG2  GLU  73           HG2      GLU  73  10.548  -5.866  -0.408
  566    HG3  GLU  73           HG3      GLU  73   9.956  -6.483  -1.949
  567    H    LEU  74           H        LEU  74   7.394  -5.565  -4.742
  568    HA   LEU  74           HA       LEU  74   6.266  -8.100  -4.286
  569    HB2  LEU  74           HB2      LEU  74   7.307  -6.635  -6.657
  570    HB3  LEU  74           HB3      LEU  74   7.060  -8.365  -6.811
  571    HG   LEU  74           HG       LEU  74   4.696  -8.076  -6.166
  572   HD11  LEU  74          HD11      LEU  74   3.733  -5.837  -6.066
  573   HD12  LEU  74          HD12      LEU  74   5.340  -5.131  -6.240
  574   HD13  LEU  74          HD13      LEU  74   4.939  -6.070  -4.801
  575   HD21  LEU  74          HD21      LEU  74   5.478  -6.272  -8.451
  576   HD22  LEU  74          HD22      LEU  74   3.951  -7.130  -8.241
  577   HD23  LEU  74          HD23      LEU  74   5.437  -8.033  -8.539
  578    H    ASP  75           H        ASP  75   9.561  -7.042  -4.754
  579    HA   ASP  75           HA       ASP  75  11.542  -8.186  -4.966
  580    HB2  ASP  75           HB2      ASP  75  12.022  -9.513  -2.991
  581    HB3  ASP  75           HB3      ASP  75  11.076  -8.100  -2.541
  582    H    ASP  76           H        ASP  76   9.732  -9.212  -6.827
  583    HA   ASP  76           HA       ASP  76   9.670 -12.078  -6.677
  584    HB2  ASP  76           HB2      ASP  76   9.000 -10.105  -8.858
  585    HB3  ASP  76           HB3      ASP  76   8.917 -11.847  -9.106
  586    H    LEU  77           H        LEU  77  10.929 -13.553  -7.752
  587    HA   LEU  77           HA       LEU  77  13.557 -12.621  -8.543
  588    HB2  LEU  77           HB2      LEU  77  12.339 -15.321  -8.064
  589    HB3  LEU  77           HB3      LEU  77  13.898 -15.169  -8.851
  590    HG   LEU  77           HG       LEU  77  13.371 -13.917  -6.170
  591   HD11  LEU  77          HD11      LEU  77  14.402 -16.699  -6.701
  592   HD12  LEU  77          HD12      LEU  77  12.843 -16.295  -5.984
  593   HD13  LEU  77          HD13      LEU  77  14.335 -15.898  -5.132
  594   HD21  LEU  77          HD21      LEU  77  15.925 -14.895  -7.431
  595   HD22  LEU  77          HD22      LEU  77  15.749 -13.927  -5.967
  596   HD23  LEU  77          HD23      LEU  77  15.347 -13.232  -7.538
  597    H    GLU  78           H        GLU  78  10.671 -13.892 -10.028
  598    HA   GLU  78           HA       GLU  78  11.556 -13.100 -12.623
  599    HB2  GLU  78           HB2      GLU  78  11.779 -15.175 -13.681
  600    HB3  GLU  78           HB3      GLU  78  12.635 -15.381 -12.161
  601    HG2  GLU  78           HG2      GLU  78  10.561 -16.440 -11.240
  602    HG3  GLU  78           HG3      GLU  78   9.904 -16.408 -12.876
  603    H    HIS  79           H        HIS  79   9.831 -12.431 -13.720
  604    HA   HIS  79           HA       HIS  79   7.181 -13.146 -12.733
  605    HB2  HIS  79           HB2      HIS  79   8.089 -10.738 -13.319
  606    HB3  HIS  79           HB3      HIS  79   7.614 -11.189 -14.953
  607    HD1  HIS  79           HD1      HIS  79   6.311  -9.109 -12.687
  608    HD2  HIS  79           HD2      HIS  79   4.749 -12.609 -14.293
  609    HE1  HIS  79           HE1      HIS  79   3.820  -8.930 -12.393
  610    HE2  HIS  79           HE2      HIS  79   2.903 -11.097 -13.295
  611    H    HIS  80           H        HIS  80   7.873 -15.362 -13.752
  612    HA   HIS  80           HA       HIS  80   6.240 -15.719 -16.059
  613    HB2  HIS  80           HB2      HIS  80   8.451 -14.852 -17.000
  614    HB3  HIS  80           HB3      HIS  80   9.153 -16.378 -16.475
  615    HD1  HIS  80           HD1      HIS  80   5.700 -16.441 -17.845
  616    HD2  HIS  80           HD2      HIS  80   9.582 -17.075 -19.184
  617    HE1  HIS  80           HE1      HIS  80   5.464 -17.563 -20.082
  618    HE2  HIS  80           HE2      HIS  80   7.826 -18.015 -20.834
  619    H    HIS  81           H        HIS  81   5.428 -17.732 -16.068
  620    HA   HIS  81           HA       HIS  81   5.917 -19.497 -13.949
  621    HB2  HIS  81           HB2      HIS  81   4.495 -19.804 -16.584
  622    HB3  HIS  81           HB3      HIS  81   4.636 -21.151 -15.460
  623    HD1  HIS  81           HD1      HIS  81   2.529 -18.334 -16.255
  624    HD2  HIS  81           HD2      HIS  81   3.464 -20.474 -12.818
  625    HE1  HIS  81           HE1      HIS  81   0.704 -17.797 -14.611
  626    HE2  HIS  81           HE2      HIS  81   1.337 -19.035 -12.511
  627    H    HIS  82           H        HIS  82   6.493 -20.220 -17.393
  628    HA   HIS  82           HA       HIS  82   8.832 -21.808 -16.562
  629    HB2  HIS  82           HB2      HIS  82   8.435 -23.224 -18.524
  630    HB3  HIS  82           HB3      HIS  82   7.022 -23.194 -17.473
  631    HD1  HIS  82           HD1      HIS  82   8.251 -21.828 -20.769
  632    HD2  HIS  82           HD2      HIS  82   4.708 -22.277 -18.646
  633    HE1  HIS  82           HE1      HIS  82   6.420 -21.217 -22.380
  634    HE2  HIS  82           HE2      HIS  82   4.291 -21.411 -21.047
  635    H    HIS  83           H        HIS  83  10.757 -21.471 -17.555
  636    HA   HIS  83           HA       HIS  83  10.856 -19.717 -19.895
  637    HB2  HIS  83           HB2      HIS  83  12.622 -18.343 -18.899
  638    HB3  HIS  83           HB3      HIS  83  11.145 -18.250 -17.946
  639    HD1  HIS  83           HD1      HIS  83  14.537 -18.267 -17.348
  640    HD2  HIS  83           HD2      HIS  83  11.435 -20.594 -15.853
  641    HE1  HIS  83           HE1      HIS  83  15.386 -19.203 -15.174
  642    HE2  HIS  83           HE2      HIS  83  13.461 -20.538 -14.246
  643    H    HIS  84           H        HIS  84  13.459 -19.456 -20.333
  644    HA   HIS  84           HA       HIS  84  14.578 -22.177 -20.238
  645    HB2  HIS  84           HB2      HIS  84  14.203 -20.359 -22.585
  646    HB3  HIS  84           HB3      HIS  84  15.586 -21.447 -22.559
  647    HD1  HIS  84           HD1      HIS  84  12.982 -21.559 -24.469
  648    HD2  HIS  84           HD2      HIS  84  13.849 -24.018 -21.234
  649    HE1  HIS  84           HE1      HIS  84  11.684 -23.676 -24.867
  650    HE2  HIS  84           HE2      HIS  84  12.293 -25.182 -22.941
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1  -1.539   9.634 -15.447
    2    H2   MET   1           H2       MET   1  -2.921   8.622 -15.484
    3    H3   MET   1           H3       MET   1  -2.947  10.074 -14.570
    4    HA   MET   1           HA       MET   1  -1.250   9.222 -13.137
    5    HB2  MET   1           HB2      MET   1  -3.879   8.747 -13.075
    6    HB3  MET   1           HB3      MET   1  -3.323   7.085 -13.210
    7    HG2  MET   1           HG2      MET   1  -1.743   7.777 -11.243
    8    HG3  MET   1           HG3      MET   1  -2.951   9.037 -10.997
    9    HE1  MET   1           HE1      MET   1  -5.565   8.452 -10.155
   10    HE2  MET   1           HE2      MET   1  -4.187   8.735  -9.091
   11    HE3  MET   1           HE3      MET   1  -5.309   7.418  -8.749
   12    H    GLU   2           H        GLU   2   0.671   8.423 -13.905
   13    HA   GLU   2           HA       GLU   2   0.796   5.542 -14.248
   14    HB2  GLU   2           HB2      GLU   2   0.500   6.393 -16.542
   15    HB3  GLU   2           HB3      GLU   2   1.906   7.428 -16.335
   16    HG2  GLU   2           HG2      GLU   2   3.055   5.112 -15.754
   17    HG3  GLU   2           HG3      GLU   2   1.745   4.503 -16.765
   18    H    ASN   3           H        ASN   3   1.754   6.017 -12.101
   19    HA   ASN   3           HA       ASN   3   4.530   6.971 -12.298
   20    HB2  ASN   3           HB2      ASN   3   2.844   6.633  -9.809
   21    HB3  ASN   3           HB3      ASN   3   4.438   7.376  -9.905
   22   HD21  ASN   3          HD21      ASN   3   4.571   9.486 -10.280
   23   HD22  ASN   3          HD22      ASN   3   3.249  10.508 -10.718
   24    H    ASP   4           H        ASP   4   4.732   4.701 -13.307
   25    HA   ASP   4           HA       ASP   4   5.581   2.605 -13.209
   26    HB2  ASP   4           HB2      ASP   4   6.859   4.121 -11.237
   27    HB3  ASP   4           HB3      ASP   4   6.442   2.604 -10.460
   28    HA   PRO   5           HA       PRO   5   2.554   0.050 -11.258
   29    HB2  PRO   5           HB2      PRO   5   3.663  -2.376 -11.507
   30    HB3  PRO   5           HB3      PRO   5   3.148  -1.447 -12.920
   31    HG2  PRO   5           HG2      PRO   5   5.892  -1.826 -11.798
   32    HG3  PRO   5           HG3      PRO   5   5.367  -1.801 -13.490
   33    HD2  PRO   5           HD2      PRO   5   6.516   0.336 -12.171
   34    HD3  PRO   5           HD3      PRO   5   5.490   0.477 -13.608
   35    H    THR   6           H        THR   6   5.830  -0.021 -10.031
   36    HA   THR   6           HA       THR   6   5.040  -1.427  -7.610
   37    HB   THR   6           HB       THR   6   7.379  -1.431  -7.038
   38    HG1  THR   6           HG1      THR   6   8.850  -0.190  -8.043
   39   HG21  THR   6          HG21      THR   6   7.021  -1.939  -9.980
   40   HG22  THR   6          HG22      THR   6   6.857  -3.105  -8.668
   41   HG23  THR   6          HG23      THR   6   8.436  -2.414  -9.041
   42    H    VAL   7           H        VAL   7   3.682   0.970  -7.880
   43    HA   VAL   7           HA       VAL   7   4.641   2.385  -5.523
   44    HB   VAL   7           HB       VAL   7   3.935   3.920  -8.023
   45   HG11  VAL   7          HG11      VAL   7   4.830   4.684  -5.266
   46   HG12  VAL   7          HG12      VAL   7   3.450   5.276  -6.190
   47   HG13  VAL   7          HG13      VAL   7   5.085   5.757  -6.642
   48   HG21  VAL   7          HG21      VAL   7   6.637   3.259  -6.862
   49   HG22  VAL   7          HG22      VAL   7   6.361   4.505  -8.079
   50   HG23  VAL   7          HG23      VAL   7   6.016   2.816  -8.452
   51    H    LEU   8           H        LEU   8   2.999   2.736  -4.185
   52    HA   LEU   8           HA       LEU   8   0.280   2.365  -5.144
   53    HB2  LEU   8           HB2      LEU   8   1.589   1.668  -2.814
   54    HB3  LEU   8           HB3      LEU   8   0.605   3.033  -2.320
   55    HG   LEU   8           HG       LEU   8  -0.565   0.939  -1.922
   56   HD11  LEU   8          HD11      LEU   8  -1.674   3.119  -2.882
   57   HD12  LEU   8          HD12      LEU   8  -2.611   1.640  -2.669
   58   HD13  LEU   8          HD13      LEU   8  -2.003   2.076  -4.266
   59   HD21  LEU   8          HD21      LEU   8  -0.970   0.329  -4.768
   60   HD22  LEU   8          HD22      LEU   8  -0.740  -0.752  -3.393
   61   HD23  LEU   8          HD23      LEU   8   0.654   0.014  -4.156
   62    H    ARG   9           H        ARG   9  -1.380   3.869  -4.907
   63    HA   ARG   9           HA       ARG   9  -0.740   6.547  -3.965
   64    HB2  ARG   9           HB2      ARG   9  -1.399   5.876  -6.820
   65    HB3  ARG   9           HB3      ARG   9  -1.816   7.445  -6.149
   66    HG2  ARG   9           HG2      ARG   9   0.261   8.185  -6.377
   67    HG3  ARG   9           HG3      ARG   9   0.926   6.769  -5.566
   68    HD2  ARG   9           HD2      ARG   9   0.286   7.117  -8.481
   69    HD3  ARG   9           HD3      ARG   9   1.851   6.782  -7.743
   70    HE   ARG   9           HE       ARG   9   0.420   4.627  -7.032
   71   HH11  ARG   9          HH11      ARG   9   0.876   6.201 -10.115
   72   HH12  ARG   9          HH12      ARG   9   0.670   4.745 -11.028
   73   HH21  ARG   9          HH21      ARG   9   0.151   2.712  -8.235
   74   HH22  ARG   9          HH22      ARG   9   0.260   2.765  -9.963
   75    H    SER  10           H        SER  10  -2.516   7.686  -3.267
   76    HA   SER  10           HA       SER  10  -4.844   6.192  -2.641
   77    HB2  SER  10           HB2      SER  10  -4.177   7.910  -1.116
   78    HB3  SER  10           HB3      SER  10  -4.188   9.131  -2.388
   79    HG   SER  10           HG       SER  10  -6.095   8.839  -0.829
   80    HA   PRO  11           HA       PRO  11  -7.279   6.935  -6.259
   81    HB2  PRO  11           HB2      PRO  11  -9.756   6.526  -5.263
   82    HB3  PRO  11           HB3      PRO  11  -8.605   5.206  -5.506
   83    HG2  PRO  11           HG2      PRO  11  -9.298   6.675  -2.991
   84    HG3  PRO  11           HG3      PRO  11  -9.065   4.935  -3.242
   85    HD2  PRO  11           HD2      PRO  11  -7.151   6.549  -2.180
   86    HD3  PRO  11           HD3      PRO  11  -6.774   5.100  -3.134
   87    H    SER  12           H        SER  12  -8.005   8.659  -3.283
   88    HA   SER  12           HA       SER  12  -8.562  11.065  -4.793
   89    HB2  SER  12           HB2      SER  12 -10.731  11.489  -3.751
   90    HB3  SER  12           HB3      SER  12 -10.779   9.971  -4.647
   91    HG   SER  12           HG       SER  12 -10.465  10.284  -1.843
   92    H    ALA  13           H        ALA  13  -9.327  12.812  -3.001
   93    HA   ALA  13           HA       ALA  13  -7.078  13.022  -1.237
   94    HB1  ALA  13           HB1      ALA  13  -7.954  15.193  -0.662
   95    HB2  ALA  13           HB2      ALA  13  -9.505  14.803  -1.405
   96    HB3  ALA  13           HB3      ALA  13  -8.064  14.966  -2.408
   97    H    GLY  14           H        GLY  14  -6.944  12.146   0.715
   98    HA2  GLY  14           HA2      GLY  14  -9.348  12.063   2.401
   99    HA3  GLY  14           HA3      GLY  14  -8.460  10.570   2.129
  100    H    LYS  15           H        LYS  15  -7.646  10.155   4.102
  101    HA   LYS  15           HA       LYS  15  -5.459  11.758   5.031
  102    HB2  LYS  15           HB2      LYS  15  -7.470  12.940   5.969
  103    HB3  LYS  15           HB3      LYS  15  -7.834  11.478   6.877
  104    HG2  LYS  15           HG2      LYS  15  -5.107  12.559   7.185
  105    HG3  LYS  15           HG3      LYS  15  -6.420  13.520   7.868
  106    HD2  LYS  15           HD2      LYS  15  -7.121  11.064   8.735
  107    HD3  LYS  15           HD3      LYS  15  -5.365  10.890   8.686
  108    HE2  LYS  15           HE2      LYS  15  -5.297  13.105   9.965
  109    HE3  LYS  15           HE3      LYS  15  -7.015  12.843  10.262
  110    HZ1  LYS  15           HZ1      LYS  15  -6.192  11.802  12.072
  111    HZ2  LYS  15           HZ2      LYS  15  -4.707  11.438  11.349
  112    HZ3  LYS  15           HZ3      LYS  15  -6.067  10.495  11.005
  113    H    LEU  16           H        LEU  16  -4.056  10.586   6.277
  114    HA   LEU  16           HA       LEU  16  -4.329   7.767   6.274
  115    HB2  LEU  16           HB2      LEU  16  -2.185   9.170   6.228
  116    HB3  LEU  16           HB3      LEU  16  -2.383   9.316   7.962
  117    HG   LEU  16           HG       LEU  16  -2.130   6.944   8.265
  118   HD11  LEU  16          HD11      LEU  16  -1.569   5.526   6.243
  119   HD12  LEU  16          HD12      LEU  16  -2.213   6.843   5.263
  120   HD13  LEU  16          HD13      LEU  16  -3.255   6.011   6.417
  121   HD21  LEU  16          HD21      LEU  16   0.111   6.929   8.035
  122   HD22  LEU  16          HD22      LEU  16  -0.133   8.607   7.550
  123   HD23  LEU  16          HD23      LEU  16   0.046   7.351   6.324
  124    H    THR  17           H        THR  17  -6.064   7.049   7.448
  125    HA   THR  17           HA       THR  17  -6.590   7.974  10.111
  126    HB   THR  17           HB       THR  17  -8.381   7.199   8.570
  127    HG1  THR  17           HG1      THR  17  -9.397   6.868  10.353
  128   HG21  THR  17          HG21      THR  17  -7.674   4.379   9.214
  129   HG22  THR  17          HG22      THR  17  -6.972   5.166   7.801
  130   HG23  THR  17          HG23      THR  17  -8.723   5.018   7.949
  131    H    GLN  18           H        GLN  18  -5.224   5.015   8.695
  132    HA   GLN  18           HA       GLN  18  -3.623   4.537  11.004
  133    HB2  GLN  18           HB2      GLN  18  -6.184   3.627  11.294
  134    HB3  GLN  18           HB3      GLN  18  -5.385   2.210  10.626
  135    HG2  GLN  18           HG2      GLN  18  -4.627   1.723  12.640
  136    HG3  GLN  18           HG3      GLN  18  -3.683   3.212  12.623
  137   HE21  GLN  18          HE21      GLN  18  -6.804   1.833  13.475
  138   HE22  GLN  18          HE22      GLN  18  -7.186   2.986  14.704
  139    H    TYR  19           H        TYR  19  -3.339   1.707  10.639
  140    HA   TYR  19           HA       TYR  19  -2.643   1.328   7.843
  141    HB2  TYR  19           HB2      TYR  19  -0.303   0.749   8.353
  142    HB3  TYR  19           HB3      TYR  19  -0.655   2.432   8.731
  143    HD1  TYR  19           HD2      TYR  19   0.088  -0.877  10.137
  144    HD2  TYR  19           HD1      TYR  19  -0.632   3.224  11.014
  145    HE1  TYR  19           HE2      TYR  19   0.933  -1.223  12.420
  146    HE2  TYR  19           HE1      TYR  19   0.212   2.889  13.299
  147    HH   TYR  19           HH       TYR  19   0.364   0.652  14.896
  148    H    THR  20           H        THR  20  -2.471  -0.818   7.244
  149    HA   THR  20           HA       THR  20  -3.464  -2.724   9.224
  150    HB   THR  20           HB       THR  20  -4.165  -4.079   7.409
  151    HG1  THR  20           HG1      THR  20  -3.147  -4.125   5.583
  152   HG21  THR  20          HG21      THR  20  -5.387  -2.548   5.886
  153   HG22  THR  20          HG22      THR  20  -4.556  -1.196   6.656
  154   HG23  THR  20          HG23      THR  20  -5.640  -2.218   7.600
  155    H    VAL  21           H        VAL  21  -0.555  -1.889   7.625
  156    HA   VAL  21           HA       VAL  21   0.767  -4.180   8.837
  157    HB   VAL  21           HB       VAL  21   2.009  -4.756   6.802
  158   HG11  VAL  21          HG11      VAL  21   0.174  -5.877   5.602
  159   HG12  VAL  21          HG12      VAL  21  -0.988  -4.896   6.495
  160   HG13  VAL  21          HG13      VAL  21   0.036  -6.048   7.351
  161   HG21  VAL  21          HG21      VAL  21   1.240  -2.326   5.848
  162   HG22  VAL  21          HG22      VAL  21   0.153  -3.405   4.975
  163   HG23  VAL  21          HG23      VAL  21   1.898  -3.630   4.860
  164    H    GLU  22           H        GLU  22   2.949  -3.869   9.263
  165    HA   GLU  22           HA       GLU  22   3.768  -1.180   9.630
  166    HB2  GLU  22           HB2      GLU  22   5.818  -2.112  10.518
  167    HB3  GLU  22           HB3      GLU  22   4.452  -3.048  11.105
  168    HG2  GLU  22           HG2      GLU  22   5.248  -4.916  10.223
  169    HG3  GLU  22           HG3      GLU  22   5.483  -4.153   8.651
  170    H    ASP  23           H        ASP  23   6.411  -1.039   8.996
  171    HA   ASP  23           HA       ASP  23   6.388  -0.207   6.328
  172    HB2  ASP  23           HB2      ASP  23   7.985   0.511   8.173
  173    HB3  ASP  23           HB3      ASP  23   8.874  -0.975   7.857
  174    H    GLY  24           H        GLY  24   6.845  -1.169   4.433
  175    HA2  GLY  24           HA2      GLY  24   7.290  -2.826   2.910
  176    HA3  GLY  24           HA3      GLY  24   8.456  -3.437   4.072
  177    H    GLY  25           H        GLY  25   5.102  -3.155   4.949
  178    HA2  GLY  25           HA2      GLY  25   4.885  -5.839   5.735
  179    HA3  GLY  25           HA3      GLY  25   3.535  -4.744   5.491
  180    H    HIS  26           H        HIS  26   5.066  -7.513   4.406
  181    HA   HIS  26           HA       HIS  26   4.503  -7.480   1.655
  182    HB2  HIS  26           HB2      HIS  26   4.721  -9.932   1.773
  183    HB3  HIS  26           HB3      HIS  26   6.015  -9.120   2.648
  184    HD1  HIS  26           HD1      HIS  26   6.141  -9.479   5.176
  185    HD2  HIS  26           HD2      HIS  26   2.876 -11.332   3.395
  186    HE1  HIS  26           HE1      HIS  26   5.195 -11.008   6.934
  187    HE2  HIS  26           HE2      HIS  26   3.167 -12.052   5.862
  188    H    VAL  27           H        VAL  27   2.645  -7.550   0.588
  189    HA   VAL  27           HA       VAL  27   0.362  -8.977   1.711
  190    HB   VAL  27           HB       VAL  27  -1.177  -7.098   1.237
  191   HG11  VAL  27          HG11      VAL  27  -0.220  -7.551   3.509
  192   HG12  VAL  27          HG12      VAL  27  -0.754  -5.891   3.248
  193   HG13  VAL  27          HG13      VAL  27   0.964  -6.283   3.192
  194   HG21  VAL  27          HG21      VAL  27  -0.194  -5.686  -0.283
  195   HG22  VAL  27          HG22      VAL  27   1.384  -5.761   0.501
  196   HG23  VAL  27          HG23      VAL  27   0.089  -4.798   1.214
  197    H    GLU  28           H        GLU  28  -0.953  -9.875   0.186
  198    HA   GLU  28           HA       GLU  28   0.011  -9.831  -2.540
  199    HB2  GLU  28           HB2      GLU  28  -1.451 -11.680  -2.929
  200    HB3  GLU  28           HB3      GLU  28  -0.695 -11.932  -1.362
  201    HG2  GLU  28           HG2      GLU  28  -3.075 -10.513  -0.886
  202    HG3  GLU  28           HG3      GLU  28  -3.466 -11.791  -2.035
  203    H    ALA  29           H        ALA  29  -1.477  -9.570  -4.373
  204    HA   ALA  29           HA       ALA  29  -2.689  -7.115  -4.488
  205    HB1  ALA  29           HB1      ALA  29  -2.154  -8.937  -6.330
  206    HB2  ALA  29           HB2      ALA  29  -3.326  -7.649  -6.609
  207    HB3  ALA  29           HB3      ALA  29  -3.879  -9.262  -6.157
  208    H    GLY  30           H        GLY  30  -4.547  -6.244  -3.811
  209    HA2  GLY  30           HA2      GLY  30  -6.874  -6.235  -3.381
  210    HA3  GLY  30           HA3      GLY  30  -6.831  -7.986  -3.241
  211    H    SER  31           H        SER  31  -4.395  -7.718  -1.467
  212    HA   SER  31           HA       SER  31  -5.806  -7.699   1.008
  213    HB2  SER  31           HB2      SER  31  -3.902  -9.168   0.742
  214    HB3  SER  31           HB3      SER  31  -2.845  -7.801   0.393
  215    HG   SER  31           HG       SER  31  -2.880  -7.216   2.475
  216    H    SER  32           H        SER  32  -6.161  -6.079   2.383
  217    HA   SER  32           HA       SER  32  -5.543  -3.408   1.689
  218    HB2  SER  32           HB2      SER  32  -6.380  -2.960   4.086
  219    HB3  SER  32           HB3      SER  32  -7.512  -3.692   2.949
  220    HG   SER  32           HG       SER  32  -7.598  -4.852   4.846
  221    H    TYR  33           H        TYR  33  -3.872  -2.138   2.195
  222    HA   TYR  33           HA       TYR  33  -1.843  -3.215   4.036
  223    HB2  TYR  33           HB2      TYR  33  -0.175  -2.010   2.792
  224    HB3  TYR  33           HB3      TYR  33  -1.156  -2.919   1.647
  225    HD1  TYR  33           HD1      TYR  33  -0.423   0.443   2.967
  226    HD2  TYR  33           HD2      TYR  33  -2.487  -1.801  -0.001
  227    HE1  TYR  33           HE1      TYR  33  -0.858   2.513   1.714
  228    HE2  TYR  33           HE2      TYR  33  -2.927   0.263  -1.263
  229    HH   TYR  33           HH       TYR  33  -1.380   3.223  -0.545
  230    H    ALA  34           H        ALA  34  -4.144  -0.771   3.652
  231    HA   ALA  34           HA       ALA  34  -3.530   0.440   6.131
  232    HB1  ALA  34           HB1      ALA  34  -3.119   2.363   3.877
  233    HB2  ALA  34           HB2      ALA  34  -1.773   1.394   4.477
  234    HB3  ALA  34           HB3      ALA  34  -2.623   2.492   5.565
  235    H    GLU  35           H        GLU  35  -4.747   2.806   6.037
  236    HA   GLU  35           HA       GLU  35  -7.232   2.571   4.537
  237    HB2  GLU  35           HB2      GLU  35  -7.336   2.947   7.525
  238    HB3  GLU  35           HB3      GLU  35  -8.669   2.624   6.426
  239    HG2  GLU  35           HG2      GLU  35  -7.421   0.402   5.968
  240    HG3  GLU  35           HG3      GLU  35  -6.596   0.757   7.485
  241    H    MET  36           H        MET  36  -8.619   4.544   4.864
  242    HA   MET  36           HA       MET  36  -7.237   6.885   5.861
  243    HB2  MET  36           HB2      MET  36  -7.263   8.117   3.799
  244    HB3  MET  36           HB3      MET  36  -6.413   6.604   3.525
  245    HG2  MET  36           HG2      MET  36  -7.703   6.568   1.683
  246    HG3  MET  36           HG3      MET  36  -8.863   5.844   2.794
  247    HE1  MET  36           HE1      MET  36  -9.535   7.240  -0.002
  248    HE2  MET  36           HE2      MET  36  -8.318   8.503   0.181
  249    HE3  MET  36           HE3      MET  36 -10.025   8.932   0.077
  250    H    GLU  37           H        GLU  37  -8.654   8.134   6.862
  251    HA   GLU  37           HA       GLU  37 -11.498   7.703   6.416
  252    HB2  GLU  37           HB2      GLU  37 -10.374   7.809   8.719
  253    HB3  GLU  37           HB3      GLU  37 -10.278   9.546   8.461
  254    HG2  GLU  37           HG2      GLU  37 -12.729   9.605   8.185
  255    HG3  GLU  37           HG3      GLU  37 -12.783   7.882   8.555
  256    H    VAL  38           H        VAL  38 -12.186   8.788   4.658
  257    HA   VAL  38           HA       VAL  38 -11.319  11.533   4.202
  258    HB   VAL  38           HB       VAL  38 -11.428   9.951   2.299
  259   HG11  VAL  38          HG11      VAL  38 -14.335   9.883   3.026
  260   HG12  VAL  38          HG12      VAL  38 -13.229   8.538   2.757
  261   HG13  VAL  38          HG13      VAL  38 -13.780   9.512   1.395
  262   HG21  VAL  38          HG21      VAL  38 -13.469  12.123   1.914
  263   HG22  VAL  38          HG22      VAL  38 -12.328  11.470   0.738
  264   HG23  VAL  38          HG23      VAL  38 -11.745  12.455   2.081
  265    H    MET  39           H        MET  39 -13.061  13.147   3.580
  266    HA   MET  39           HA       MET  39 -14.760  13.612   5.720
  267    HB2  MET  39           HB2      MET  39 -15.271  14.646   2.936
  268    HB3  MET  39           HB3      MET  39 -15.672  15.416   4.465
  269    HG2  MET  39           HG2      MET  39 -13.005  15.207   4.731
  270    HG3  MET  39           HG3      MET  39 -13.133  15.352   2.979
  271    HE1  MET  39           HE1      MET  39 -14.671  18.469   6.006
  272    HE2  MET  39           HE2      MET  39 -14.079  16.855   6.402
  273    HE3  MET  39           HE3      MET  39 -15.642  17.051   5.610
  274    H    LYS  40           H        LYS  40 -15.252  11.637   2.919
  275    HA   LYS  40           HA       LYS  40 -18.115  11.545   3.133
  276    HB2  LYS  40           HB2      LYS  40 -16.081   9.978   1.563
  277    HB3  LYS  40           HB3      LYS  40 -17.777   9.515   1.579
  278    HG2  LYS  40           HG2      LYS  40 -17.697  10.817  -0.298
  279    HG3  LYS  40           HG3      LYS  40 -18.159  12.014   0.914
  280    HD2  LYS  40           HD2      LYS  40 -16.032  12.957   0.973
  281    HD3  LYS  40           HD3      LYS  40 -15.273  11.522   0.280
  282    HE2  LYS  40           HE2      LYS  40 -15.248  12.977  -1.509
  283    HE3  LYS  40           HE3      LYS  40 -16.740  12.081  -1.795
  284    HZ1  LYS  40           HZ1      LYS  40 -17.990  13.883  -0.816
  285    HZ2  LYS  40           HZ2      LYS  40 -17.031  14.476  -2.076
  286    HZ3  LYS  40           HZ3      LYS  40 -16.569  14.734  -0.470
  287    H    MET  41           H        MET  41 -15.881   8.791   3.275
  288    HA   MET  41           HA       MET  41 -16.893   7.986   5.867
  289    HB2  MET  41           HB2      MET  41 -17.622   6.615   3.323
  290    HB3  MET  41           HB3      MET  41 -17.288   5.616   4.730
  291    HG2  MET  41           HG2      MET  41 -18.958   7.388   5.838
  292    HG3  MET  41           HG3      MET  41 -19.549   7.425   4.178
  293    HE1  MET  41           HE1      MET  41 -22.008   5.271   6.341
  294    HE2  MET  41           HE2      MET  41 -21.310   6.890   6.307
  295    HE3  MET  41           HE3      MET  41 -20.678   5.681   7.425
  296    H    ILE  42           H        ILE  42 -15.941   5.555   6.202
  297    HA   ILE  42           HA       ILE  42 -13.080   5.921   6.025
  298    HB   ILE  42           HB       ILE  42 -14.054   5.044   8.089
  299   HG12  ILE  42          HG12      ILE  42 -12.554   3.130   8.411
  300   HG13  ILE  42          HG13      ILE  42 -12.372   2.966   6.668
  301   HG21  ILE  42          HG21      ILE  42 -15.714   3.604   6.468
  302   HG22  ILE  42          HG22      ILE  42 -15.519   3.357   8.203
  303   HG23  ILE  42          HG23      ILE  42 -14.610   2.364   7.064
  304   HD11  ILE  42          HD11      ILE  42 -11.707   5.631   7.406
  305   HD12  ILE  42          HD12      ILE  42 -10.681   4.382   6.700
  306   HD13  ILE  42          HD13      ILE  42 -10.837   4.510   8.452
  307    H    MET  43           H        MET  43 -11.616   4.545   4.980
  308    HA   MET  43           HA       MET  43 -12.690   2.476   3.228
  309    HB2  MET  43           HB2      MET  43 -11.213   4.920   2.275
  310    HB3  MET  43           HB3      MET  43 -11.260   3.436   1.334
  311    HG2  MET  43           HG2      MET  43 -13.543   3.607   0.944
  312    HG3  MET  43           HG3      MET  43 -13.784   4.731   2.280
  313    HE1  MET  43           HE1      MET  43 -12.057   4.237  -1.174
  314    HE2  MET  43           HE2      MET  43 -12.618   5.683  -2.014
  315    HE3  MET  43           HE3      MET  43 -13.781   4.484  -1.449
  316    H    THR  44           H        THR  44 -10.970   1.169   2.211
  317    HA   THR  44           HA       THR  44  -8.537   1.120   3.874
  318    HB   THR  44           HB       THR  44  -9.315  -1.420   2.619
  319    HG1  THR  44           HG1      THR  44 -11.378  -0.723   3.165
  320   HG21  THR  44          HG21      THR  44  -7.541  -1.046   4.399
  321   HG22  THR  44          HG22      THR  44  -8.659  -2.390   4.633
  322   HG23  THR  44          HG23      THR  44  -8.883  -0.890   5.533
  323    H    LEU  45           H        LEU  45  -6.630   1.134   2.843
  324    HA   LEU  45           HA       LEU  45  -6.659   1.217  -0.072
  325    HB2  LEU  45           HB2      LEU  45  -4.433   1.808   1.881
  326    HB3  LEU  45           HB3      LEU  45  -4.356   2.049   0.146
  327    HG   LEU  45           HG       LEU  45  -6.473   3.576   0.616
  328   HD11  LEU  45          HD11      LEU  45  -5.238   3.135   3.261
  329   HD12  LEU  45          HD12      LEU  45  -6.898   3.552   2.834
  330   HD13  LEU  45          HD13      LEU  45  -5.652   4.800   2.853
  331   HD21  LEU  45          HD21      LEU  45  -4.417   4.326  -0.430
  332   HD22  LEU  45          HD22      LEU  45  -3.616   4.388   1.140
  333   HD23  LEU  45          HD23      LEU  45  -4.944   5.493   0.783
  334    H    ASN  46           H        ASN  46  -6.329  -0.597  -1.162
  335    HA   ASN  46           HA       ASN  46  -4.622  -2.675   0.036
  336    HB2  ASN  46           HB2      ASN  46  -5.809  -4.268  -1.430
  337    HB3  ASN  46           HB3      ASN  46  -6.913  -3.419  -0.352
  338   HD21  ASN  46          HD21      ASN  46  -8.096  -1.601  -1.244
  339   HD22  ASN  46          HD22      ASN  46  -8.537  -1.623  -2.914
  340    H    VAL  47           H        VAL  47  -3.611  -4.127  -1.739
  341    HA   VAL  47           HA       VAL  47  -2.113  -2.347  -3.504
  342    HB   VAL  47           HB       VAL  47  -0.609  -4.288  -3.836
  343   HG11  VAL  47          HG11      VAL  47   0.506  -4.039  -1.815
  344   HG12  VAL  47          HG12      VAL  47  -0.990  -3.935  -0.887
  345   HG13  VAL  47          HG13      VAL  47  -0.484  -2.582  -1.899
  346   HG21  VAL  47          HG21      VAL  47  -1.097  -6.371  -3.181
  347   HG22  VAL  47          HG22      VAL  47  -2.754  -5.793  -3.005
  348   HG23  VAL  47          HG23      VAL  47  -1.682  -5.834  -1.606
  349    H    GLN  48           H        GLN  48  -1.795  -2.803  -5.722
  350    HA   GLN  48           HA       GLN  48  -4.123  -3.990  -6.978
  351    HB2  GLN  48           HB2      GLN  48  -2.924  -3.168  -9.107
  352    HB3  GLN  48           HB3      GLN  48  -3.574  -1.970  -7.999
  353    HG2  GLN  48           HG2      GLN  48  -1.385  -1.322  -8.808
  354    HG3  GLN  48           HG3      GLN  48  -1.354  -1.604  -7.070
  355   HE21  GLN  48          HE21      GLN  48   0.106  -2.972  -6.278
  356   HE22  GLN  48          HE22      GLN  48   1.114  -4.012  -7.220
  357    H    GLU  49           H        GLU  49  -0.991  -4.990  -6.141
  358    HA   GLU  49           HA       GLU  49  -1.386  -7.497  -7.513
  359    HB2  GLU  49           HB2      GLU  49   0.534  -5.490  -8.471
  360    HB3  GLU  49           HB3      GLU  49   1.209  -7.096  -8.238
  361    HG2  GLU  49           HG2      GLU  49   0.460  -7.569 -10.268
  362    HG3  GLU  49           HG3      GLU  49  -1.152  -7.595  -9.556
  363    H    ARG  50           H        ARG  50   0.476  -9.033  -7.005
  364    HA   ARG  50           HA       ARG  50   0.820  -9.106  -4.193
  365    HB2  ARG  50           HB2      ARG  50   1.728 -10.774  -6.494
  366    HB3  ARG  50           HB3      ARG  50   2.527 -10.990  -4.943
  367    HG2  ARG  50           HG2      ARG  50   0.828 -12.587  -4.965
  368    HG3  ARG  50           HG3      ARG  50   0.193 -11.278  -3.966
  369    HD2  ARG  50           HD2      ARG  50  -1.606 -11.740  -5.333
  370    HD3  ARG  50           HD3      ARG  50  -0.820 -10.425  -6.206
  371    HE   ARG  50           HE       ARG  50   0.242 -12.798  -7.176
  372   HH11  ARG  50          HH11      ARG  50  -2.862 -11.208  -7.067
  373   HH12  ARG  50          HH12      ARG  50  -3.423 -11.929  -8.538
  374   HH21  ARG  50          HH21      ARG  50  -0.494 -13.748  -9.111
  375   HH22  ARG  50          HH22      ARG  50  -2.079 -13.371  -9.699
  376    H    GLY  51           H        GLY  51   2.423  -8.387  -2.926
  377    HA2  GLY  51           HA2      GLY  51   5.106  -8.216  -3.442
  378    HA3  GLY  51           HA3      GLY  51   4.453  -6.706  -4.059
  379    H    ARG  52           H        ARG  52   5.996  -5.906  -2.372
  380    HA   ARG  52           HA       ARG  52   4.973  -6.083   0.357
  381    HB2  ARG  52           HB2      ARG  52   7.530  -5.167  -0.886
  382    HB3  ARG  52           HB3      ARG  52   7.078  -4.514   0.683
  383    HG2  ARG  52           HG2      ARG  52   8.563  -6.457   0.860
  384    HG3  ARG  52           HG3      ARG  52   7.000  -6.731   1.631
  385    HD2  ARG  52           HD2      ARG  52   6.288  -8.179  -0.042
  386    HD3  ARG  52           HD3      ARG  52   7.463  -7.568  -1.206
  387    HE   ARG  52           HE       ARG  52   9.023  -8.664   0.704
  388   HH11  ARG  52          HH11      ARG  52   6.288  -9.867  -1.100
  389   HH12  ARG  52          HH12      ARG  52   6.823 -11.513  -1.054
  390   HH21  ARG  52          HH21      ARG  52   9.728 -10.829   0.765
  391   HH22  ARG  52          HH22      ARG  52   8.775 -12.060   0.005
  392    H    VAL  53           H        VAL  53   5.388  -3.781   1.530
  393    HA   VAL  53           HA       VAL  53   4.394  -1.581  -0.085
  394    HB   VAL  53           HB       VAL  53   2.818  -2.465   2.331
  395   HG11  VAL  53          HG11      VAL  53   2.487  -0.283   0.295
  396   HG12  VAL  53          HG12      VAL  53   2.558  -0.149   2.052
  397   HG13  VAL  53          HG13      VAL  53   1.142  -0.859   1.278
  398   HG21  VAL  53          HG21      VAL  53   2.519  -4.119   0.596
  399   HG22  VAL  53          HG22      VAL  53   2.203  -2.858  -0.595
  400   HG23  VAL  53          HG23      VAL  53   1.063  -3.131   0.722
  401    H    LYS  54           H        LYS  54   5.696   0.028   0.442
  402    HA   LYS  54           HA       LYS  54   6.474   0.358   3.265
  403    HB2  LYS  54           HB2      LYS  54   7.985   0.888   0.719
  404    HB3  LYS  54           HB3      LYS  54   8.428   1.686   2.222
  405    HG2  LYS  54           HG2      LYS  54   8.963  -0.370   3.264
  406    HG3  LYS  54           HG3      LYS  54   8.226  -1.300   1.957
  407    HD2  LYS  54           HD2      LYS  54  10.575  -1.410   1.631
  408    HD3  LYS  54           HD3      LYS  54   9.949  -0.290   0.420
  409    HE2  LYS  54           HE2      LYS  54  10.901   0.757   3.049
  410    HE3  LYS  54           HE3      LYS  54  12.078   0.317   1.812
  411    HZ1  LYS  54           HZ1      LYS  54  10.211   2.539   1.887
  412    HZ2  LYS  54           HZ2      LYS  54  10.388   1.787   0.382
  413    HZ3  LYS  54           HZ3      LYS  54  11.740   2.431   1.170
  414    H    TYR  55           H        TYR  55   5.507   2.014   4.205
  415    HA   TYR  55           HA       TYR  55   3.950   3.925   2.911
  416    HB2  TYR  55           HB2      TYR  55   5.147   3.755   5.656
  417    HB3  TYR  55           HB3      TYR  55   4.284   5.206   5.157
  418    HD1  TYR  55           HD1      TYR  55   3.566   1.623   4.423
  419    HD2  TYR  55           HD2      TYR  55   2.288   5.194   6.348
  420    HE1  TYR  55           HE1      TYR  55   1.434   0.543   4.994
  421    HE2  TYR  55           HE2      TYR  55   0.151   4.124   6.927
  422    HH   TYR  55           HH       TYR  55  -0.411   0.717   6.374
  423    H    ILE  56           H        ILE  56   4.281   5.951   2.167
  424    HA   ILE  56           HA       ILE  56   7.071   6.863   2.015
  425    HB   ILE  56           HB       ILE  56   4.730   7.145   0.182
  426   HG12  ILE  56          HG12      ILE  56   6.305   6.536  -1.506
  427   HG13  ILE  56          HG13      ILE  56   7.670   6.867  -0.445
  428   HG21  ILE  56          HG21      ILE  56   6.065   8.959  -1.030
  429   HG22  ILE  56          HG22      ILE  56   6.900   9.193   0.505
  430   HG23  ILE  56          HG23      ILE  56   5.156   9.436   0.404
  431   HD11  ILE  56          HD11      ILE  56   7.018   4.966   0.956
  432   HD12  ILE  56          HD12      ILE  56   7.351   4.491  -0.709
  433   HD13  ILE  56          HD13      ILE  56   5.685   4.627  -0.148
  434    H    LYS  57           H        LYS  57   3.771   8.126   2.364
  435    HA   LYS  57           HA       LYS  57   4.622  10.688   3.274
  436    HB2  LYS  57           HB2      LYS  57   2.172   9.395   2.558
  437    HB3  LYS  57           HB3      LYS  57   1.960  10.187   4.114
  438    HG2  LYS  57           HG2      LYS  57   2.951  11.504   1.593
  439    HG3  LYS  57           HG3      LYS  57   1.323  11.640   2.262
  440    HD2  LYS  57           HD2      LYS  57   2.272  12.645   4.302
  441    HD3  LYS  57           HD3      LYS  57   3.880  12.554   3.580
  442    HE2  LYS  57           HE2      LYS  57   3.107  14.772   3.250
  443    HE3  LYS  57           HE3      LYS  57   2.995  13.957   1.691
  444    HZ1  LYS  57           HZ1      LYS  57   0.590  13.499   2.380
  445    HZ2  LYS  57           HZ2      LYS  57   0.985  15.067   1.887
  446    HZ3  LYS  57           HZ3      LYS  57   0.818  14.716   3.533
  447    H    ARG  58           H        ARG  58   3.554  11.487   5.446
  448    HA   ARG  58           HA       ARG  58   4.673   9.783   7.532
  449    HB2  ARG  58           HB2      ARG  58   4.115  12.672   7.226
  450    HB3  ARG  58           HB3      ARG  58   3.905  12.021   8.846
  451    HG2  ARG  58           HG2      ARG  58   6.312  10.956   8.101
  452    HG3  ARG  58           HG3      ARG  58   6.342  12.545   7.334
  453    HD2  ARG  58           HD2      ARG  58   5.639  12.116  10.230
  454    HD3  ARG  58           HD3      ARG  58   7.279  12.441   9.671
  455    HE   ARG  58           HE       ARG  58   5.853  14.473   8.603
  456   HH11  ARG  58          HH11      ARG  58   6.129  13.200  11.840
  457   HH12  ARG  58          HH12      ARG  58   5.834  14.727  12.601
  458   HH21  ARG  58          HH21      ARG  58   5.465  16.483   9.601
  459   HH22  ARG  58          HH22      ARG  58   5.456  16.591  11.330
  460    HA   PRO  59           HA       PRO  59   0.848   8.497   9.294
  461    HB2  PRO  59           HB2      PRO  59   1.212   8.858  11.967
  462    HB3  PRO  59           HB3      PRO  59   1.998   7.567  11.052
  463    HG2  PRO  59           HG2      PRO  59   3.094  10.218  11.909
  464    HG3  PRO  59           HG3      PRO  59   3.865   8.621  11.952
  465    HD2  PRO  59           HD2      PRO  59   4.393  10.426  10.013
  466    HD3  PRO  59           HD3      PRO  59   4.396   8.677   9.706
  467    H    GLY  60           H        GLY  60  -1.082   9.441   9.322
  468    HA2  GLY  60           HA2      GLY  60  -2.756  10.877  10.122
  469    HA3  GLY  60           HA3      GLY  60  -1.517  11.860  10.885
  470    H    ALA  61           H        ALA  61  -0.101  11.665   8.114
  471    HA   ALA  61           HA       ALA  61  -0.745  14.207   7.199
  472    HB1  ALA  61           HB1      ALA  61   1.340  13.094   6.633
  473    HB2  ALA  61           HB2      ALA  61   0.501  13.615   5.172
  474    HB3  ALA  61           HB3      ALA  61   0.465  11.918   5.652
  475    H    VAL  62           H        VAL  62  -2.009  14.999   5.539
  476    HA   VAL  62           HA       VAL  62  -4.386  13.491   4.951
  477    HB   VAL  62           HB       VAL  62  -3.583  16.169   3.811
  478   HG11  VAL  62          HG11      VAL  62  -6.356  15.119   4.293
  479   HG12  VAL  62          HG12      VAL  62  -5.491  14.829   2.784
  480   HG13  VAL  62          HG13      VAL  62  -5.853  16.479   3.291
  481   HG21  VAL  62          HG21      VAL  62  -3.491  16.237   6.253
  482   HG22  VAL  62          HG22      VAL  62  -5.126  15.581   6.337
  483   HG23  VAL  62          HG23      VAL  62  -4.851  17.177   5.640
  484    H    LEU  63           H        LEU  63  -4.712  12.222   3.247
  485    HA   LEU  63           HA       LEU  63  -2.703  12.048   1.177
  486    HB2  LEU  63           HB2      LEU  63  -5.230  10.501   1.721
  487    HB3  LEU  63           HB3      LEU  63  -4.214  10.203   0.323
  488    HG   LEU  63           HG       LEU  63  -3.664   8.574   1.974
  489   HD11  LEU  63          HD11      LEU  63  -1.498  10.650   2.175
  490   HD12  LEU  63          HD12      LEU  63  -1.800   9.714   0.712
  491   HD13  LEU  63          HD13      LEU  63  -1.334   8.895   2.202
  492   HD21  LEU  63          HD21      LEU  63  -2.902  10.670   3.964
  493   HD22  LEU  63          HD22      LEU  63  -3.288   8.968   4.220
  494   HD23  LEU  63          HD23      LEU  63  -4.573  10.119   3.852
  495    H    GLU  64           H        GLU  64  -2.974  12.475  -0.994
  496    HA   GLU  64           HA       GLU  64  -5.401  13.987  -1.710
  497    HB2  GLU  64           HB2      GLU  64  -2.680  14.429  -2.930
  498    HB3  GLU  64           HB3      GLU  64  -4.103  15.455  -3.055
  499    HG2  GLU  64           HG2      GLU  64  -2.437  14.987  -0.594
  500    HG3  GLU  64           HG3      GLU  64  -2.490  16.453  -1.572
  501    H    ALA  65           H        ALA  65  -6.149  13.802  -3.872
  502    HA   ALA  65           HA       ALA  65  -6.087  11.199  -4.919
  503    HB1  ALA  65           HB1      ALA  65  -6.874  13.667  -6.451
  504    HB2  ALA  65           HB2      ALA  65  -7.902  12.912  -5.233
  505    HB3  ALA  65           HB3      ALA  65  -7.449  12.016  -6.683
  506    H    GLY  66           H        GLY  66  -4.224  10.329  -5.627
  507    HA2  GLY  66           HA2      GLY  66  -2.906  10.054  -7.660
  508    HA3  GLY  66           HA3      GLY  66  -2.781  11.804  -7.739
  509    H    CYS  67           H        CYS  67  -2.341  11.820  -4.735
  510    HA   CYS  67           HA       CYS  67   0.477  11.893  -4.801
  511    HB2  CYS  67           HB2      CYS  67  -0.941  13.217  -3.240
  512    HB3  CYS  67           HB3      CYS  67  -1.312  11.734  -2.368
  513    HG   CYS  67           HG       CYS  67   1.280  11.613  -1.766
  514    H    VAL  68           H        VAL  68   2.020  10.551  -3.834
  515    HA   VAL  68           HA       VAL  68   1.350   7.745  -3.897
  516    HB   VAL  68           HB       VAL  68   4.002   8.985  -3.161
  517   HG11  VAL  68          HG11      VAL  68   4.934   6.852  -3.820
  518   HG12  VAL  68          HG12      VAL  68   3.335   6.263  -4.277
  519   HG13  VAL  68          HG13      VAL  68   3.699   6.605  -2.585
  520   HG21  VAL  68          HG21      VAL  68   3.152   9.771  -5.368
  521   HG22  VAL  68          HG22      VAL  68   3.103   8.089  -5.895
  522   HG23  VAL  68          HG23      VAL  68   4.643   8.833  -5.466
  523    H    VAL  69           H        VAL  69   0.293   6.972  -2.171
  524    HA   VAL  69           HA       VAL  69   0.818   7.945   0.497
  525    HB   VAL  69           HB       VAL  69  -0.900   5.586  -0.264
  526   HG11  VAL  69          HG11      VAL  69  -0.397   7.128   2.192
  527   HG12  VAL  69          HG12      VAL  69  -0.915   5.455   1.985
  528   HG13  VAL  69          HG13      VAL  69  -2.089   6.764   1.853
  529   HG21  VAL  69          HG21      VAL  69  -1.309   8.441  -0.738
  530   HG22  VAL  69          HG22      VAL  69  -2.627   7.671   0.146
  531   HG23  VAL  69          HG23      VAL  69  -2.137   7.045  -1.428
  532    H    ALA  70           H        ALA  70   1.894   5.337  -1.496
  533    HA   ALA  70           HA       ALA  70   3.809   4.515   0.455
  534    HB1  ALA  70           HB1      ALA  70   1.484   3.376   0.988
  535    HB2  ALA  70           HB2      ALA  70   3.005   2.501   1.166
  536    HB3  ALA  70           HB3      ALA  70   2.013   2.263  -0.273
  537    H    ARG  71           H        ARG  71   4.281   1.905  -0.561
  538    HA   ARG  71           HA       ARG  71   4.758   2.330  -3.421
  539    HB2  ARG  71           HB2      ARG  71   6.808   1.930  -1.291
  540    HB3  ARG  71           HB3      ARG  71   7.080   1.183  -2.860
  541    HG2  ARG  71           HG2      ARG  71   6.469   4.106  -2.532
  542    HG3  ARG  71           HG3      ARG  71   8.109   3.455  -2.512
  543    HD2  ARG  71           HD2      ARG  71   6.527   2.503  -4.766
  544    HD3  ARG  71           HD3      ARG  71   6.708   4.257  -4.743
  545    HE   ARG  71           HE       ARG  71   8.751   2.311  -5.271
  546   HH11  ARG  71          HH11      ARG  71   8.126   5.551  -4.138
  547   HH12  ARG  71          HH12      ARG  71   9.704   6.134  -4.547
  548   HH21  ARG  71          HH21      ARG  71  10.828   3.075  -5.810
  549   HH22  ARG  71          HH22      ARG  71  11.239   4.728  -5.497
  550    H    LEU  72           H        LEU  72   5.964   0.157  -4.222
  551    HA   LEU  72           HA       LEU  72   4.716  -2.168  -2.964
  552    HB2  LEU  72           HB2      LEU  72   3.723  -0.929  -5.306
  553    HB3  LEU  72           HB3      LEU  72   4.478  -2.429  -5.807
  554    HG   LEU  72           HG       LEU  72   2.045  -2.624  -5.337
  555   HD11  LEU  72          HD11      LEU  72   3.968  -4.422  -4.921
  556   HD12  LEU  72          HD12      LEU  72   2.265  -4.757  -4.614
  557   HD13  LEU  72          HD13      LEU  72   3.330  -4.315  -3.281
  558   HD21  LEU  72          HD21      LEU  72   2.191  -0.994  -3.377
  559   HD22  LEU  72          HD22      LEU  72   2.754  -2.373  -2.433
  560   HD23  LEU  72          HD23      LEU  72   1.158  -2.410  -3.182
  561    H    GLU  73           H        GLU  73   5.573  -4.212  -3.734
  562    HA   GLU  73           HA       GLU  73   8.101  -4.070  -5.191
  563    HB2  GLU  73           HB2      GLU  73   8.209  -4.043  -2.496
  564    HB3  GLU  73           HB3      GLU  73   8.140  -5.778  -2.769
  565    HG2  GLU  73           HG2      GLU  73  10.412  -5.296  -2.687
  566    HG3  GLU  73           HG3      GLU  73  10.059  -5.423  -4.409
  567    H    LEU  74           H        LEU  74   7.105  -5.178  -6.873
  568    HA   LEU  74           HA       LEU  74   5.551  -7.497  -6.595
  569    HB2  LEU  74           HB2      LEU  74   6.833  -6.024  -8.768
  570    HB3  LEU  74           HB3      LEU  74   6.752  -7.751  -9.066
  571    HG   LEU  74           HG       LEU  74   4.323  -7.706  -8.745
  572   HD11  LEU  74          HD11      LEU  74   3.964  -5.970  -7.204
  573   HD12  LEU  74          HD12      LEU  74   3.245  -5.405  -8.712
  574   HD13  LEU  74          HD13      LEU  74   4.819  -4.794  -8.203
  575   HD21  LEU  74          HD21      LEU  74   5.278  -7.369 -10.983
  576   HD22  LEU  74          HD22      LEU  74   5.273  -5.627 -10.712
  577   HD23  LEU  74          HD23      LEU  74   3.750  -6.514 -10.778
  578    H    ASP  75           H        ASP  75   6.090  -9.463  -5.975
  579    HA   ASP  75           HA       ASP  75   8.809 -10.225  -5.550
  580    HB2  ASP  75           HB2      ASP  75   6.301 -11.913  -5.410
  581    HB3  ASP  75           HB3      ASP  75   7.878 -12.345  -4.755
  582    H    ASP  76           H        ASP  76   9.197  -9.751  -7.970
  583    HA   ASP  76           HA       ASP  76   8.404 -11.787  -9.827
  584    HB2  ASP  76           HB2      ASP  76   9.156  -9.263 -10.202
  585    HB3  ASP  76           HB3      ASP  76  10.738 -10.016 -10.385
  586    H    LEU  77           H        LEU  77   9.684 -13.394 -10.756
  587    HA   LEU  77           HA       LEU  77  11.222 -15.068 -10.799
  588    HB2  LEU  77           HB2      LEU  77  12.717 -13.026 -11.123
  589    HB3  LEU  77           HB3      LEU  77  13.119 -13.179  -9.423
  590    HG   LEU  77           HG       LEU  77  14.002 -15.445  -9.848
  591   HD11  LEU  77          HD11      LEU  77  14.381 -16.128 -12.199
  592   HD12  LEU  77          HD12      LEU  77  13.363 -14.785 -12.718
  593   HD13  LEU  77          HD13      LEU  77  12.677 -16.088 -11.747
  594   HD21  LEU  77          HD21      LEU  77  15.175 -13.278 -11.588
  595   HD22  LEU  77          HD22      LEU  77  16.010 -14.741 -11.065
  596   HD23  LEU  77          HD23      LEU  77  15.511 -13.538  -9.876
  597    H    GLU  78           H        GLU  78   9.469 -14.711  -8.481
  598    HA   GLU  78           HA       GLU  78  10.939 -15.403  -6.129
  599    HB2  GLU  78           HB2      GLU  78   8.777 -14.251  -6.003
  600    HB3  GLU  78           HB3      GLU  78   7.985 -15.643  -6.729
  601    HG2  GLU  78           HG2      GLU  78   7.564 -15.777  -4.422
  602    HG3  GLU  78           HG3      GLU  78   8.800 -16.988  -4.763
  603    H    HIS  79           H        HIS  79  11.993 -17.277  -6.014
  604    HA   HIS  79           HA       HIS  79  10.533 -19.726  -6.737
  605    HB2  HIS  79           HB2      HIS  79  12.808 -20.667  -7.414
  606    HB3  HIS  79           HB3      HIS  79  12.077 -19.503  -8.514
  607    HD1  HIS  79           HD1      HIS  79  14.445 -18.946  -9.455
  608    HD2  HIS  79           HD2      HIS  79  13.928 -18.057  -5.429
  609    HE1  HIS  79           HE1      HIS  79  16.388 -17.474  -8.837
  610    HE2  HIS  79           HE2      HIS  79  16.007 -16.879  -6.419
  611    H    HIS  80           H        HIS  80  10.027 -19.805  -4.462
  612    HA   HIS  80           HA       HIS  80  12.295 -20.418  -2.705
  613    HB2  HIS  80           HB2      HIS  80   9.529 -19.411  -2.264
  614    HB3  HIS  80           HB3      HIS  80  10.244 -20.402  -0.997
  615    HD1  HIS  80           HD1      HIS  80  10.439 -18.447   0.651
  616    HD2  HIS  80           HD2      HIS  80  12.465 -17.829  -2.923
  617    HE1  HIS  80           HE1      HIS  80  11.887 -16.429   1.040
  618    HE2  HIS  80           HE2      HIS  80  13.169 -16.127  -1.107
  619    H    HIS  81           H        HIS  81  11.373 -22.045  -0.856
  620    HA   HIS  81           HA       HIS  81  10.039 -24.309  -2.134
  621    HB2  HIS  81           HB2      HIS  81  12.845 -24.309  -1.071
  622    HB3  HIS  81           HB3      HIS  81  11.879 -25.780  -1.015
  623    HD1  HIS  81           HD1      HIS  81  14.491 -25.187  -2.809
  624    HD2  HIS  81           HD2      HIS  81  10.536 -25.282  -4.078
  625    HE1  HIS  81           HE1      HIS  81  14.587 -25.675  -5.274
  626    HE2  HIS  81           HE2      HIS  81  12.186 -25.642  -6.036
  627    H    HIS  82           H        HIS  82  10.052 -26.188  -0.317
  628    HA   HIS  82           HA       HIS  82   9.519 -25.030   2.310
  629    HB2  HIS  82           HB2      HIS  82   7.409 -25.213   0.732
  630    HB3  HIS  82           HB3      HIS  82   7.469 -26.907   1.208
  631    HD1  HIS  82           HD1      HIS  82   6.700 -27.494   3.555
  632    HD2  HIS  82           HD2      HIS  82   6.845 -23.401   2.856
  633    HE1  HIS  82           HE1      HIS  82   5.551 -26.435   5.525
  634    HE2  HIS  82           HE2      HIS  82   5.729 -23.954   5.123
  635    H    HIS  83           H        HIS  83   9.043 -26.786   3.941
  636    HA   HIS  83           HA       HIS  83  10.855 -29.031   3.424
  637    HB2  HIS  83           HB2      HIS  83   9.720 -28.149   6.081
  638    HB3  HIS  83           HB3      HIS  83  11.069 -29.247   5.807
  639    HD1  HIS  83           HD1      HIS  83  13.351 -28.198   5.222
  640    HD2  HIS  83           HD2      HIS  83  10.324 -25.421   5.847
  641    HE1  HIS  83           HE1      HIS  83  14.509 -25.975   5.417
  642    HE2  HIS  83           HE2      HIS  83  12.665 -24.322   5.883
  643    H    HIS  84           H        HIS  84  10.192 -31.032   4.874
  644    HA   HIS  84           HA       HIS  84   7.502 -31.767   3.981
  645    HB2  HIS  84           HB2      HIS  84   8.219 -34.085   4.325
  646    HB3  HIS  84           HB3      HIS  84   9.352 -33.227   3.284
  647    HD1  HIS  84           HD1      HIS  84   9.107 -35.032   6.494
  648    HD2  HIS  84           HD2      HIS  84  11.863 -32.628   4.520
  649    HE1  HIS  84           HE1      HIS  84  11.283 -35.366   7.710
  650    HE2  HIS  84           HE2      HIS  84  12.915 -33.836   6.551
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1   0.168  10.548 -13.093
    2    H2   MET   1           H2       MET   1   1.255   9.225 -13.008
    3    H3   MET   1           H3       MET   1  -0.224   9.066 -13.865
    4    HA   MET   1           HA       MET   1  -0.146   9.707 -11.009
    5    HB2  MET   1           HB2      MET   1  -2.150   8.729 -13.024
    6    HB3  MET   1           HB3      MET   1  -2.402   8.447 -11.307
    7    HG2  MET   1           HG2      MET   1  -2.060  10.969 -11.038
    8    HG3  MET   1           HG3      MET   1  -2.294  11.048 -12.783
    9    HE1  MET   1           HE1      MET   1  -4.334  12.314 -13.142
   10    HE2  MET   1           HE2      MET   1  -4.320  12.834 -11.457
   11    HE3  MET   1           HE3      MET   1  -5.809  12.226 -12.179
   12    H    GLU   2           H        GLU   2   0.119   7.133 -13.395
   13    HA   GLU   2           HA       GLU   2   0.259   5.092 -11.328
   14    HB2  GLU   2           HB2      GLU   2   0.041   5.109 -14.295
   15    HB3  GLU   2           HB3      GLU   2   0.804   3.712 -13.548
   16    HG2  GLU   2           HG2      GLU   2  -1.443   3.128 -13.763
   17    HG3  GLU   2           HG3      GLU   2  -1.254   3.573 -12.068
   18    H    ASN   3           H        ASN   3   2.193   5.949 -10.325
   19    HA   ASN   3           HA       ASN   3   4.663   5.851 -11.836
   20    HB2  ASN   3           HB2      ASN   3   3.847   6.759  -9.125
   21    HB3  ASN   3           HB3      ASN   3   5.516   6.235  -9.324
   22   HD21  ASN   3          HD21      ASN   3   6.919   7.675 -10.029
   23   HD22  ASN   3          HD22      ASN   3   6.533   9.168 -10.809
   24    H    ASP   4           H        ASP   4   4.671   3.615 -12.390
   25    HA   ASP   4           HA       ASP   4   5.295   1.450 -12.175
   26    HB2  ASP   4           HB2      ASP   4   7.012   2.977 -10.570
   27    HB3  ASP   4           HB3      ASP   4   6.561   1.590  -9.595
   28    HA   PRO   5           HA       PRO   5   2.332  -0.502  -9.546
   29    HB2  PRO   5           HB2      PRO   5   3.141  -3.057  -9.618
   30    HB3  PRO   5           HB3      PRO   5   2.521  -2.241 -11.059
   31    HG2  PRO   5           HG2      PRO   5   5.348  -2.808 -10.270
   32    HG3  PRO   5           HG3      PRO   5   4.586  -2.922 -11.866
   33    HD2  PRO   5           HD2      PRO   5   6.124  -0.797 -11.020
   34    HD3  PRO   5           HD3      PRO   5   4.903  -0.701 -12.299
   35    H    THR   6           H        THR   6   5.634  -0.393  -8.646
   36    HA   THR   6           HA       THR   6   5.213  -1.713  -6.089
   37    HB   THR   6           HB       THR   6   7.569  -1.526  -5.763
   38    HG1  THR   6           HG1      THR   6   7.680   0.166  -8.032
   39   HG21  THR   6          HG21      THR   6   8.213  -1.960  -8.440
   40   HG22  THR   6          HG22      THR   6   6.575  -2.580  -8.236
   41   HG23  THR   6          HG23      THR   6   7.877  -3.171  -7.203
   42    H    VAL   7           H        VAL   7   3.593   0.489  -6.328
   43    HA   VAL   7           HA       VAL   7   4.649   2.187  -4.220
   44    HB   VAL   7           HB       VAL   7   4.100   4.253  -5.273
   45   HG11  VAL   7          HG11      VAL   7   5.861   4.403  -6.763
   46   HG12  VAL   7          HG12      VAL   7   5.550   2.810  -7.453
   47   HG13  VAL   7          HG13      VAL   7   6.280   2.951  -5.854
   48   HG21  VAL   7          HG21      VAL   7   3.345   4.242  -7.665
   49   HG22  VAL   7          HG22      VAL   7   2.167   3.662  -6.487
   50   HG23  VAL   7          HG23      VAL   7   3.060   2.512  -7.475
   51    H    LEU   8           H        LEU   8   2.819   3.861  -3.610
   52    HA   LEU   8           HA       LEU   8   0.158   2.724  -3.889
   53    HB2  LEU   8           HB2      LEU   8   1.652   1.939  -1.745
   54    HB3  LEU   8           HB3      LEU   8   0.828   3.343  -1.092
   55    HG   LEU   8           HG       LEU   8  -0.472   1.418  -0.548
   56   HD11  LEU   8          HD11      LEU   8  -2.535   2.135  -1.250
   57   HD12  LEU   8          HD12      LEU   8  -1.985   2.460  -2.894
   58   HD13  LEU   8          HD13      LEU   8  -1.554   3.562  -1.586
   59   HD21  LEU   8          HD21      LEU   8   0.154   0.647  -3.328
   60   HD22  LEU   8          HD22      LEU   8  -1.449   0.212  -2.736
   61   HD23  LEU   8          HD23      LEU   8  -0.011  -0.348  -1.881
   62    H    ARG   9           H        ARG   9  -1.458   4.216  -3.685
   63    HA   ARG   9           HA       ARG   9  -0.881   6.843  -2.582
   64    HB2  ARG   9           HB2      ARG   9  -1.562   6.373  -5.483
   65    HB3  ARG   9           HB3      ARG   9  -1.810   7.923  -4.692
   66    HG2  ARG   9           HG2      ARG   9   0.492   8.250  -4.369
   67    HG3  ARG   9           HG3      ARG   9   0.863   6.561  -4.719
   68    HD2  ARG   9           HD2      ARG   9   0.133   6.903  -7.042
   69    HD3  ARG   9           HD3      ARG   9  -0.181   8.600  -6.680
   70    HE   ARG   9           HE       ARG   9   2.506   7.773  -6.088
   71   HH11  ARG   9          HH11      ARG   9   0.361   8.955  -8.574
   72   HH12  ARG   9          HH12      ARG   9   1.637   9.636  -9.526
   73   HH21  ARG   9          HH21      ARG   9   4.186   8.668  -7.339
   74   HH22  ARG   9          HH22      ARG   9   3.809   9.473  -8.826
   75    H    SER  10           H        SER  10  -2.683   7.908  -1.856
   76    HA   SER  10           HA       SER  10  -5.011   6.356  -1.393
   77    HB2  SER  10           HB2      SER  10  -4.386   7.979   0.257
   78    HB3  SER  10           HB3      SER  10  -4.404   9.281  -0.932
   79    HG   SER  10           HG       SER  10  -6.304   9.304   0.296
   80    HA   PRO  11           HA       PRO  11  -7.374   7.322  -5.004
   81    HB2  PRO  11           HB2      PRO  11  -9.871   6.851  -4.087
   82    HB3  PRO  11           HB3      PRO  11  -8.712   5.549  -4.386
   83    HG2  PRO  11           HG2      PRO  11  -9.461   6.862  -1.801
   84    HG3  PRO  11           HG3      PRO  11  -9.219   5.141  -2.152
   85    HD2  PRO  11           HD2      PRO  11  -7.331   6.688  -0.954
   86    HD3  PRO  11           HD3      PRO  11  -6.932   5.300  -1.986
   87    H    SER  12           H        SER  12  -8.049   8.913  -1.961
   88    HA   SER  12           HA       SER  12  -8.680  11.366  -3.365
   89    HB2  SER  12           HB2      SER  12 -10.753  11.651  -1.838
   90    HB3  SER  12           HB3      SER  12 -10.906  10.630  -3.268
   91    HG   SER  12           HG       SER  12 -10.604   9.843  -0.569
   92    H    ALA  13           H        ALA  13  -9.162  13.147  -1.651
   93    HA   ALA  13           HA       ALA  13  -6.933  13.159   0.150
   94    HB1  ALA  13           HB1      ALA  13  -7.701  15.161  -1.104
   95    HB2  ALA  13           HB2      ALA  13  -7.549  15.429   0.632
   96    HB3  ALA  13           HB3      ALA  13  -9.142  15.196  -0.088
   97    H    GLY  14           H        GLY  14  -6.913  12.408   2.158
   98    HA2  GLY  14           HA2      GLY  14  -9.341  12.617   3.788
   99    HA3  GLY  14           HA3      GLY  14  -8.621  11.028   3.581
  100    H    LYS  15           H        LYS  15  -7.741  10.522   5.484
  101    HA   LYS  15           HA       LYS  15  -5.491  12.017   6.438
  102    HB2  LYS  15           HB2      LYS  15  -7.582  13.175   7.392
  103    HB3  LYS  15           HB3      LYS  15  -7.763  11.740   8.392
  104    HG2  LYS  15           HG2      LYS  15  -5.091  12.966   8.424
  105    HG3  LYS  15           HG3      LYS  15  -6.387  13.939   9.123
  106    HD2  LYS  15           HD2      LYS  15  -6.234  11.071   9.886
  107    HD3  LYS  15           HD3      LYS  15  -5.026  12.168  10.557
  108    HE2  LYS  15           HE2      LYS  15  -7.958  12.801  10.663
  109    HE3  LYS  15           HE3      LYS  15  -7.189  11.790  11.887
  110    HZ1  LYS  15           HZ1      LYS  15  -6.312  14.541  11.191
  111    HZ2  LYS  15           HZ2      LYS  15  -5.718  13.579  12.449
  112    HZ3  LYS  15           HZ3      LYS  15  -7.307  14.157  12.505
  113    H    LEU  16           H        LEU  16  -4.127  10.768   7.643
  114    HA   LEU  16           HA       LEU  16  -4.520   7.960   7.601
  115    HB2  LEU  16           HB2      LEU  16  -2.320   9.300   7.550
  116    HB3  LEU  16           HB3      LEU  16  -2.481   9.375   9.292
  117    HG   LEU  16           HG       LEU  16  -2.333   6.977   9.477
  118   HD11  LEU  16          HD11      LEU  16  -1.820   5.656   7.369
  119   HD12  LEU  16          HD12      LEU  16  -2.444   7.043   6.476
  120   HD13  LEU  16          HD13      LEU  16  -3.491   6.173   7.596
  121   HD21  LEU  16          HD21      LEU  16  -0.092   6.869   9.215
  122   HD22  LEU  16          HD22      LEU  16  -0.274   8.589   8.871
  123   HD23  LEU  16          HD23      LEU  16  -0.150   7.433   7.545
  124    H    THR  17           H        THR  17  -6.259   7.299   8.796
  125    HA   THR  17           HA       THR  17  -6.723   8.228  11.467
  126    HB   THR  17           HB       THR  17  -8.556   7.518   9.960
  127    HG1  THR  17           HG1      THR  17  -9.022   7.464  12.126
  128   HG21  THR  17          HG21      THR  17  -7.963   4.665  10.534
  129   HG22  THR  17          HG22      THR  17  -7.179   5.447   9.162
  130   HG23  THR  17          HG23      THR  17  -8.939   5.385   9.254
  131    H    GLN  18           H        GLN  18  -5.416   5.260  10.026
  132    HA   GLN  18           HA       GLN  18  -3.836   4.724  12.337
  133    HB2  GLN  18           HB2      GLN  18  -6.414   3.846  12.597
  134    HB3  GLN  18           HB3      GLN  18  -5.627   2.427  11.921
  135    HG2  GLN  18           HG2      GLN  18  -4.569   1.968  13.825
  136    HG3  GLN  18           HG3      GLN  18  -4.111   3.651  14.082
  137   HE21  GLN  18          HE21      GLN  18  -5.152   4.791  15.584
  138   HE22  GLN  18          HE22      GLN  18  -6.552   4.260  16.446
  139    H    TYR  19           H        TYR  19  -3.519   1.938  11.973
  140    HA   TYR  19           HA       TYR  19  -2.879   1.520   9.171
  141    HB2  TYR  19           HB2      TYR  19  -0.510   0.956   9.678
  142    HB3  TYR  19           HB3      TYR  19  -0.882   2.659   9.928
  143    HD1  TYR  19           HD1      TYR  19  -0.070  -0.518  11.578
  144    HD2  TYR  19           HD2      TYR  19  -0.843   3.628  12.142
  145    HE1  TYR  19           HE1      TYR  19   0.810  -0.671  13.869
  146    HE2  TYR  19           HE2      TYR  19   0.037   3.487  14.434
  147    HH   TYR  19           HH       TYR  19   0.241   1.213  16.189
  148    H    THR  20           H        THR  20  -2.812  -0.614   8.603
  149    HA   THR  20           HA       THR  20  -3.626  -2.504  10.676
  150    HB   THR  20           HB       THR  20  -4.465  -3.880   8.937
  151    HG1  THR  20           HG1      THR  20  -3.475  -3.992   7.110
  152   HG21  THR  20          HG21      THR  20  -5.701  -2.256   7.404
  153   HG22  THR  20          HG22      THR  20  -4.946  -0.983   8.363
  154   HG23  THR  20          HG23      THR  20  -6.012  -2.156   9.137
  155    H    VAL  21           H        VAL  21  -0.830  -1.623   8.970
  156    HA   VAL  21           HA       VAL  21   0.567  -3.949  10.016
  157    HB   VAL  21           HB       VAL  21   1.721  -4.404   7.889
  158   HG11  VAL  21          HG11      VAL  21  -0.054  -5.651   6.849
  159   HG12  VAL  21          HG12      VAL  21  -1.273  -4.635   7.618
  160   HG13  VAL  21          HG13      VAL  21  -0.268  -5.703   8.599
  161   HG21  VAL  21          HG21      VAL  21   1.159  -2.060   6.985
  162   HG22  VAL  21          HG22      VAL  21  -0.370  -2.779   6.482
  163   HG23  VAL  21          HG23      VAL  21   1.151  -3.414   5.855
  164    H    GLU  22           H        GLU  22   2.731  -3.602  10.418
  165    HA   GLU  22           HA       GLU  22   3.544  -0.912  10.781
  166    HB2  GLU  22           HB2      GLU  22   5.696  -1.891  11.500
  167    HB3  GLU  22           HB3      GLU  22   4.318  -2.656  12.278
  168    HG2  GLU  22           HG2      GLU  22   4.754  -4.651  11.370
  169    HG3  GLU  22           HG3      GLU  22   5.171  -3.959   9.803
  170    H    ASP  23           H        ASP  23   5.994  -0.449  10.063
  171    HA   ASP  23           HA       ASP  23   5.897   0.141   7.329
  172    HB2  ASP  23           HB2      ASP  23   8.422  -0.077   8.973
  173    HB3  ASP  23           HB3      ASP  23   8.146   0.936   7.559
  174    H    GLY  24           H        GLY  24   6.279  -1.045   5.577
  175    HA2  GLY  24           HA2      GLY  24   7.203  -2.656   4.203
  176    HA3  GLY  24           HA3      GLY  24   8.303  -3.077   5.506
  177    H    GLY  25           H        GLY  25   4.855  -3.045   6.005
  178    HA2  GLY  25           HA2      GLY  25   4.852  -5.746   6.899
  179    HA3  GLY  25           HA3      GLY  25   3.437  -4.729   6.674
  180    H    HIS  26           H        HIS  26   5.016  -7.453   5.610
  181    HA   HIS  26           HA       HIS  26   4.513  -7.448   2.847
  182    HB2  HIS  26           HB2      HIS  26   4.721  -9.900   2.997
  183    HB3  HIS  26           HB3      HIS  26   5.998  -9.081   3.890
  184    HD1  HIS  26           HD1      HIS  26   5.927  -9.252   6.485
  185    HD2  HIS  26           HD2      HIS  26   2.980 -11.437   4.534
  186    HE1  HIS  26           HE1      HIS  26   4.975 -10.799   8.224
  187    HE2  HIS  26           HE2      HIS  26   3.254 -12.172   6.998
  188    H    VAL  27           H        VAL  27   2.655  -7.418   1.785
  189    HA   VAL  27           HA       VAL  27   0.360  -8.890   2.825
  190    HB   VAL  27           HB       VAL  27  -1.174  -7.000   2.416
  191   HG11  VAL  27          HG11      VAL  27  -0.198  -7.514   4.672
  192   HG12  VAL  27          HG12      VAL  27  -0.762  -5.857   4.460
  193   HG13  VAL  27          HG13      VAL  27   0.963  -6.217   4.387
  194   HG21  VAL  27          HG21      VAL  27  -0.367  -5.401   1.062
  195   HG22  VAL  27          HG22      VAL  27   1.309  -5.748   1.489
  196   HG23  VAL  27          HG23      VAL  27   0.325  -4.728   2.538
  197    H    GLU  28           H        GLU  28  -0.898  -9.770   1.255
  198    HA   GLU  28           HA       GLU  28   0.075  -9.582  -1.463
  199    HB2  GLU  28           HB2      GLU  28  -1.338 -11.454  -1.937
  200    HB3  GLU  28           HB3      GLU  28  -0.562 -11.754  -0.389
  201    HG2  GLU  28           HG2      GLU  28  -2.996 -10.428   0.141
  202    HG3  GLU  28           HG3      GLU  28  -3.334 -11.702  -1.029
  203    H    ALA  29           H        ALA  29  -1.442  -9.322  -3.285
  204    HA   ALA  29           HA       ALA  29  -2.705  -6.895  -3.334
  205    HB1  ALA  29           HB1      ALA  29  -2.190  -8.758  -5.193
  206    HB2  ALA  29           HB2      ALA  29  -3.266  -7.387  -5.467
  207    HB3  ALA  29           HB3      ALA  29  -3.935  -8.963  -5.043
  208    H    GLY  30           H        GLY  30  -4.597  -6.070  -2.673
  209    HA2  GLY  30           HA2      GLY  30  -6.918  -6.123  -2.222
  210    HA3  GLY  30           HA3      GLY  30  -6.827  -7.872  -2.084
  211    H    SER  31           H        SER  31  -4.401  -7.553  -0.310
  212    HA   SER  31           HA       SER  31  -5.815  -7.567   2.163
  213    HB2  SER  31           HB2      SER  31  -3.896  -9.000   1.933
  214    HB3  SER  31           HB3      SER  31  -2.859  -7.632   1.527
  215    HG   SER  31           HG       SER  31  -3.038  -6.894   3.617
  216    H    SER  32           H        SER  32  -6.168  -5.975   3.578
  217    HA   SER  32           HA       SER  32  -5.638  -3.281   2.891
  218    HB2  SER  32           HB2      SER  32  -6.316  -3.066   5.485
  219    HB3  SER  32           HB3      SER  32  -7.502  -3.348   4.211
  220    HG   SER  32           HG       SER  32  -7.792  -4.839   5.879
  221    H    TYR  33           H        TYR  33  -4.134  -1.843   3.620
  222    HA   TYR  33           HA       TYR  33  -1.999  -2.935   5.335
  223    HB2  TYR  33           HB2      TYR  33  -0.364  -1.716   4.078
  224    HB3  TYR  33           HB3      TYR  33  -1.354  -2.612   2.932
  225    HD1  TYR  33           HD2      TYR  33  -0.848   0.755   4.412
  226    HD2  TYR  33           HD1      TYR  33  -2.475  -1.499   1.191
  227    HE1  TYR  33           HE2      TYR  33  -1.302   2.840   3.190
  228    HE2  TYR  33           HE1      TYR  33  -2.931   0.580  -0.041
  229    HH   TYR  33           HH       TYR  33  -1.593   3.521   0.755
  230    H    ALA  34           H        ALA  34  -4.333  -0.498   4.964
  231    HA   ALA  34           HA       ALA  34  -3.729   0.687   7.456
  232    HB1  ALA  34           HB1      ALA  34  -3.311   2.656   5.251
  233    HB2  ALA  34           HB2      ALA  34  -1.968   1.650   5.792
  234    HB3  ALA  34           HB3      ALA  34  -2.782   2.722   6.932
  235    H    GLU  35           H        GLU  35  -4.947   3.036   7.421
  236    HA   GLU  35           HA       GLU  35  -7.431   2.820   5.907
  237    HB2  GLU  35           HB2      GLU  35  -7.558   3.238   8.884
  238    HB3  GLU  35           HB3      GLU  35  -8.865   2.836   7.780
  239    HG2  GLU  35           HG2      GLU  35  -8.575   0.801   8.708
  240    HG3  GLU  35           HG3      GLU  35  -7.371   0.668   7.428
  241    H    MET  36           H        MET  36  -8.811   4.784   6.221
  242    HA   MET  36           HA       MET  36  -7.450   7.140   7.217
  243    HB2  MET  36           HB2      MET  36  -7.492   8.361   5.142
  244    HB3  MET  36           HB3      MET  36  -6.607   6.863   4.892
  245    HG2  MET  36           HG2      MET  36  -8.755   5.899   3.976
  246    HG3  MET  36           HG3      MET  36  -9.385   7.545   3.985
  247    HE1  MET  36           HE1      MET  36  -8.828   7.293   0.218
  248    HE2  MET  36           HE2      MET  36  -9.955   7.479   1.562
  249    HE3  MET  36           HE3      MET  36  -9.295   5.889   1.177
  250    H    GLU  37           H        GLU  37  -8.890   8.394   8.196
  251    HA   GLU  37           HA       GLU  37 -11.724   7.906   7.759
  252    HB2  GLU  37           HB2      GLU  37 -10.685   8.061  10.058
  253    HB3  GLU  37           HB3      GLU  37 -10.458   9.779   9.758
  254    HG2  GLU  37           HG2      GLU  37 -12.930   9.944   9.383
  255    HG3  GLU  37           HG3      GLU  37 -13.055   8.279   9.949
  256    H    VAL  38           H        VAL  38 -12.604   8.964   6.107
  257    HA   VAL  38           HA       VAL  38 -11.708  11.657   5.433
  258    HB   VAL  38           HB       VAL  38 -13.922  10.284   3.964
  259   HG11  VAL  38          HG11      VAL  38 -13.568  12.296   2.965
  260   HG12  VAL  38          HG12      VAL  38 -12.380  11.341   2.079
  261   HG13  VAL  38          HG13      VAL  38 -11.868  12.354   3.429
  262   HG21  VAL  38          HG21      VAL  38 -11.001   9.569   3.736
  263   HG22  VAL  38          HG22      VAL  38 -12.227   9.143   2.541
  264   HG23  VAL  38          HG23      VAL  38 -12.331   8.498   4.179
  265    H    MET  39           H        MET  39 -13.549  13.208   4.762
  266    HA   MET  39           HA       MET  39 -15.022  13.887   7.032
  267    HB2  MET  39           HB2      MET  39 -15.706  14.696   4.204
  268    HB3  MET  39           HB3      MET  39 -16.077  15.571   5.683
  269    HG2  MET  39           HG2      MET  39 -13.279  15.192   5.608
  270    HG3  MET  39           HG3      MET  39 -13.781  15.758   4.016
  271    HE1  MET  39           HE1      MET  39 -14.492  17.965   7.988
  272    HE2  MET  39           HE2      MET  39 -13.115  16.885   7.770
  273    HE3  MET  39           HE3      MET  39 -14.757  16.246   7.699
  274    H    LYS  40           H        LYS  40 -15.784  11.786   4.369
  275    HA   LYS  40           HA       LYS  40 -18.606  11.691   4.894
  276    HB2  LYS  40           HB2      LYS  40 -16.715  10.302   3.060
  277    HB3  LYS  40           HB3      LYS  40 -18.242   9.505   3.411
  278    HG2  LYS  40           HG2      LYS  40 -18.877  10.689   1.590
  279    HG3  LYS  40           HG3      LYS  40 -19.196  11.910   2.824
  280    HD2  LYS  40           HD2      LYS  40 -17.108  12.999   2.375
  281    HD3  LYS  40           HD3      LYS  40 -16.607  11.697   1.294
  282    HE2  LYS  40           HE2      LYS  40 -18.957  13.535   0.847
  283    HE3  LYS  40           HE3      LYS  40 -17.380  13.690   0.073
  284    HZ1  LYS  40           HZ1      LYS  40 -17.766  11.372  -0.788
  285    HZ2  LYS  40           HZ2      LYS  40 -18.754  12.574  -1.450
  286    HZ3  LYS  40           HZ3      LYS  40 -19.371  11.527  -0.275
  287    H    MET  41           H        MET  41 -16.304   8.979   4.893
  288    HA   MET  41           HA       MET  41 -17.093   8.215   7.575
  289    HB2  MET  41           HB2      MET  41 -18.014   6.797   5.132
  290    HB3  MET  41           HB3      MET  41 -17.486   5.802   6.482
  291    HG2  MET  41           HG2      MET  41 -19.073   7.257   7.891
  292    HG3  MET  41           HG3      MET  41 -19.770   7.724   6.341
  293    HE1  MET  41           HE1      MET  41 -21.800   6.398   8.353
  294    HE2  MET  41           HE2      MET  41 -20.372   5.808   9.203
  295    HE3  MET  41           HE3      MET  41 -21.593   4.669   8.635
  296    H    ILE  42           H        ILE  42 -16.066   5.811   7.885
  297    HA   ILE  42           HA       ILE  42 -13.235   6.237   7.498
  298    HB   ILE  42           HB       ILE  42 -14.020   5.396   9.646
  299   HG12  ILE  42          HG12      ILE  42 -12.497   3.478   9.885
  300   HG13  ILE  42          HG13      ILE  42 -12.435   3.306   8.134
  301   HG21  ILE  42          HG21      ILE  42 -15.291   3.333   7.937
  302   HG22  ILE  42          HG22      ILE  42 -15.896   4.135   9.386
  303   HG23  ILE  42          HG23      ILE  42 -14.707   2.840   9.526
  304   HD11  ILE  42          HD11      ILE  42 -11.739   5.973   8.755
  305   HD12  ILE  42          HD12      ILE  42 -10.727   4.699   8.075
  306   HD13  ILE  42          HD13      ILE  42 -10.824   4.910   9.823
  307    H    MET  43           H        MET  43 -11.810   4.818   6.434
  308    HA   MET  43           HA       MET  43 -12.960   2.713   4.777
  309    HB2  MET  43           HB2      MET  43 -11.722   5.229   3.748
  310    HB3  MET  43           HB3      MET  43 -11.448   3.733   2.866
  311    HG2  MET  43           HG2      MET  43 -14.225   4.520   3.615
  312    HG3  MET  43           HG3      MET  43 -13.434   5.284   2.237
  313    HE1  MET  43           HE1      MET  43 -14.461   3.077  -0.478
  314    HE2  MET  43           HE2      MET  43 -12.982   3.974  -0.134
  315    HE3  MET  43           HE3      MET  43 -14.549   4.666   0.283
  316    H    THR  44           H        THR  44 -11.329   1.323   3.797
  317    HA   THR  44           HA       THR  44  -8.781   1.382   5.278
  318    HB   THR  44           HB       THR  44  -9.570  -1.253   4.304
  319    HG1  THR  44           HG1      THR  44 -11.649  -0.608   4.770
  320   HG21  THR  44          HG21      THR  44  -8.930  -2.007   6.425
  321   HG22  THR  44          HG22      THR  44  -9.142  -0.412   7.148
  322   HG23  THR  44          HG23      THR  44  -7.809  -0.704   6.030
  323    H    LEU  45           H        LEU  45  -6.961   1.328   4.105
  324    HA   LEU  45           HA       LEU  45  -7.205   1.180   1.207
  325    HB2  LEU  45           HB2      LEU  45  -5.151   2.195   3.112
  326    HB3  LEU  45           HB3      LEU  45  -4.638   1.724   1.504
  327    HG   LEU  45           HG       LEU  45  -5.018   4.068   1.466
  328   HD11  LEU  45          HD11      LEU  45  -7.526   2.960   0.255
  329   HD12  LEU  45          HD12      LEU  45  -5.935   2.603  -0.417
  330   HD13  LEU  45          HD13      LEU  45  -6.500   4.272  -0.326
  331   HD21  LEU  45          HD21      LEU  45  -7.654   4.595   1.943
  332   HD22  LEU  45          HD22      LEU  45  -6.340   4.864   3.087
  333   HD23  LEU  45          HD23      LEU  45  -7.292   3.382   3.170
  334    H    ASN  46           H        ASN  46  -5.999  -0.220  -0.090
  335    HA   ASN  46           HA       ASN  46  -4.641  -2.437   1.272
  336    HB2  ASN  46           HB2      ASN  46  -5.746  -4.010  -0.370
  337    HB3  ASN  46           HB3      ASN  46  -6.811  -3.338   0.861
  338   HD21  ASN  46          HD21      ASN  46  -8.265  -1.675   0.267
  339   HD22  ASN  46          HD22      ASN  46  -8.774  -1.489  -1.374
  340    H    VAL  47           H        VAL  47  -3.589  -3.907  -0.488
  341    HA   VAL  47           HA       VAL  47  -2.022  -2.124  -2.189
  342    HB   VAL  47           HB       VAL  47  -0.590  -4.179  -2.529
  343   HG11  VAL  47          HG11      VAL  47  -0.938  -3.331   0.342
  344   HG12  VAL  47          HG12      VAL  47  -0.107  -2.376  -0.885
  345   HG13  VAL  47          HG13      VAL  47   0.527  -3.954  -0.417
  346   HG21  VAL  47          HG21      VAL  47  -2.595  -5.664  -1.764
  347   HG22  VAL  47          HG22      VAL  47  -1.958  -5.355  -0.149
  348   HG23  VAL  47          HG23      VAL  47  -0.944  -6.136  -1.363
  349    H    GLN  48           H        GLN  48  -1.608  -2.597  -4.400
  350    HA   GLN  48           HA       GLN  48  -3.917  -3.702  -5.752
  351    HB2  GLN  48           HB2      GLN  48  -3.039  -2.726  -7.748
  352    HB3  GLN  48           HB3      GLN  48  -2.828  -1.555  -6.455
  353    HG2  GLN  48           HG2      GLN  48  -0.598  -3.408  -7.175
  354    HG3  GLN  48           HG3      GLN  48  -0.914  -1.974  -8.148
  355   HE21  GLN  48          HE21      GLN  48   0.558  -3.205  -5.376
  356   HE22  GLN  48          HE22      GLN  48   1.033  -1.705  -4.660
  357    H    GLU  49           H        GLU  49  -0.727  -4.698  -4.927
  358    HA   GLU  49           HA       GLU  49  -1.199  -7.281  -6.142
  359    HB2  GLU  49           HB2      GLU  49   1.169  -5.583  -6.947
  360    HB3  GLU  49           HB3      GLU  49   0.994  -7.293  -7.317
  361    HG2  GLU  49           HG2      GLU  49  -1.034  -6.791  -8.605
  362    HG3  GLU  49           HG3      GLU  49  -0.807  -5.076  -8.265
  363    H    ARG  50           H        ARG  50   0.827  -8.722  -5.707
  364    HA   ARG  50           HA       ARG  50   1.211  -8.760  -2.896
  365    HB2  ARG  50           HB2      ARG  50   2.311 -10.363  -5.184
  366    HB3  ARG  50           HB3      ARG  50   2.942 -10.583  -3.558
  367    HG2  ARG  50           HG2      ARG  50   1.335 -12.200  -3.604
  368    HG3  ARG  50           HG3      ARG  50   0.405 -10.851  -2.949
  369    HD2  ARG  50           HD2      ARG  50  -0.938 -11.818  -4.637
  370    HD3  ARG  50           HD3      ARG  50  -0.280 -10.333  -5.322
  371    HE   ARG  50           HE       ARG  50   1.359 -12.574  -5.933
  372   HH11  ARG  50          HH11      ARG  50  -1.611 -10.980  -6.834
  373   HH12  ARG  50          HH12      ARG  50  -1.588 -11.581  -8.457
  374   HH21  ARG  50          HH21      ARG  50   1.392 -13.366  -8.068
  375   HH22  ARG  50          HH22      ARG  50   0.116 -12.936  -9.159
  376    H    GLY  51           H        GLY  51   2.892  -8.113  -1.647
  377    HA2  GLY  51           HA2      GLY  51   5.513  -7.728  -2.239
  378    HA3  GLY  51           HA3      GLY  51   4.760  -6.246  -2.808
  379    H    ARG  52           H        ARG  52   6.556  -5.803  -0.982
  380    HA   ARG  52           HA       ARG  52   5.314  -5.821   1.661
  381    HB2  ARG  52           HB2      ARG  52   8.071  -5.529   0.622
  382    HB3  ARG  52           HB3      ARG  52   7.691  -4.608   2.070
  383    HG2  ARG  52           HG2      ARG  52   8.367  -6.502   3.082
  384    HG3  ARG  52           HG3      ARG  52   6.692  -6.978   2.798
  385    HD2  ARG  52           HD2      ARG  52   8.193  -8.756   2.118
  386    HD3  ARG  52           HD3      ARG  52   7.375  -8.078   0.710
  387    HE   ARG  52           HE       ARG  52   9.691  -6.687   0.804
  388   HH11  ARG  52          HH11      ARG  52   8.958 -10.099   0.843
  389   HH12  ARG  52          HH12      ARG  52  10.433 -10.553   0.059
  390   HH21  ARG  52          HH21      ARG  52  11.633  -7.282  -0.227
  391   HH22  ARG  52          HH22      ARG  52  11.953  -8.954  -0.548
  392    H    VAL  53           H        VAL  53   4.155  -4.149   2.323
  393    HA   VAL  53           HA       VAL  53   4.201  -1.650   0.878
  394    HB   VAL  53           HB       VAL  53   2.645  -2.315   3.379
  395   HG11  VAL  53          HG11      VAL  53   2.787   0.067   2.882
  396   HG12  VAL  53          HG12      VAL  53   1.150  -0.533   2.617
  397   HG13  VAL  53          HG13      VAL  53   2.212  -0.231   1.241
  398   HG21  VAL  53          HG21      VAL  53   1.811  -2.629   0.496
  399   HG22  VAL  53          HG22      VAL  53   0.790  -2.898   1.909
  400   HG23  VAL  53          HG23      VAL  53   2.178  -3.945   1.611
  401    H    LYS  54           H        LYS  54   5.388   0.065   1.371
  402    HA   LYS  54           HA       LYS  54   6.533   0.251   4.081
  403    HB2  LYS  54           HB2      LYS  54   7.696   0.810   1.385
  404    HB3  LYS  54           HB3      LYS  54   8.259   1.747   2.762
  405    HG2  LYS  54           HG2      LYS  54   8.675  -0.499   3.899
  406    HG3  LYS  54           HG3      LYS  54   8.477  -1.205   2.294
  407    HD2  LYS  54           HD2      LYS  54  10.350  -0.069   1.444
  408    HD3  LYS  54           HD3      LYS  54  10.389   1.054   2.805
  409    HE2  LYS  54           HE2      LYS  54  11.008  -0.792   4.297
  410    HE3  LYS  54           HE3      LYS  54  10.986  -1.901   2.926
  411    HZ1  LYS  54           HZ1      LYS  54  12.785   0.446   3.216
  412    HZ2  LYS  54           HZ2      LYS  54  12.773  -0.634   1.914
  413    HZ3  LYS  54           HZ3      LYS  54  13.230  -1.170   3.452
  414    H    TYR  55           H        TYR  55   5.562   1.786   5.217
  415    HA   TYR  55           HA       TYR  55   3.902   3.777   4.193
  416    HB2  TYR  55           HB2      TYR  55   5.213   3.278   6.822
  417    HB3  TYR  55           HB3      TYR  55   4.510   4.868   6.541
  418    HD1  TYR  55           HD1      TYR  55   3.290   1.551   5.375
  419    HD2  TYR  55           HD2      TYR  55   2.625   4.895   7.919
  420    HE1  TYR  55           HE1      TYR  55   1.071   0.664   5.950
  421    HE2  TYR  55           HE2      TYR  55   0.403   4.016   8.502
  422    HH   TYR  55           HH       TYR  55  -0.590   0.839   7.684
  423    H    ILE  56           H        ILE  56   4.216   5.772   3.417
  424    HA   ILE  56           HA       ILE  56   6.974   6.786   3.334
  425    HB   ILE  56           HB       ILE  56   4.688   6.956   1.436
  426   HG12  ILE  56          HG12      ILE  56   6.438   6.627  -0.213
  427   HG13  ILE  56          HG13      ILE  56   7.681   6.886   1.007
  428   HG21  ILE  56          HG21      ILE  56   4.918   9.279   1.766
  429   HG22  ILE  56          HG22      ILE  56   5.839   8.915   0.307
  430   HG23  ILE  56          HG23      ILE  56   6.678   9.174   1.837
  431   HD11  ILE  56          HD11      ILE  56   6.963   4.854   2.157
  432   HD12  ILE  56          HD12      ILE  56   7.442   4.535   0.490
  433   HD13  ILE  56          HD13      ILE  56   5.733   4.596   0.921
  434    H    LYS  57           H        LYS  57   3.619   7.896   3.660
  435    HA   LYS  57           HA       LYS  57   4.339  10.490   4.593
  436    HB2  LYS  57           HB2      LYS  57   1.964   9.092   3.848
  437    HB3  LYS  57           HB3      LYS  57   1.702   9.827   5.425
  438    HG2  LYS  57           HG2      LYS  57   0.998  11.282   3.586
  439    HG3  LYS  57           HG3      LYS  57   2.290  12.003   4.547
  440    HD2  LYS  57           HD2      LYS  57   3.700  10.675   2.625
  441    HD3  LYS  57           HD3      LYS  57   2.263  11.177   1.732
  442    HE2  LYS  57           HE2      LYS  57   3.970  13.024   3.395
  443    HE3  LYS  57           HE3      LYS  57   4.137  12.817   1.652
  444    HZ1  LYS  57           HZ1      LYS  57   1.463  13.433   2.603
  445    HZ2  LYS  57           HZ2      LYS  57   2.291  14.013   1.247
  446    HZ3  LYS  57           HZ3      LYS  57   2.602  14.674   2.772
  447    H    ARG  58           H        ARG  58   3.445  11.291   6.754
  448    HA   ARG  58           HA       ARG  58   4.494   9.534   8.833
  449    HB2  ARG  58           HB2      ARG  58   4.047  12.457   8.550
  450    HB3  ARG  58           HB3      ARG  58   3.925  11.788  10.171
  451    HG2  ARG  58           HG2      ARG  58   6.157  12.568   9.826
  452    HG3  ARG  58           HG3      ARG  58   6.181  10.805   9.885
  453    HD2  ARG  58           HD2      ARG  58   6.202  10.750   7.422
  454    HD3  ARG  58           HD3      ARG  58   6.245  12.512   7.399
  455    HE   ARG  58           HE       ARG  58   8.388  11.862   8.915
  456   HH11  ARG  58          HH11      ARG  58   7.310  10.859   5.751
  457   HH12  ARG  58          HH12      ARG  58   8.912  10.582   5.156
  458   HH21  ARG  58          HH21      ARG  58  10.496  11.498   8.133
  459   HH22  ARG  58          HH22      ARG  58  10.721  10.945   6.508
  460    HA   PRO  59           HA       PRO  59   0.632   8.456  10.648
  461    HB2  PRO  59           HB2      PRO  59   1.065   8.813  13.318
  462    HB3  PRO  59           HB3      PRO  59   1.736   7.462  12.397
  463    HG2  PRO  59           HG2      PRO  59   3.039  10.029  13.216
  464    HG3  PRO  59           HG3      PRO  59   3.695   8.381  13.247
  465    HD2  PRO  59           HD2      PRO  59   4.312  10.137  11.293
  466    HD3  PRO  59           HD3      PRO  59   4.171   8.394  10.986
  467    H    GLY  60           H        GLY  60  -1.239   9.509  10.702
  468    HA2  GLY  60           HA2      GLY  60  -2.817  11.040  11.520
  469    HA3  GLY  60           HA3      GLY  60  -1.514  11.950  12.268
  470    H    ALA  61           H        ALA  61  -0.142  11.683   9.482
  471    HA   ALA  61           HA       ALA  61  -0.667  14.258   8.577
  472    HB1  ALA  61           HB1      ALA  61   1.359  13.050   7.996
  473    HB2  ALA  61           HB2      ALA  61   0.536  13.612   6.541
  474    HB3  ALA  61           HB3      ALA  61   0.424  11.918   7.019
  475    H    VAL  62           H        VAL  62  -1.885  15.106   6.901
  476    HA   VAL  62           HA       VAL  62  -4.348  13.728   6.345
  477    HB   VAL  62           HB       VAL  62  -3.404  16.341   5.163
  478   HG11  VAL  62          HG11      VAL  62  -6.225  15.450   5.690
  479   HG12  VAL  62          HG12      VAL  62  -5.395  15.105   4.172
  480   HG13  VAL  62          HG13      VAL  62  -5.663  16.776   4.671
  481   HG21  VAL  62          HG21      VAL  62  -4.941  15.874   7.718
  482   HG22  VAL  62          HG22      VAL  62  -4.597  17.444   6.991
  483   HG23  VAL  62          HG23      VAL  62  -3.277  16.445   7.599
  484    H    LEU  63           H        LEU  63  -4.785  12.492   4.638
  485    HA   LEU  63           HA       LEU  63  -2.792  12.145   2.575
  486    HB2  LEU  63           HB2      LEU  63  -5.392  10.790   3.225
  487    HB3  LEU  63           HB3      LEU  63  -4.549  10.464   1.723
  488    HG   LEU  63           HG       LEU  63  -3.976   8.743   3.276
  489   HD11  LEU  63          HD11      LEU  63  -1.585  10.540   3.383
  490   HD12  LEU  63          HD12      LEU  63  -2.168   9.902   1.846
  491   HD13  LEU  63          HD13      LEU  63  -1.662   8.797   3.124
  492   HD21  LEU  63          HD21      LEU  63  -2.910  10.794   5.193
  493   HD22  LEU  63          HD22      LEU  63  -3.207   9.077   5.467
  494   HD23  LEU  63          HD23      LEU  63  -4.564  10.190   5.290
  495    H    GLU  64           H        GLU  64  -3.035  12.558   0.394
  496    HA   GLU  64           HA       GLU  64  -5.337  14.246  -0.343
  497    HB2  GLU  64           HB2      GLU  64  -2.580  14.503  -1.534
  498    HB3  GLU  64           HB3      GLU  64  -3.930  15.620  -1.679
  499    HG2  GLU  64           HG2      GLU  64  -3.721  15.889   0.862
  500    HG3  GLU  64           HG3      GLU  64  -2.140  15.133   0.669
  501    H    ALA  65           H        ALA  65  -6.151  14.040  -2.449
  502    HA   ALA  65           HA       ALA  65  -6.164  11.443  -3.512
  503    HB1  ALA  65           HB1      ALA  65  -7.954  13.189  -3.774
  504    HB2  ALA  65           HB2      ALA  65  -7.550  12.297  -5.240
  505    HB3  ALA  65           HB3      ALA  65  -6.941  13.936  -5.009
  506    H    GLY  66           H        GLY  66  -4.165  10.662  -4.069
  507    HA2  GLY  66           HA2      GLY  66  -2.960  10.347  -6.222
  508    HA3  GLY  66           HA3      GLY  66  -2.786  12.095  -6.257
  509    H    CYS  67           H        CYS  67  -2.323  12.000  -3.251
  510    HA   CYS  67           HA       CYS  67   0.494  12.014  -3.341
  511    HB2  CYS  67           HB2      CYS  67  -0.839  13.324  -1.720
  512    HB3  CYS  67           HB3      CYS  67  -1.307  11.828  -0.917
  513    HG   CYS  67           HG       CYS  67   1.226  11.529  -0.236
  514    H    VAL  68           H        VAL  68   2.018  10.601  -2.463
  515    HA   VAL  68           HA       VAL  68   1.279   7.815  -2.605
  516    HB   VAL  68           HB       VAL  68   3.979   8.934  -1.858
  517   HG11  VAL  68          HG11      VAL  68   4.838   6.830  -2.600
  518   HG12  VAL  68          HG12      VAL  68   3.256   6.337  -3.204
  519   HG13  VAL  68          HG13      VAL  68   3.523   6.510  -1.469
  520   HG21  VAL  68          HG21      VAL  68   3.918   9.908  -3.888
  521   HG22  VAL  68          HG22      VAL  68   2.575   8.908  -4.442
  522   HG23  VAL  68          HG23      VAL  68   4.220   8.273  -4.475
  523    H    VAL  69           H        VAL  69   0.233   7.014  -0.888
  524    HA   VAL  69           HA       VAL  69   0.831   7.881   1.800
  525    HB   VAL  69           HB       VAL  69  -0.974   5.612   0.963
  526   HG11  VAL  69          HG11      VAL  69  -0.528   7.138   3.491
  527   HG12  VAL  69          HG12      VAL  69  -0.711   5.402   3.244
  528   HG13  VAL  69          HG13      VAL  69  -2.119   6.460   3.147
  529   HG21  VAL  69          HG21      VAL  69  -1.301   8.510   0.704
  530   HG22  VAL  69          HG22      VAL  69  -2.626   7.707   1.548
  531   HG23  VAL  69          HG23      VAL  69  -2.176   7.193  -0.078
  532    H    ALA  70           H        ALA  70   1.915   5.391  -0.302
  533    HA   ALA  70           HA       ALA  70   3.754   4.416   1.654
  534    HB1  ALA  70           HB1      ALA  70   1.476   3.260   2.117
  535    HB2  ALA  70           HB2      ALA  70   2.951   2.294   2.091
  536    HB3  ALA  70           HB3      ALA  70   1.876   2.300   0.693
  537    H    ARG  71           H        ARG  71   4.580   2.088   0.645
  538    HA   ARG  71           HA       ARG  71   4.875   2.379  -2.247
  539    HB2  ARG  71           HB2      ARG  71   7.026   2.716  -0.227
  540    HB3  ARG  71           HB3      ARG  71   7.428   1.787  -1.665
  541    HG2  ARG  71           HG2      ARG  71   6.250   4.555  -1.731
  542    HG3  ARG  71           HG3      ARG  71   7.979   4.210  -1.803
  543    HD2  ARG  71           HD2      ARG  71   6.528   2.609  -3.713
  544    HD3  ARG  71           HD3      ARG  71   6.180   4.323  -3.938
  545    HE   ARG  71           HE       ARG  71   8.587   2.987  -4.598
  546   HH11  ARG  71          HH11      ARG  71   7.390   6.007  -3.321
  547   HH12  ARG  71          HH12      ARG  71   8.746   6.925  -3.883
  548   HH21  ARG  71          HH21      ARG  71  10.371   4.194  -5.337
  549   HH22  ARG  71          HH22      ARG  71  10.438   5.897  -5.028
  550    H    LEU  72           H        LEU  72   5.064   0.466  -3.311
  551    HA   LEU  72           HA       LEU  72   4.840  -1.949  -1.683
  552    HB2  LEU  72           HB2      LEU  72   3.785  -1.074  -4.218
  553    HB3  LEU  72           HB3      LEU  72   4.610  -2.609  -4.408
  554    HG   LEU  72           HG       LEU  72   2.306  -3.067  -3.989
  555   HD11  LEU  72          HD11      LEU  72   4.168  -4.351  -2.741
  556   HD12  LEU  72          HD12      LEU  72   2.490  -4.588  -2.253
  557   HD13  LEU  72          HD13      LEU  72   3.544  -3.536  -1.307
  558   HD21  LEU  72          HD21      LEU  72   2.196  -0.724  -2.682
  559   HD22  LEU  72          HD22      LEU  72   2.238  -1.832  -1.311
  560   HD23  LEU  72          HD23      LEU  72   0.970  -1.982  -2.527
  561    H    GLU  73           H        GLU  73   6.041  -3.872  -2.246
  562    HA   GLU  73           HA       GLU  73   8.494  -3.451  -3.776
  563    HB2  GLU  73           HB2      GLU  73   8.332  -4.046  -0.851
  564    HB3  GLU  73           HB3      GLU  73   9.643  -4.748  -1.788
  565    HG2  GLU  73           HG2      GLU  73  10.196  -2.429  -2.565
  566    HG3  GLU  73           HG3      GLU  73   9.027  -1.835  -1.387
  567    H    LEU  74           H        LEU  74   7.626  -4.881  -5.304
  568    HA   LEU  74           HA       LEU  74   6.582  -7.424  -4.717
  569    HB2  LEU  74           HB2      LEU  74   7.613  -6.051  -7.139
  570    HB3  LEU  74           HB3      LEU  74   7.504  -7.800  -7.202
  571    HG   LEU  74           HG       LEU  74   5.072  -7.530  -6.480
  572   HD11  LEU  74          HD11      LEU  74   4.030  -5.390  -6.933
  573   HD12  LEU  74          HD12      LEU  74   5.594  -4.692  -7.352
  574   HD13  LEU  74          HD13      LEU  74   5.275  -5.210  -5.697
  575   HD21  LEU  74          HD21      LEU  74   5.825  -6.358  -9.152
  576   HD22  LEU  74          HD22      LEU  74   4.331  -7.195  -8.733
  577   HD23  LEU  74          HD23      LEU  74   5.855  -8.081  -8.777
  578    H    ASP  75           H        ASP  75   7.489  -9.412  -4.506
  579    HA   ASP  75           HA       ASP  75  10.239  -9.549  -3.756
  580    HB2  ASP  75           HB2      ASP  75   8.376 -11.872  -4.269
  581    HB3  ASP  75           HB3      ASP  75   9.819 -11.859  -3.259
  582    H    ASP  76           H        ASP  76   8.430 -10.289  -6.647
  583    HA   ASP  76           HA       ASP  76   9.062 -10.846  -8.756
  584    HB2  ASP  76           HB2      ASP  76  10.704  -8.994  -8.261
  585    HB3  ASP  76           HB3      ASP  76  11.877 -10.243  -7.883
  586    H    LEU  77           H        LEU  77   9.424 -12.716  -6.310
  587    HA   LEU  77           HA       LEU  77  11.366 -14.622  -7.305
  588    HB2  LEU  77           HB2      LEU  77   9.571 -14.511  -4.900
  589    HB3  LEU  77           HB3      LEU  77  10.401 -15.994  -5.335
  590    HG   LEU  77           HG       LEU  77  11.896 -13.418  -4.920
  591   HD11  LEU  77          HD11      LEU  77  11.308 -15.514  -2.836
  592   HD12  LEU  77          HD12      LEU  77  10.582 -13.908  -2.896
  593   HD13  LEU  77          HD13      LEU  77  12.317 -14.082  -2.635
  594   HD21  LEU  77          HD21      LEU  77  13.046 -15.232  -6.098
  595   HD22  LEU  77          HD22      LEU  77  12.718 -16.314  -4.744
  596   HD23  LEU  77          HD23      LEU  77  13.770 -14.915  -4.522
  597    H    GLU  78           H        GLU  78  10.289 -14.977  -9.361
  598    HA   GLU  78           HA       GLU  78   8.642 -17.305  -9.296
  599    HB2  GLU  78           HB2      GLU  78   6.994 -15.427  -8.887
  600    HB3  GLU  78           HB3      GLU  78   7.370 -14.849 -10.505
  601    HG2  GLU  78           HG2      GLU  78   6.315 -16.604 -11.531
  602    HG3  GLU  78           HG3      GLU  78   6.524 -17.679 -10.148
  603    H    HIS  79           H        HIS  79   9.493 -18.483 -10.865
  604    HA   HIS  79           HA       HIS  79  10.022 -17.226 -13.462
  605    HB2  HIS  79           HB2      HIS  79  12.121 -18.640 -13.611
  606    HB3  HIS  79           HB3      HIS  79  12.194 -17.284 -12.492
  607    HD1  HIS  79           HD1      HIS  79  11.144 -20.938 -12.169
  608    HD2  HIS  79           HD2      HIS  79  13.421 -18.057 -10.225
  609    HE1  HIS  79           HE1      HIS  79  12.086 -22.083 -10.138
  610    HE2  HIS  79           HE2      HIS  79  13.529 -20.345  -9.024
  611    H    HIS  80           H        HIS  80  10.806 -19.211 -14.988
  612    HA   HIS  80           HA       HIS  80   8.519 -20.743 -15.449
  613    HB2  HIS  80           HB2      HIS  80  10.057 -22.108 -16.948
  614    HB3  HIS  80           HB3      HIS  80   9.986 -20.380 -17.276
  615    HD1  HIS  80           HD1      HIS  80  12.166 -19.178 -17.342
  616    HD2  HIS  80           HD2      HIS  80  12.462 -22.864 -15.447
  617    HE1  HIS  80           HE1      HIS  80  14.619 -19.511 -16.899
  618    HE2  HIS  80           HE2      HIS  80  14.764 -21.708 -15.674
  619    H    HIS  81           H        HIS  81   7.907 -22.798 -14.939
  620    HA   HIS  81           HA       HIS  81   8.795 -23.925 -12.536
  621    HB2  HIS  81           HB2      HIS  81   6.596 -24.272 -14.004
  622    HB3  HIS  81           HB3      HIS  81   7.489 -25.686 -14.553
  623    HD1  HIS  81           HD1      HIS  81   6.434 -27.586 -13.355
  624    HD2  HIS  81           HD2      HIS  81   7.162 -24.364 -10.834
  625    HE1  HIS  81           HE1      HIS  81   5.829 -28.387 -11.049
  626    HE2  HIS  81           HE2      HIS  81   6.196 -26.393  -9.553
  627    H    HIS  82           H        HIS  82  10.458 -25.194 -12.046
  628    HA   HIS  82           HA       HIS  82  12.091 -26.260 -14.228
  629    HB2  HIS  82           HB2      HIS  82  12.950 -24.827 -12.199
  630    HB3  HIS  82           HB3      HIS  82  12.913 -26.368 -11.350
  631    HD1  HIS  82           HD1      HIS  82  15.086 -27.526 -11.403
  632    HD2  HIS  82           HD2      HIS  82  14.503 -25.206 -14.800
  633    HE1  HIS  82           HE1      HIS  82  17.180 -27.795 -12.768
  634    HE2  HIS  82           HE2      HIS  82  16.769 -26.451 -14.859
  635    H    HIS  83           H        HIS  83  10.573 -27.990 -14.666
  636    HA   HIS  83           HA       HIS  83   9.889 -29.951 -12.752
  637    HB2  HIS  83           HB2      HIS  83   8.677 -29.627 -14.887
  638    HB3  HIS  83           HB3      HIS  83  10.078 -30.243 -15.758
  639    HD1  HIS  83           HD1      HIS  83  10.488 -32.785 -15.699
  640    HD2  HIS  83           HD2      HIS  83   7.139 -31.568 -13.562
  641    HE1  HIS  83           HE1      HIS  83   9.214 -34.892 -15.189
  642    HE2  HIS  83           HE2      HIS  83   7.238 -34.140 -13.819
  643    H    HIS  84           H        HIS  84  10.861 -31.810 -12.125
  644    HA   HIS  84           HA       HIS  84  13.647 -32.063 -12.343
  645    HB2  HIS  84           HB2      HIS  84  11.475 -33.917 -11.401
  646    HB3  HIS  84           HB3      HIS  84  13.152 -34.448 -11.461
  647    HD1  HIS  84           HD1      HIS  84  14.751 -32.342 -10.246
  648    HD2  HIS  84           HD2      HIS  84  10.907 -33.143  -8.887
  649    HE1  HIS  84           HE1      HIS  84  14.661 -31.425  -7.906
  650    HE2  HIS  84           HE2      HIS  84  12.354 -31.998  -7.074
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1   6.716   7.939 -14.977
    2    H2   MET   1           H2       MET   1   6.879   7.340 -16.575
    3    H3   MET   1           H3       MET   1   5.333   7.791 -15.982
    4    HA   MET   1           HA       MET   1   5.357   5.511 -15.902
    5    HB2  MET   1           HB2      MET   1   7.226   4.244 -14.974
    6    HB3  MET   1           HB3      MET   1   7.783   5.295 -16.270
    7    HG2  MET   1           HG2      MET   1   8.522   6.925 -14.546
    8    HG3  MET   1           HG3      MET   1   8.097   5.740 -13.312
    9    HE1  MET   1           HE1      MET   1  12.066   5.944 -13.571
   10    HE2  MET   1           HE2      MET   1  10.814   5.724 -12.348
   11    HE3  MET   1           HE3      MET   1  10.747   7.107 -13.440
   12    H    GLU   2           H        GLU   2   4.318   7.583 -14.272
   13    HA   GLU   2           HA       GLU   2   4.692   6.834 -11.510
   14    HB2  GLU   2           HB2      GLU   2   3.009   8.858 -12.948
   15    HB3  GLU   2           HB3      GLU   2   2.674   8.472 -11.265
   16    HG2  GLU   2           HG2      GLU   2   4.815   9.220 -10.577
   17    HG3  GLU   2           HG3      GLU   2   5.378   9.343 -12.243
   18    H    ASN   3           H        ASN   3   4.042   4.538 -12.399
   19    HA   ASN   3           HA       ASN   3   1.598   3.863 -11.174
   20    HB2  ASN   3           HB2      ASN   3   0.740   4.887 -13.311
   21    HB3  ASN   3           HB3      ASN   3   1.545   3.586 -14.184
   22   HD21  ASN   3          HD21      ASN   3  -0.825   3.438 -14.839
   23   HD22  ASN   3          HD22      ASN   3  -1.797   2.344 -13.920
   24    H    ASP   4           H        ASP   4   1.905   1.886 -10.404
   25    HA   ASP   4           HA       ASP   4   3.015  -0.219 -12.022
   26    HB2  ASP   4           HB2      ASP   4   4.627   1.141  -9.928
   27    HB3  ASP   4           HB3      ASP   4   4.713  -0.617  -9.985
   28    HA   PRO   5           HA       PRO   5   0.435  -2.657  -9.410
   29    HB2  PRO   5           HB2      PRO   5   1.705  -5.059  -9.474
   30    HB3  PRO   5           HB3      PRO   5   0.789  -4.417 -10.842
   31    HG2  PRO   5           HG2      PRO   5   3.743  -4.386 -10.359
   32    HG3  PRO   5           HG3      PRO   5   2.857  -4.742 -11.854
   33    HD2  PRO   5           HD2      PRO   5   4.010  -2.341 -11.391
   34    HD3  PRO   5           HD3      PRO   5   2.512  -2.511 -12.330
   35    H    THR   6           H        THR   6   3.858  -2.478  -8.706
   36    HA   THR   6           HA       THR   6   3.496  -3.525  -6.016
   37    HB   THR   6           HB       THR   6   5.915  -3.321  -5.814
   38    HG1  THR   6           HG1      THR   6   7.091  -2.187  -7.173
   39   HG21  THR   6          HG21      THR   6   6.668  -4.798  -7.549
   40   HG22  THR   6          HG22      THR   6   5.258  -4.414  -8.537
   41   HG23  THR   6          HG23      THR   6   5.060  -5.290  -7.019
   42    H    VAL   7           H        VAL   7   2.017  -1.215  -6.427
   43    HA   VAL   7           HA       VAL   7   3.240   0.539  -4.454
   44    HB   VAL   7           HB       VAL   7   2.125   1.736  -6.982
   45   HG11  VAL   7          HG11      VAL   7   4.022   3.189  -5.258
   46   HG12  VAL   7          HG12      VAL   7   2.431   2.872  -4.564
   47   HG13  VAL   7          HG13      VAL   7   2.571   3.757  -6.084
   48   HG21  VAL   7          HG21      VAL   7   5.024   1.285  -6.274
   49   HG22  VAL   7          HG22      VAL   7   4.431   2.202  -7.660
   50   HG23  VAL   7          HG23      VAL   7   4.130   0.468  -7.556
   51    H    LEU   8           H        LEU   8   1.774   0.892  -2.941
   52    HA   LEU   8           HA       LEU   8  -1.045   0.485  -3.531
   53    HB2  LEU   8           HB2      LEU   8   0.499  -0.164  -1.374
   54    HB3  LEU   8           HB3      LEU   8  -0.285   1.300  -0.811
   55    HG   LEU   8           HG       LEU   8  -1.606  -0.545  -0.085
   56   HD11  LEU   8          HD11      LEU   8  -3.678   0.125  -0.821
   57   HD12  LEU   8          HD12      LEU   8  -3.142   0.325  -2.489
   58   HD13  LEU   8          HD13      LEU   8  -2.688   1.514  -1.267
   59   HD21  LEU   8          HD21      LEU   8  -1.058  -1.558  -2.806
   60   HD22  LEU   8          HD22      LEU   8  -2.642  -1.930  -2.126
   61   HD23  LEU   8          HD23      LEU   8  -1.179  -2.422  -1.273
   62    H    ARG   9           H        ARG   9  -2.624   2.029  -3.381
   63    HA   ARG   9           HA       ARG   9  -1.951   4.714  -2.504
   64    HB2  ARG   9           HB2      ARG   9  -2.964   4.216  -5.308
   65    HB3  ARG   9           HB3      ARG   9  -2.638   5.782  -4.579
   66    HG2  ARG   9           HG2      ARG   9  -0.232   4.894  -4.295
   67    HG3  ARG   9           HG3      ARG   9  -0.709   3.691  -5.495
   68    HD2  ARG   9           HD2      ARG   9  -1.564   5.805  -6.798
   69    HD3  ARG   9           HD3      ARG   9  -0.399   6.643  -5.775
   70    HE   ARG   9           HE       ARG   9   0.801   4.386  -6.980
   71   HH11  ARG   9          HH11      ARG   9  -0.314   7.608  -7.725
   72   HH12  ARG   9          HH12      ARG   9   0.801   7.827  -9.031
   73   HH21  ARG   9          HH21      ARG   9   2.270   4.673  -8.698
   74   HH22  ARG   9          HH22      ARG   9   2.268   6.161  -9.584
   75    H    SER  10           H        SER  10  -3.701   5.871  -1.799
   76    HA   SER  10           HA       SER  10  -6.056   4.425  -1.171
   77    HB2  SER  10           HB2      SER  10  -6.774   6.996  -0.688
   78    HB3  SER  10           HB3      SER  10  -5.802   6.029   0.420
   79    HG   SER  10           HG       SER  10  -4.937   7.961  -1.453
   80    HA   PRO  11           HA       PRO  11  -8.483   5.197  -4.787
   81    HB2  PRO  11           HB2      PRO  11 -10.964   4.827  -3.792
   82    HB3  PRO  11           HB3      PRO  11  -9.830   3.490  -4.017
   83    HG2  PRO  11           HG2      PRO  11 -10.513   4.995  -1.521
   84    HG3  PRO  11           HG3      PRO  11 -10.299   3.250  -1.751
   85    HD2  PRO  11           HD2      PRO  11  -8.370   4.860  -0.704
   86    HD3  PRO  11           HD3      PRO  11  -8.009   3.388  -1.627
   87    H    SER  12           H        SER  12  -9.251   6.926  -1.812
   88    HA   SER  12           HA       SER  12  -9.727   9.347  -3.330
   89    HB2  SER  12           HB2      SER  12 -11.929   9.784  -2.525
   90    HB3  SER  12           HB3      SER  12 -11.956   8.138  -3.156
   91    HG   SER  12           HG       SER  12 -12.139   9.049  -0.530
   92    H    ALA  13           H        ALA  13 -10.567  11.076  -1.525
   93    HA   ALA  13           HA       ALA  13  -8.350  11.288   0.279
   94    HB1  ALA  13           HB1      ALA  13  -9.335  13.432   0.911
   95    HB2  ALA  13           HB2      ALA  13 -10.794  13.034   0.004
   96    HB3  ALA  13           HB3      ALA  13  -9.263  13.255  -0.842
   97    H    GLY  14           H        GLY  14  -8.231  10.529   2.282
   98    HA2  GLY  14           HA2      GLY  14 -10.631  10.405   3.938
   99    HA3  GLY  14           HA3      GLY  14  -9.816   8.882   3.620
  100    H    LYS  15           H        LYS  15  -9.031   8.391   5.599
  101    HA   LYS  15           HA       LYS  15  -6.750   9.854   6.531
  102    HB2  LYS  15           HB2      LYS  15  -8.775  11.088   7.479
  103    HB3  LYS  15           HB3      LYS  15  -9.056   9.657   8.462
  104    HG2  LYS  15           HG2      LYS  15  -6.328  10.760   8.562
  105    HG3  LYS  15           HG3      LYS  15  -7.598  11.766   9.262
  106    HD2  LYS  15           HD2      LYS  15  -7.544   8.873   9.957
  107    HD3  LYS  15           HD3      LYS  15  -6.337   9.932  10.690
  108    HE2  LYS  15           HE2      LYS  15  -9.277  10.560  10.731
  109    HE3  LYS  15           HE3      LYS  15  -8.502   9.586  11.979
  110    HZ1  LYS  15           HZ1      LYS  15  -7.695  12.349  11.251
  111    HZ2  LYS  15           HZ2      LYS  15  -7.063  11.418  12.513
  112    HZ3  LYS  15           HZ3      LYS  15  -8.669  11.946  12.575
  113    H    LEU  16           H        LEU  16  -5.420   8.611   7.796
  114    HA   LEU  16           HA       LEU  16  -5.835   5.806   7.762
  115    HB2  LEU  16           HB2      LEU  16  -3.621   7.094   7.731
  116    HB3  LEU  16           HB3      LEU  16  -3.819   7.246   9.464
  117    HG   LEU  16           HG       LEU  16  -3.684   4.866   9.765
  118   HD11  LEU  16          HD11      LEU  16  -3.176   3.437   7.719
  119   HD12  LEU  16          HD12      LEU  16  -3.809   4.780   6.767
  120   HD13  LEU  16          HD13      LEU  16  -4.845   3.964   7.939
  121   HD21  LEU  16          HD21      LEU  16  -1.447   4.729   9.528
  122   HD22  LEU  16          HD22      LEU  16  -1.604   6.421   9.056
  123   HD23  LEU  16          HD23      LEU  16  -1.492   5.168   7.820
  124    H    THR  17           H        THR  17  -7.600   5.159   8.926
  125    HA   THR  17           HA       THR  17  -8.117   6.109  11.579
  126    HB   THR  17           HB       THR  17  -9.922   5.398  10.043
  127    HG1  THR  17           HG1      THR  17 -10.995   4.992  11.780
  128   HG21  THR  17          HG21      THR  17  -9.347   2.545  10.636
  129   HG22  THR  17          HG22      THR  17  -8.536   3.321   9.276
  130   HG23  THR  17          HG23      THR  17 -10.297   3.263   9.336
  131    H    GLN  18           H        GLN  18  -6.797   3.122  10.193
  132    HA   GLN  18           HA       GLN  18  -5.267   2.600  12.540
  133    HB2  GLN  18           HB2      GLN  18  -7.916   1.581  12.504
  134    HB3  GLN  18           HB3      GLN  18  -6.832   0.215  12.281
  135    HG2  GLN  18           HG2      GLN  18  -6.846   2.185  14.552
  136    HG3  GLN  18           HG3      GLN  18  -7.260   0.472  14.611
  137   HE21  GLN  18          HE21      GLN  18  -5.084   2.385  15.751
  138   HE22  GLN  18          HE22      GLN  18  -3.638   1.455  15.577
  139    H    TYR  19           H        TYR  19  -4.908  -0.169  12.220
  140    HA   TYR  19           HA       TYR  19  -4.237  -0.631   9.431
  141    HB2  TYR  19           HB2      TYR  19  -1.868  -1.161   9.975
  142    HB3  TYR  19           HB3      TYR  19  -2.260   0.542  10.192
  143    HD1  TYR  19           HD1      TYR  19  -1.462  -2.604  11.915
  144    HD2  TYR  19           HD2      TYR  19  -2.230   1.555  12.379
  145    HE1  TYR  19           HE1      TYR  19  -0.606  -2.708  14.218
  146    HE2  TYR  19           HE2      TYR  19  -1.376   1.462  14.683
  147    HH   TYR  19           HH       TYR  19  -1.166  -0.954  16.471
  148    H    THR  20           H        THR  20  -4.130  -2.774   8.900
  149    HA   THR  20           HA       THR  20  -4.955  -4.639  10.991
  150    HB   THR  20           HB       THR  20  -5.747  -6.055   9.260
  151    HG1  THR  20           HG1      THR  20  -4.889  -6.111   7.347
  152   HG21  THR  20          HG21      THR  20  -6.993  -4.478   7.694
  153   HG22  THR  20          HG22      THR  20  -6.262  -3.175   8.632
  154   HG23  THR  20          HG23      THR  20  -7.318  -4.346   9.422
  155    H    VAL  21           H        VAL  21  -2.156  -3.771   9.260
  156    HA   VAL  21           HA       VAL  21  -0.731  -6.036  10.399
  157    HB   VAL  21           HB       VAL  21   0.432  -6.554   8.290
  158   HG11  VAL  21          HG11      VAL  21  -1.362  -7.835   7.269
  159   HG12  VAL  21          HG12      VAL  21  -2.563  -6.850   8.103
  160   HG13  VAL  21          HG13      VAL  21  -1.485  -7.896   9.027
  161   HG21  VAL  21          HG21      VAL  21  -0.070  -4.308   7.249
  162   HG22  VAL  21          HG22      VAL  21  -1.685  -4.926   6.901
  163   HG23  VAL  21          HG23      VAL  21  -0.270  -5.705   6.191
  164    H    GLU  22           H        GLU  22   1.446  -5.662  10.750
  165    HA   GLU  22           HA       GLU  22   2.224  -2.952  11.041
  166    HB2  GLU  22           HB2      GLU  22   4.425  -3.911  11.711
  167    HB3  GLU  22           HB3      GLU  22   3.061  -4.599  12.582
  168    HG2  GLU  22           HG2      GLU  22   3.390  -6.652  11.742
  169    HG3  GLU  22           HG3      GLU  22   3.835  -6.044  10.148
  170    H    ASP  23           H        ASP  23   4.689  -2.518  10.289
  171    HA   ASP  23           HA       ASP  23   4.550  -1.951   7.553
  172    HB2  ASP  23           HB2      ASP  23   6.922  -1.325   7.744
  173    HB3  ASP  23           HB3      ASP  23   5.980  -0.691   9.090
  174    H    GLY  24           H        GLY  24   4.856  -3.176   5.816
  175    HA2  GLY  24           HA2      GLY  24   5.743  -4.804   4.436
  176    HA3  GLY  24           HA3      GLY  24   6.874  -5.215   5.716
  177    H    GLY  25           H        GLY  25   3.430  -5.160   6.271
  178    HA2  GLY  25           HA2      GLY  25   3.416  -7.819   7.254
  179    HA3  GLY  25           HA3      GLY  25   1.999  -6.823   6.954
  180    H    HIS  26           H        HIS  26   3.470  -9.636   6.125
  181    HA   HIS  26           HA       HIS  26   3.141  -9.788   3.339
  182    HB2  HIS  26           HB2      HIS  26   3.100 -12.264   3.712
  183    HB3  HIS  26           HB3      HIS  26   4.460 -11.447   4.477
  184    HD1  HIS  26           HD1      HIS  26   4.510 -11.389   7.057
  185    HD2  HIS  26           HD2      HIS  26   1.244 -13.410   5.471
  186    HE1  HIS  26           HE1      HIS  26   3.488 -12.635   8.988
  187    HE2  HIS  26           HE2      HIS  26   1.566 -13.919   7.986
  188    H    VAL  27           H        VAL  27   1.353  -9.669   2.175
  189    HA   VAL  27           HA       VAL  27  -1.076 -10.983   3.113
  190    HB   VAL  27           HB       VAL  27  -2.494  -9.044   2.623
  191   HG11  VAL  27          HG11      VAL  27  -1.612  -9.497   4.920
  192   HG12  VAL  27          HG12      VAL  27  -2.064  -7.819   4.624
  193   HG13  VAL  27          HG13      VAL  27  -0.364  -8.289   4.614
  194   HG21  VAL  27          HG21      VAL  27  -0.971  -7.948   1.015
  195   HG22  VAL  27          HG22      VAL  27   0.077  -7.488   2.357
  196   HG23  VAL  27          HG23      VAL  27  -1.562  -6.844   2.257
  197    H    GLU  28           H        GLU  28  -2.241 -11.880   1.502
  198    HA   GLU  28           HA       GLU  28  -1.147 -11.745  -1.176
  199    HB2  GLU  28           HB2      GLU  28  -2.587 -13.601  -1.684
  200    HB3  GLU  28           HB3      GLU  28  -1.837 -13.901  -0.123
  201    HG2  GLU  28           HG2      GLU  28  -4.278 -12.538   0.335
  202    HG3  GLU  28           HG3      GLU  28  -4.590 -13.855  -0.795
  203    H    ALA  29           H        ALA  29  -2.633 -11.536  -3.058
  204    HA   ALA  29           HA       ALA  29  -3.843  -9.084  -3.205
  205    HB1  ALA  29           HB1      ALA  29  -4.461  -9.639  -5.327
  206    HB2  ALA  29           HB2      ALA  29  -5.025 -11.244  -4.863
  207    HB3  ALA  29           HB3      ALA  29  -3.297 -10.929  -5.023
  208    H    GLY  30           H        GLY  30  -5.635  -8.210  -2.399
  209    HA2  GLY  30           HA2      GLY  30  -8.003  -8.201  -2.065
  210    HA3  GLY  30           HA3      GLY  30  -7.947  -9.946  -1.869
  211    H    SER  31           H        SER  31  -5.551  -9.658  -0.079
  212    HA   SER  31           HA       SER  31  -6.989  -9.530   2.377
  213    HB2  SER  31           HB2      SER  31  -4.071  -9.842   1.691
  214    HB3  SER  31           HB3      SER  31  -4.619  -9.712   3.362
  215    HG   SER  31           HG       SER  31  -5.699 -11.600   3.169
  216    H    SER  32           H        SER  32  -7.407  -7.826   3.612
  217    HA   SER  32           HA       SER  32  -6.631  -5.209   2.866
  218    HB2  SER  32           HB2      SER  32  -7.610  -4.653   5.201
  219    HB3  SER  32           HB3      SER  32  -8.689  -5.326   3.979
  220    HG   SER  32           HG       SER  32  -8.593  -6.265   6.254
  221    H    TYR  33           H        TYR  33  -5.122  -3.831   3.681
  222    HA   TYR  33           HA       TYR  33  -3.162  -5.000   5.544
  223    HB2  TYR  33           HB2      TYR  33  -1.447  -3.698   4.462
  224    HB3  TYR  33           HB3      TYR  33  -2.336  -4.582   3.226
  225    HD1  TYR  33           HD1      TYR  33  -3.809  -3.401   1.670
  226    HD2  TYR  33           HD2      TYR  33  -1.550  -1.289   4.592
  227    HE1  TYR  33           HE1      TYR  33  -4.226  -1.299   0.465
  228    HE2  TYR  33           HE2      TYR  33  -1.961   0.819   3.395
  229    HH   TYR  33           HH       TYR  33  -2.515   1.439   0.895
  230    H    ALA  34           H        ALA  34  -5.465  -2.554   5.153
  231    HA   ALA  34           HA       ALA  34  -5.000  -1.467   7.721
  232    HB1  ALA  34           HB1      ALA  34  -4.532   0.625   5.657
  233    HB2  ALA  34           HB2      ALA  34  -3.190  -0.423   6.119
  234    HB3  ALA  34           HB3      ALA  34  -4.003   0.557   7.338
  235    H    GLU  35           H        GLU  35  -6.210   0.940   7.608
  236    HA   GLU  35           HA       GLU  35  -8.637   0.688   6.015
  237    HB2  GLU  35           HB2      GLU  35  -8.909   1.123   8.977
  238    HB3  GLU  35           HB3      GLU  35 -10.146   0.661   7.816
  239    HG2  GLU  35           HG2      GLU  35  -8.749  -1.493   7.541
  240    HG3  GLU  35           HG3      GLU  35  -8.015  -1.014   9.071
  241    H    MET  36           H        MET  36 -10.032   2.637   6.226
  242    HA   MET  36           HA       MET  36  -8.760   5.010   7.296
  243    HB2  MET  36           HB2      MET  36  -8.713   6.223   5.203
  244    HB3  MET  36           HB3      MET  36  -7.755   4.758   5.048
  245    HG2  MET  36           HG2      MET  36  -9.978   3.765   4.094
  246    HG3  MET  36           HG3      MET  36 -10.363   5.460   3.800
  247    HE1  MET  36           HE1      MET  36  -8.309   6.954   1.671
  248    HE2  MET  36           HE2      MET  36  -9.974   6.608   2.140
  249    HE3  MET  36           HE3      MET  36  -9.350   6.015   0.601
  250    H    GLU  37           H        GLU  37 -10.248   6.359   8.079
  251    HA   GLU  37           HA       GLU  37 -13.054   5.788   7.558
  252    HB2  GLU  37           HB2      GLU  37 -12.226   6.092   9.881
  253    HB3  GLU  37           HB3      GLU  37 -11.817   7.757   9.491
  254    HG2  GLU  37           HG2      GLU  37 -14.279   8.024   8.866
  255    HG3  GLU  37           HG3      GLU  37 -14.525   6.498   9.713
  256    H    VAL  38           H        VAL  38 -14.333   6.970   6.303
  257    HA   VAL  38           HA       VAL  38 -13.643   9.738   5.693
  258    HB   VAL  38           HB       VAL  38 -12.591   8.388   3.912
  259   HG11  VAL  38          HG11      VAL  38 -14.007   7.192   2.300
  260   HG12  VAL  38          HG12      VAL  38 -15.411   7.495   3.324
  261   HG13  VAL  38          HG13      VAL  38 -14.092   6.483   3.912
  262   HG21  VAL  38          HG21      VAL  38 -14.964   9.888   2.824
  263   HG22  VAL  38          HG22      VAL  38 -13.374   9.689   2.086
  264   HG23  VAL  38          HG23      VAL  38 -13.558  10.683   3.531
  265    H    MET  39           H        MET  39 -15.396  10.961   4.848
  266    HA   MET  39           HA       MET  39 -17.556  11.679   5.277
  267    HB2  MET  39           HB2      MET  39 -17.812   9.428   3.289
  268    HB3  MET  39           HB3      MET  39 -19.117  10.549   3.649
  269    HG2  MET  39           HG2      MET  39 -17.547  12.405   2.999
  270    HG3  MET  39           HG3      MET  39 -16.454  11.157   2.403
  271    HE1  MET  39           HE1      MET  39 -20.422  11.309   2.269
  272    HE2  MET  39           HE2      MET  39 -20.639  12.062   0.689
  273    HE3  MET  39           HE3      MET  39 -19.868  12.961   1.996
  274    H    LYS  40           H        LYS  40 -16.819   9.888   7.361
  275    HA   LYS  40           HA       LYS  40 -17.885   9.028   9.190
  276    HB2  LYS  40           HB2      LYS  40 -20.455   8.858   7.635
  277    HB3  LYS  40           HB3      LYS  40 -20.238   8.954   9.376
  278    HG2  LYS  40           HG2      LYS  40 -19.093  11.243   8.020
  279    HG3  LYS  40           HG3      LYS  40 -20.809  11.046   7.662
  280    HD2  LYS  40           HD2      LYS  40 -21.440  11.353   9.853
  281    HD3  LYS  40           HD3      LYS  40 -19.888  10.801  10.487
  282    HE2  LYS  40           HE2      LYS  40 -19.550  13.000  10.847
  283    HE3  LYS  40           HE3      LYS  40 -19.102  13.000   9.141
  284    HZ1  LYS  40           HZ1      LYS  40 -21.368  13.647   8.589
  285    HZ2  LYS  40           HZ2      LYS  40 -20.660  14.771   9.636
  286    HZ3  LYS  40           HZ3      LYS  40 -21.787  13.658  10.229
  287    H    MET  41           H        MET  41 -18.067   7.544   6.075
  288    HA   MET  41           HA       MET  41 -18.770   4.948   7.177
  289    HB2  MET  41           HB2      MET  41 -19.341   6.073   4.788
  290    HB3  MET  41           HB3      MET  41 -17.898   5.165   4.359
  291    HG2  MET  41           HG2      MET  41 -19.627   3.697   3.899
  292    HG3  MET  41           HG3      MET  41 -19.050   3.174   5.481
  293    HE1  MET  41           HE1      MET  41 -22.693   2.367   6.108
  294    HE2  MET  41           HE2      MET  41 -21.065   1.791   5.750
  295    HE3  MET  41           HE3      MET  41 -22.127   2.305   4.439
  296    H    ILE  42           H        ILE  42 -17.390   3.310   7.532
  297    HA   ILE  42           HA       ILE  42 -14.557   3.884   7.477
  298    HB   ILE  42           HB       ILE  42 -15.479   2.745   9.419
  299   HG12  ILE  42          HG12      ILE  42 -13.922   0.836   9.535
  300   HG13  ILE  42          HG13      ILE  42 -13.700   0.914   7.790
  301   HG21  ILE  42          HG21      ILE  42 -17.332   1.573   8.567
  302   HG22  ILE  42          HG22      ILE  42 -16.212   0.334   9.131
  303   HG23  ILE  42          HG23      ILE  42 -16.341   0.687   7.408
  304   HD11  ILE  42          HD11      ILE  42 -13.148   3.482   8.801
  305   HD12  ILE  42          HD12      ILE  42 -12.026   2.315   8.102
  306   HD13  ILE  42          HD13      ILE  42 -12.322   2.321   9.840
  307    H    MET  43           H        MET  43 -12.979   2.616   6.407
  308    HA   MET  43           HA       MET  43 -13.908   0.758   4.360
  309    HB2  MET  43           HB2      MET  43 -12.526   3.362   3.835
  310    HB3  MET  43           HB3      MET  43 -12.236   1.995   2.768
  311    HG2  MET  43           HG2      MET  43 -14.473   1.915   2.079
  312    HG3  MET  43           HG3      MET  43 -15.006   2.941   3.409
  313    HE1  MET  43           HE1      MET  43 -15.821   5.384   0.576
  314    HE2  MET  43           HE2      MET  43 -16.248   4.906   2.219
  315    HE3  MET  43           HE3      MET  43 -16.256   3.710   0.922
  316    H    THR  44           H        THR  44 -12.273  -0.629   3.538
  317    HA   THR  44           HA       THR  44  -9.830  -0.692   5.187
  318    HB   THR  44           HB       THR  44 -10.592  -3.261   4.038
  319    HG1  THR  44           HG1      THR  44 -12.671  -2.854   4.387
  320   HG21  THR  44          HG21      THR  44  -8.951  -2.870   5.894
  321   HG22  THR  44          HG22      THR  44 -10.165  -4.114   6.193
  322   HG23  THR  44          HG23      THR  44 -10.333  -2.523   6.934
  323    H    LEU  45           H        LEU  45  -7.943  -0.695   4.140
  324    HA   LEU  45           HA       LEU  45  -7.982  -0.757   1.225
  325    HB2  LEU  45           HB2      LEU  45  -5.722  -0.094   3.114
  326    HB3  LEU  45           HB3      LEU  45  -5.703   0.112   1.373
  327    HG   LEU  45           HG       LEU  45  -7.820   1.636   1.899
  328   HD11  LEU  45          HD11      LEU  45  -6.407   1.318   4.485
  329   HD12  LEU  45          HD12      LEU  45  -8.114   1.614   4.151
  330   HD13  LEU  45          HD13      LEU  45  -6.952   2.937   4.045
  331   HD21  LEU  45          HD21      LEU  45  -5.345   2.084   1.007
  332   HD22  LEU  45          HD22      LEU  45  -5.244   2.941   2.545
  333   HD23  LEU  45          HD23      LEU  45  -6.480   3.385   1.368
  334    H    ASN  46           H        ASN  46  -7.088  -2.333   0.009
  335    HA   ASN  46           HA       ASN  46  -5.547  -4.429   1.382
  336    HB2  ASN  46           HB2      ASN  46  -6.752  -5.978  -0.388
  337    HB3  ASN  46           HB3      ASN  46  -7.514  -5.606   1.153
  338   HD21  ASN  46          HD21      ASN  46  -7.211  -4.044  -2.024
  339   HD22  ASN  46          HD22      ASN  46  -8.891  -3.679  -2.191
  340    H    VAL  47           H        VAL  47  -4.566  -5.964  -0.367
  341    HA   VAL  47           HA       VAL  47  -3.109  -4.236  -2.213
  342    HB   VAL  47           HB       VAL  47  -1.662  -6.267  -2.544
  343   HG11  VAL  47          HG11      VAL  47  -1.753  -5.677   0.375
  344   HG12  VAL  47          HG12      VAL  47  -1.434  -4.362  -0.756
  345   HG13  VAL  47          HG13      VAL  47  -0.369  -5.767  -0.714
  346   HG21  VAL  47          HG21      VAL  47  -3.637  -7.754  -1.664
  347   HG22  VAL  47          HG22      VAL  47  -2.895  -7.437  -0.096
  348   HG23  VAL  47          HG23      VAL  47  -1.960  -8.219  -1.371
  349    H    GLN  48           H        GLN  48  -2.849  -4.729  -4.424
  350    HA   GLN  48           HA       GLN  48  -5.188  -5.962  -5.605
  351    HB2  GLN  48           HB2      GLN  48  -4.502  -4.980  -7.662
  352    HB3  GLN  48           HB3      GLN  48  -4.225  -3.782  -6.408
  353    HG2  GLN  48           HG2      GLN  48  -2.011  -5.581  -7.307
  354    HG3  GLN  48           HG3      GLN  48  -2.439  -4.142  -8.229
  355   HE21  GLN  48          HE21      GLN  48  -0.757  -5.378  -5.566
  356   HE22  GLN  48          HE22      GLN  48  -0.241  -3.876  -4.885
  357    H    GLU  49           H        GLU  49  -2.050  -6.941  -4.777
  358    HA   GLU  49           HA       GLU  49  -2.447  -9.478  -6.107
  359    HB2  GLU  49           HB2      GLU  49  -0.172  -7.633  -6.812
  360    HB3  GLU  49           HB3      GLU  49  -0.074  -9.371  -7.057
  361    HG2  GLU  49           HG2      GLU  49  -2.259  -9.093  -8.383
  362    HG3  GLU  49           HG3      GLU  49  -1.849  -7.378  -8.406
  363    H    ARG  50           H        ARG  50  -0.389 -10.901  -5.638
  364    HA   ARG  50           HA       ARG  50  -0.172 -11.069  -2.815
  365    HB2  ARG  50           HB2      ARG  50   1.026 -12.541  -5.126
  366    HB3  ARG  50           HB3      ARG  50   1.705 -12.776  -3.521
  367    HG2  ARG  50           HG2      ARG  50   0.162 -14.490  -3.705
  368    HG3  ARG  50           HG3      ARG  50  -0.715 -13.257  -2.797
  369    HD2  ARG  50           HD2      ARG  50  -2.246 -13.967  -4.410
  370    HD3  ARG  50           HD3      ARG  50  -1.587 -12.473  -5.074
  371    HE   ARG  50           HE       ARG  50  -0.771 -13.682  -6.823
  372   HH11  ARG  50          HH11      ARG  50  -1.342 -15.864  -4.160
  373   HH12  ARG  50          HH12      ARG  50  -0.955 -17.282  -5.075
  374   HH21  ARG  50          HH21      ARG  50  -0.262 -15.546  -8.029
  375   HH22  ARG  50          HH22      ARG  50  -0.342 -17.102  -7.271
  376    H    GLY  51           H        GLY  51   1.384 -10.401  -1.437
  377    HA2  GLY  51           HA2      GLY  51   4.018  -9.948  -1.747
  378    HA3  GLY  51           HA3      GLY  51   3.320  -8.494  -2.445
  379    H    ARG  52           H        ARG  52   4.947  -8.124  -0.369
  380    HA   ARG  52           HA       ARG  52   3.335  -7.977   2.059
  381    HB2  ARG  52           HB2      ARG  52   6.234  -7.836   1.435
  382    HB3  ARG  52           HB3      ARG  52   5.667  -6.945   2.842
  383    HG2  ARG  52           HG2      ARG  52   4.978  -8.867   3.941
  384    HG3  ARG  52           HG3      ARG  52   4.926  -9.815   2.453
  385    HD2  ARG  52           HD2      ARG  52   7.413  -8.759   3.781
  386    HD3  ARG  52           HD3      ARG  52   6.830 -10.420   3.867
  387    HE   ARG  52           HE       ARG  52   8.303  -9.235   1.740
  388   HH11  ARG  52          HH11      ARG  52   5.829 -11.597   2.433
  389   HH12  ARG  52          HH12      ARG  52   6.158 -12.541   1.019
  390   HH21  ARG  52          HH21      ARG  52   8.737 -10.475  -0.121
  391   HH22  ARG  52          HH22      ARG  52   7.809 -11.905  -0.431
  392    H    VAL  53           H        VAL  53   2.456  -6.153   2.813
  393    HA   VAL  53           HA       VAL  53   2.604  -3.764   1.202
  394    HB   VAL  53           HB       VAL  53   1.143  -4.151   3.817
  395   HG11  VAL  53          HG11      VAL  53   1.619  -1.836   2.490
  396   HG12  VAL  53          HG12      VAL  53   0.209  -2.130   3.507
  397   HG13  VAL  53          HG13      VAL  53   0.095  -2.336   1.759
  398   HG21  VAL  53          HG21      VAL  53   0.687  -5.598   1.541
  399   HG22  VAL  53          HG22      VAL  53  -0.422  -4.240   1.350
  400   HG23  VAL  53          HG23      VAL  53  -0.511  -5.255   2.789
  401    H    LYS  54           H        LYS  54   3.827  -2.030   1.563
  402    HA   LYS  54           HA       LYS  54   5.223  -1.830   4.151
  403    HB2  LYS  54           HB2      LYS  54   6.219  -0.652   1.563
  404    HB3  LYS  54           HB3      LYS  54   7.113  -0.912   3.054
  405    HG2  LYS  54           HG2      LYS  54   6.627  -3.417   2.624
  406    HG3  LYS  54           HG3      LYS  54   6.300  -2.892   0.971
  407    HD2  LYS  54           HD2      LYS  54   8.854  -2.402   2.503
  408    HD3  LYS  54           HD3      LYS  54   8.624  -3.620   1.246
  409    HE2  LYS  54           HE2      LYS  54   8.340  -1.975  -0.428
  410    HE3  LYS  54           HE3      LYS  54   8.164  -0.688   0.764
  411    HZ1  LYS  54           HZ1      LYS  54  10.352  -0.685  -0.298
  412    HZ2  LYS  54           HZ2      LYS  54  10.651  -2.242   0.291
  413    HZ3  LYS  54           HZ3      LYS  54  10.470  -0.952   1.369
  414    H    TYR  55           H        TYR  55   4.261  -0.315   5.334
  415    HA   TYR  55           HA       TYR  55   2.623   1.732   4.391
  416    HB2  TYR  55           HB2      TYR  55   4.009   1.173   6.971
  417    HB3  TYR  55           HB3      TYR  55   3.320   2.775   6.732
  418    HD1  TYR  55           HD1      TYR  55   2.018  -0.510   5.565
  419    HD2  TYR  55           HD2      TYR  55   1.479   2.809   8.170
  420    HE1  TYR  55           HE1      TYR  55  -0.194  -1.376   6.199
  421    HE2  TYR  55           HE2      TYR  55  -0.735   1.953   8.813
  422    HH   TYR  55           HH       TYR  55  -1.799  -1.201   7.977
  423    H    ILE  56           H        ILE  56   2.955   3.732   3.645
  424    HA   ILE  56           HA       ILE  56   5.731   4.683   3.472
  425    HB   ILE  56           HB       ILE  56   3.371   4.956   1.677
  426   HG12  ILE  56          HG12      ILE  56   5.023   4.587  -0.053
  427   HG13  ILE  56          HG13      ILE  56   6.335   4.809   1.099
  428   HG21  ILE  56          HG21      ILE  56   4.581   6.894   0.534
  429   HG22  ILE  56          HG22      ILE  56   5.429   7.107   2.066
  430   HG23  ILE  56          HG23      ILE  56   3.673   7.257   2.002
  431   HD11  ILE  56          HD11      ILE  56   4.339   2.560   1.083
  432   HD12  ILE  56          HD12      ILE  56   5.618   2.785   2.277
  433   HD13  ILE  56          HD13      ILE  56   6.030   2.470   0.591
  434    H    LYS  57           H        LYS  57   2.430   5.943   3.846
  435    HA   LYS  57           HA       LYS  57   3.289   8.453   4.881
  436    HB2  LYS  57           HB2      LYS  57   0.828   7.194   4.102
  437    HB3  LYS  57           HB3      LYS  57   0.616   7.981   5.660
  438    HG2  LYS  57           HG2      LYS  57   1.630   9.283   3.141
  439    HG3  LYS  57           HG3      LYS  57   0.019   9.468   3.836
  440    HD2  LYS  57           HD2      LYS  57   1.101  10.380   5.898
  441    HD3  LYS  57           HD3      LYS  57   2.642  10.349   5.037
  442    HE2  LYS  57           HE2      LYS  57   0.247  11.770   3.919
  443    HE3  LYS  57           HE3      LYS  57   1.319  12.551   5.082
  444    HZ1  LYS  57           HZ1      LYS  57   1.920  13.045   2.778
  445    HZ2  LYS  57           HZ2      LYS  57   2.178  11.400   2.482
  446    HZ3  LYS  57           HZ3      LYS  57   3.162  12.224   3.582
  447    H    ARG  58           H        ARG  58   2.305   9.207   7.060
  448    HA   ARG  58           HA       ARG  58   3.286   7.358   9.092
  449    HB2  ARG  58           HB2      ARG  58   2.894  10.292   8.904
  450    HB3  ARG  58           HB3      ARG  58   2.685   9.575  10.495
  451    HG2  ARG  58           HG2      ARG  58   4.921  10.185  10.460
  452    HG3  ARG  58           HG3      ARG  58   4.960   8.464  10.070
  453    HD2  ARG  58           HD2      ARG  58   6.451   9.743   8.616
  454    HD3  ARG  58           HD3      ARG  58   5.146   8.990   7.700
  455    HE   ARG  58           HE       ARG  58   4.349  11.579   8.384
  456   HH11  ARG  58          HH11      ARG  58   6.726   9.993   6.380
  457   HH12  ARG  58          HH12      ARG  58   6.801  11.285   5.230
  458   HH21  ARG  58          HH21      ARG  58   4.447  13.279   6.872
  459   HH22  ARG  58          HH22      ARG  58   5.508  13.151   5.509
  460    HA   PRO  59           HA       PRO  59  -0.623   6.255  10.789
  461    HB2  PRO  59           HB2      PRO  59  -0.277   6.579  13.477
  462    HB3  PRO  59           HB3      PRO  59   0.421   5.239  12.560
  463    HG2  PRO  59           HG2      PRO  59   1.701   7.793  13.455
  464    HG3  PRO  59           HG3      PRO  59   2.353   6.144  13.483
  465    HD2  PRO  59           HD2      PRO  59   3.035   7.924  11.575
  466    HD3  PRO  59           HD3      PRO  59   2.898   6.186  11.238
  467    H    GLY  60           H        GLY  60  -2.505   7.291  10.824
  468    HA2  GLY  60           HA2      GLY  60  -4.105   8.810  11.628
  469    HA3  GLY  60           HA3      GLY  60  -2.816   9.731  12.388
  470    H    ALA  61           H        ALA  61  -1.406   9.467   9.626
  471    HA   ALA  61           HA       ALA  61  -1.930  12.034   8.702
  472    HB1  ALA  61           HB1      ALA  61   0.103  10.819   8.147
  473    HB2  ALA  61           HB2      ALA  61  -0.702  11.386   6.684
  474    HB3  ALA  61           HB3      ALA  61  -0.824   9.691   7.158
  475    H    VAL  62           H        VAL  62  -3.151  12.880   7.036
  476    HA   VAL  62           HA       VAL  62  -5.593  11.480   6.447
  477    HB   VAL  62           HB       VAL  62  -6.236  13.505   5.214
  478   HG11  VAL  62          HG11      VAL  62  -6.611  13.415   7.616
  479   HG12  VAL  62          HG12      VAL  62  -6.220  15.059   7.111
  480   HG13  VAL  62          HG13      VAL  62  -4.998  14.067   7.907
  481   HG21  VAL  62          HG21      VAL  62  -3.425  14.405   5.832
  482   HG22  VAL  62          HG22      VAL  62  -4.709  15.472   5.264
  483   HG23  VAL  62          HG23      VAL  62  -4.141  14.153   4.240
  484    H    LEU  63           H        LEU  63  -6.013  10.264   4.723
  485    HA   LEU  63           HA       LEU  63  -4.000   9.947   2.673
  486    HB2  LEU  63           HB2      LEU  63  -6.685   8.615   2.642
  487    HB3  LEU  63           HB3      LEU  63  -5.160   8.029   2.005
  488    HG   LEU  63           HG       LEU  63  -5.939   8.213   4.915
  489   HD11  LEU  63          HD11      LEU  63  -5.633   5.739   4.793
  490   HD12  LEU  63          HD12      LEU  63  -5.503   5.896   3.042
  491   HD13  LEU  63          HD13      LEU  63  -6.997   6.353   3.859
  492   HD21  LEU  63          HD21      LEU  63  -3.509   8.726   4.350
  493   HD22  LEU  63          HD22      LEU  63  -3.395   7.047   3.824
  494   HD23  LEU  63          HD23      LEU  63  -3.807   7.421   5.498
  495    H    GLU  64           H        GLU  64  -4.173  10.479   0.532
  496    HA   GLU  64           HA       GLU  64  -6.488  12.142  -0.205
  497    HB2  GLU  64           HB2      GLU  64  -4.749  13.660  -0.235
  498    HB3  GLU  64           HB3      GLU  64  -3.559  12.454  -0.699
  499    HG2  GLU  64           HG2      GLU  64  -4.254  12.504  -2.956
  500    HG3  GLU  64           HG3      GLU  64  -5.696  13.440  -2.563
  501    H    ALA  65           H        ALA  65  -7.147  12.079  -2.434
  502    HA   ALA  65           HA       ALA  65  -7.376   9.474  -3.462
  503    HB1  ALA  65           HB1      ALA  65  -8.939  11.427  -3.842
  504    HB2  ALA  65           HB2      ALA  65  -8.591  10.423  -5.251
  505    HB3  ALA  65           HB3      ALA  65  -7.794  11.986  -5.062
  506    H    GLY  66           H        GLY  66  -5.625   8.369  -4.120
  507    HA2  GLY  66           HA2      GLY  66  -4.222   7.853  -5.996
  508    HA3  GLY  66           HA3      GLY  66  -4.018   9.576  -6.269
  509    H    CYS  67           H        CYS  67  -3.694   9.618  -3.135
  510    HA   CYS  67           HA       CYS  67  -0.882   9.811  -3.157
  511    HB2  CYS  67           HB2      CYS  67  -2.703  10.815  -1.529
  512    HB3  CYS  67           HB3      CYS  67  -2.363   9.359  -0.600
  513    HG   CYS  67           HG       CYS  67  -0.603  11.803  -0.752
  514    H    VAL  68           H        VAL  68   0.705   8.503  -2.216
  515    HA   VAL  68           HA       VAL  68   0.156   5.675  -2.382
  516    HB   VAL  68           HB       VAL  68   2.743   6.992  -1.557
  517   HG11  VAL  68          HG11      VAL  68   3.788   4.957  -2.066
  518   HG12  VAL  68          HG12      VAL  68   2.381   4.352  -2.940
  519   HG13  VAL  68          HG13      VAL  68   2.332   4.498  -1.183
  520   HG21  VAL  68          HG21      VAL  68   2.068   7.912  -3.693
  521   HG22  VAL  68          HG22      VAL  68   1.764   6.293  -4.324
  522   HG23  VAL  68          HG23      VAL  68   3.408   6.789  -3.924
  523    H    VAL  69           H        VAL  69  -0.971   4.891  -0.687
  524    HA   VAL  69           HA       VAL  69  -0.441   5.751   2.017
  525    HB   VAL  69           HB       VAL  69  -2.201   3.466   1.125
  526   HG11  VAL  69          HG11      VAL  69  -2.188   5.142   3.633
  527   HG12  VAL  69          HG12      VAL  69  -1.661   3.464   3.499
  528   HG13  VAL  69          HG13      VAL  69  -3.357   3.879   3.246
  529   HG21  VAL  69          HG21      VAL  69  -3.100   6.287   1.659
  530   HG22  VAL  69          HG22      VAL  69  -4.027   4.958   0.963
  531   HG23  VAL  69          HG23      VAL  69  -2.717   5.697   0.042
  532    H    ALA  70           H        ALA  70   0.597   3.202  -0.072
  533    HA   ALA  70           HA       ALA  70   2.510   2.288   1.837
  534    HB1  ALA  70           HB1      ALA  70   0.291   1.163   2.492
  535    HB2  ALA  70           HB2      ALA  70   1.730   0.154   2.344
  536    HB3  ALA  70           HB3      ALA  70   0.533   0.179   1.048
  537    H    ARG  71           H        ARG  71   3.203  -0.140   0.843
  538    HA   ARG  71           HA       ARG  71   3.416   0.123  -2.060
  539    HB2  ARG  71           HB2      ARG  71   5.662   0.330  -0.112
  540    HB3  ARG  71           HB3      ARG  71   5.954  -0.544  -1.610
  541    HG2  ARG  71           HG2      ARG  71   4.860   2.254  -1.517
  542    HG3  ARG  71           HG3      ARG  71   6.580   1.880  -1.635
  543    HD2  ARG  71           HD2      ARG  71   5.015   0.405  -3.577
  544    HD3  ARG  71           HD3      ARG  71   4.785   2.146  -3.737
  545    HE   ARG  71           HE       ARG  71   7.117   0.658  -4.418
  546   HH11  ARG  71          HH11      ARG  71   6.030   3.756  -3.234
  547   HH12  ARG  71          HH12      ARG  71   7.414   4.609  -3.827
  548   HH21  ARG  71          HH21      ARG  71   8.940   1.779  -5.199
  549   HH22  ARG  71          HH22      ARG  71   9.066   3.488  -4.944
  550    H    LEU  72           H        LEU  72   3.704  -1.808  -3.143
  551    HA   LEU  72           HA       LEU  72   3.286  -4.202  -1.520
  552    HB2  LEU  72           HB2      LEU  72   2.411  -3.310  -4.116
  553    HB3  LEU  72           HB3      LEU  72   3.197  -4.872  -4.249
  554    HG   LEU  72           HG       LEU  72   0.857  -5.250  -3.966
  555   HD11  LEU  72          HD11      LEU  72   2.729  -6.434  -2.446
  556   HD12  LEU  72          HD12      LEU  72   1.024  -6.884  -2.422
  557   HD13  LEU  72          HD13      LEU  72   1.669  -5.802  -1.187
  558   HD21  LEU  72          HD21      LEU  72   0.753  -2.902  -2.665
  559   HD22  LEU  72          HD22      LEU  72   0.675  -4.011  -1.296
  560   HD23  LEU  72          HD23      LEU  72  -0.523  -4.116  -2.586
  561    H    GLU  73           H        GLU  73   4.900  -5.531  -1.086
  562    HA   GLU  73           HA       GLU  73   7.425  -5.250  -2.501
  563    HB2  GLU  73           HB2      GLU  73   7.022  -5.515   0.089
  564    HB3  GLU  73           HB3      GLU  73   6.995  -7.229  -0.301
  565    HG2  GLU  73           HG2      GLU  73   9.202  -6.735   0.333
  566    HG3  GLU  73           HG3      GLU  73   9.223  -6.893  -1.423
  567    H    LEU  74           H        LEU  74   6.577  -6.149  -4.511
  568    HA   LEU  74           HA       LEU  74   5.600  -8.777  -4.733
  569    HB2  LEU  74           HB2      LEU  74   6.430  -6.653  -6.510
  570    HB3  LEU  74           HB3      LEU  74   6.975  -8.208  -7.110
  571    HG   LEU  74           HG       LEU  74   4.771  -7.497  -8.013
  572   HD11  LEU  74          HD11      LEU  74   4.834 -10.003  -6.343
  573   HD12  LEU  74          HD12      LEU  74   5.327  -9.832  -8.027
  574   HD13  LEU  74          HD13      LEU  74   3.630  -9.656  -7.583
  575   HD21  LEU  74          HD21      LEU  74   4.122  -6.483  -5.721
  576   HD22  LEU  74          HD22      LEU  74   3.588  -8.119  -5.337
  577   HD23  LEU  74          HD23      LEU  74   2.877  -7.258  -6.701
  578    H    ASP  75           H        ASP  75   6.891 -10.400  -6.213
  579    HA   ASP  75           HA       ASP  75   9.707 -10.546  -5.818
  580    HB2  ASP  75           HB2      ASP  75   9.491 -12.742  -4.466
  581    HB3  ASP  75           HB3      ASP  75   9.348 -11.213  -3.608
  582    H    ASP  76           H        ASP  76   9.303 -10.756  -8.133
  583    HA   ASP  76           HA       ASP  76   8.015 -13.119  -9.132
  584    HB2  ASP  76           HB2      ASP  76   8.235 -10.849 -10.317
  585    HB3  ASP  76           HB3      ASP  76   9.878 -11.351 -10.705
  586    H    LEU  77           H        LEU  77   9.189 -14.613 -10.637
  587    HA   LEU  77           HA       LEU  77  11.559 -15.608  -9.288
  588    HB2  LEU  77           HB2      LEU  77   9.461 -16.912 -10.276
  589    HB3  LEU  77           HB3      LEU  77  10.461 -16.926 -11.716
  590    HG   LEU  77           HG       LEU  77  12.278 -17.995 -10.372
  591   HD11  LEU  77          HD11      LEU  77  11.776 -17.379  -8.158
  592   HD12  LEU  77          HD12      LEU  77  11.471 -19.114  -8.245
  593   HD13  LEU  77          HD13      LEU  77  10.122 -17.979  -8.281
  594   HD21  LEU  77          HD21      LEU  77   9.658 -19.487 -10.443
  595   HD22  LEU  77          HD22      LEU  77  11.267 -20.204 -10.369
  596   HD23  LEU  77          HD23      LEU  77  10.770 -19.300 -11.799
  597    H    GLU  78           H        GLU  78  12.160 -13.233 -10.483
  598    HA   GLU  78           HA       GLU  78  14.301 -13.973 -12.211
  599    HB2  GLU  78           HB2      GLU  78  12.478 -14.007 -13.852
  600    HB3  GLU  78           HB3      GLU  78  12.040 -12.363 -13.410
  601    HG2  GLU  78           HG2      GLU  78  13.283 -12.327 -15.456
  602    HG3  GLU  78           HG3      GLU  78  14.255 -11.601 -14.177
  603    H    HIS  79           H        HIS  79  15.880 -12.740 -11.455
  604    HA   HIS  79           HA       HIS  79  15.270 -10.125 -10.320
  605    HB2  HIS  79           HB2      HIS  79  17.552 -10.190  -9.439
  606    HB3  HIS  79           HB3      HIS  79  16.686 -11.667  -9.029
  607    HD1  HIS  79           HD1      HIS  79  19.562 -12.030  -8.827
  608    HD2  HIS  79           HD2      HIS  79  17.639 -12.351 -12.496
  609    HE1  HIS  79           HE1      HIS  79  21.104 -13.387 -10.277
  610    HE2  HIS  79           HE2      HIS  79  19.880 -13.642 -12.464
  611    H    HIS  80           H        HIS  80  17.212  -8.495 -10.701
  612    HA   HIS  80           HA       HIS  80  17.847  -8.442 -13.571
  613    HB2  HIS  80           HB2      HIS  80  17.434  -5.949 -13.490
  614    HB3  HIS  80           HB3      HIS  80  15.994  -6.955 -13.374
  615    HD1  HIS  80           HD1      HIS  80  14.495  -6.524 -11.432
  616    HD2  HIS  80           HD2      HIS  80  18.280  -4.898 -10.888
  617    HE1  HIS  80           HE1      HIS  80  14.353  -5.185  -9.308
  618    HE2  HIS  80           HE2      HIS  80  16.630  -4.140  -9.046
  619    H    HIS  81           H        HIS  81  19.420  -6.456 -13.943
  620    HA   HIS  81           HA       HIS  81  21.429  -6.470 -11.790
  621    HB2  HIS  81           HB2      HIS  81  22.108  -6.509 -14.731
  622    HB3  HIS  81           HB3      HIS  81  23.203  -6.721 -13.370
  623    HD1  HIS  81           HD1      HIS  81  22.276  -8.713 -15.887
  624    HD2  HIS  81           HD2      HIS  81  21.635  -9.117 -11.802
  625    HE1  HIS  81           HE1      HIS  81  21.896 -11.169 -15.506
  626    HE2  HIS  81           HE2      HIS  81  21.597 -11.401 -13.015
  627    H    HIS  82           H        HIS  82  23.255  -4.757 -12.652
  628    HA   HIS  82           HA       HIS  82  21.854  -2.320 -13.496
  629    HB2  HIS  82           HB2      HIS  82  22.221  -2.607 -10.914
  630    HB3  HIS  82           HB3      HIS  82  23.880  -2.158 -11.294
  631    HD1  HIS  82           HD1      HIS  82  20.478  -0.751 -12.297
  632    HD2  HIS  82           HD2      HIS  82  24.186   0.485 -10.888
  633    HE1  HIS  82           HE1      HIS  82  20.318   1.750 -12.090
  634    HE2  HIS  82           HE2      HIS  82  22.544   2.466 -11.153
  635    H    HIS  83           H        HIS  83  23.176  -0.733 -14.469
  636    HA   HIS  83           HA       HIS  83  25.453  -1.831 -15.850
  637    HB2  HIS  83           HB2      HIS  83  25.503   0.413 -16.967
  638    HB3  HIS  83           HB3      HIS  83  23.965  -0.431 -17.116
  639    HD1  HIS  83           HD1      HIS  83  22.823   1.889 -17.544
  640    HD2  HIS  83           HD2      HIS  83  24.544   1.454 -13.787
  641    HE1  HIS  83           HE1      HIS  83  21.893   3.770 -16.157
  642    HE2  HIS  83           HE2      HIS  83  22.881   3.434 -13.864
  643    H    HIS  84           H        HIS  84  27.309  -0.031 -16.161
  644    HA   HIS  84           HA       HIS  84  28.634   0.061 -13.627
  645    HB2  HIS  84           HB2      HIS  84  29.421   1.188 -16.322
  646    HB3  HIS  84           HB3      HIS  84  30.470   1.149 -14.909
  647    HD1  HIS  84           HD1      HIS  84  28.576  -1.302 -17.114
  648    HD2  HIS  84           HD2      HIS  84  31.973  -1.100 -14.729
  649    HE1  HIS  84           HE1      HIS  84  29.748  -3.505 -17.425
  650    HE2  HIS  84           HE2      HIS  84  31.845  -3.326 -16.040
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1  -1.837   9.577 -12.116
    2    H2   MET   1           H2       MET   1  -0.627   8.381 -12.322
    3    H3   MET   1           H3       MET   1  -2.182   8.156 -13.013
    4    HA   MET   1           HA       MET   1  -1.800   8.483 -10.129
    5    HB2  MET   1           HB2      MET   1  -3.949   7.660 -12.029
    6    HB3  MET   1           HB3      MET   1  -3.935   6.927 -10.431
    7    HG2  MET   1           HG2      MET   1  -5.261   8.703  -9.992
    8    HG3  MET   1           HG3      MET   1  -3.696   9.452  -9.680
    9    HE1  MET   1           HE1      MET   1  -6.273  11.377 -10.330
   10    HE2  MET   1           HE2      MET   1  -6.928   9.893 -11.022
   11    HE3  MET   1           HE3      MET   1  -6.771  11.337 -12.022
   12    H    GLU   2           H        GLU   2  -1.932   6.091 -12.754
   13    HA   GLU   2           HA       GLU   2  -1.348   3.869 -11.075
   14    HB2  GLU   2           HB2      GLU   2  -1.342   4.296 -14.051
   15    HB3  GLU   2           HB3      GLU   2  -0.778   2.785 -13.351
   16    HG2  GLU   2           HG2      GLU   2  -3.453   3.859 -12.587
   17    HG3  GLU   2           HG3      GLU   2  -3.244   3.031 -14.130
   18    H    ASN   3           H        ASN   3   0.492   4.607  -9.892
   19    HA   ASN   3           HA       ASN   3   2.980   4.912 -11.397
   20    HB2  ASN   3           HB2      ASN   3   2.471   6.548  -9.615
   21    HB3  ASN   3           HB3      ASN   3   2.455   5.241  -8.434
   22   HD21  ASN   3          HD21      ASN   3   4.376   7.387 -10.281
   23   HD22  ASN   3          HD22      ASN   3   5.914   6.899  -9.665
   24    H    ASP   4           H        ASP   4   3.075   2.679 -12.045
   25    HA   ASP   4           HA       ASP   4   3.846   0.555 -11.915
   26    HB2  ASP   4           HB2      ASP   4   5.490   2.134 -10.280
   27    HB3  ASP   4           HB3      ASP   4   5.145   0.686  -9.353
   28    HA   PRO   5           HA       PRO   5   1.053  -1.668  -9.313
   29    HB2  PRO   5           HB2      PRO   5   2.039  -4.159  -9.459
   30    HB3  PRO   5           HB3      PRO   5   1.335  -3.354 -10.867
   31    HG2  PRO   5           HG2      PRO   5   4.208  -3.745 -10.143
   32    HG3  PRO   5           HG3      PRO   5   3.426  -3.865 -11.728
   33    HD2  PRO   5           HD2      PRO   5   4.835  -1.667 -10.847
   34    HD3  PRO   5           HD3      PRO   5   3.585  -1.617 -12.102
   35    H    THR   6           H        THR   6   4.352  -1.370  -8.444
   36    HA   THR   6           HA       THR   6   4.044  -2.782  -5.921
   37    HB   THR   6           HB       THR   6   6.412  -2.324  -5.593
   38    HG1  THR   6           HG1      THR   6   7.555  -1.077  -7.028
   39   HG21  THR   6          HG21      THR   6   6.971  -3.020  -8.241
   40   HG22  THR   6          HG22      THR   6   5.404  -3.738  -7.866
   41   HG23  THR   6          HG23      THR   6   6.804  -4.092  -6.852
   42    H    VAL   7           H        VAL   7   2.294  -0.682  -6.071
   43    HA   VAL   7           HA       VAL   7   3.280   1.022  -3.933
   44    HB   VAL   7           HB       VAL   7   2.547   3.074  -4.919
   45   HG11  VAL   7          HG11      VAL   7   4.303   3.407  -6.377
   46   HG12  VAL   7          HG12      VAL   7   4.110   1.829  -7.140
   47   HG13  VAL   7          HG13      VAL   7   4.826   1.950  -5.532
   48   HG21  VAL   7          HG21      VAL   7   1.645   1.304  -7.156
   49   HG22  VAL   7          HG22      VAL   7   1.809   3.053  -7.323
   50   HG23  VAL   7          HG23      VAL   7   0.673   2.375  -6.157
   51    H    LEU   8           H        LEU   8   1.438   2.422  -3.049
   52    HA   LEU   8           HA       LEU   8  -1.200   1.265  -3.439
   53    HB2  LEU   8           HB2      LEU   8   0.383   0.266  -1.424
   54    HB3  LEU   8           HB3      LEU   8  -0.561   1.494  -0.603
   55    HG   LEU   8           HG       LEU   8  -1.706  -0.586  -0.365
   56   HD11  LEU   8          HD11      LEU   8  -3.746   0.235  -0.798
   57   HD12  LEU   8          HD12      LEU   8  -3.407   0.445  -2.516
   58   HD13  LEU   8          HD13      LEU   8  -2.874   1.663  -1.357
   59   HD21  LEU   8          HD21      LEU   8  -2.083  -0.951  -3.288
   60   HD22  LEU   8          HD22      LEU   8  -2.029  -2.148  -1.994
   61   HD23  LEU   8          HD23      LEU   8  -0.535  -1.422  -2.586
   62    H    ARG   9           H        ARG   9  -1.766   3.295  -4.204
   63    HA   ARG   9           HA       ARG   9  -1.556   5.573  -2.400
   64    HB2  ARG   9           HB2      ARG   9  -2.282   5.247  -5.291
   65    HB3  ARG   9           HB3      ARG   9  -2.732   6.714  -4.431
   66    HG2  ARG   9           HG2      ARG   9  -0.545   7.387  -4.157
   67    HG3  ARG   9           HG3      ARG   9   0.090   5.751  -4.334
   68    HD2  ARG   9           HD2      ARG   9  -0.667   5.836  -6.732
   69    HD3  ARG   9           HD3      ARG   9  -0.999   7.550  -6.487
   70    HE   ARG   9           HE       ARG   9   1.673   6.758  -5.768
   71   HH11  ARG   9          HH11      ARG   9  -0.401   7.842  -8.358
   72   HH12  ARG   9          HH12      ARG   9   0.901   8.488  -9.298
   73   HH21  ARG   9          HH21      ARG   9   3.387   7.608  -7.004
   74   HH22  ARG   9          HH22      ARG   9   3.052   8.355  -8.530
   75    H    SER  10           H        SER  10  -3.323   6.703  -1.599
   76    HA   SER  10           HA       SER  10  -5.593   5.145  -0.936
   77    HB2  SER  10           HB2      SER  10  -6.352   7.712  -0.348
   78    HB3  SER  10           HB3      SER  10  -5.396   6.679   0.715
   79    HG   SER  10           HG       SER  10  -4.569   8.882   0.145
   80    HA   PRO  11           HA       PRO  11  -8.252   5.937  -4.372
   81    HB2  PRO  11           HB2      PRO  11 -10.678   5.634  -3.206
   82    HB3  PRO  11           HB3      PRO  11  -9.600   4.272  -3.531
   83    HG2  PRO  11           HG2      PRO  11 -10.053   5.760  -0.973
   84    HG3  PRO  11           HG3      PRO  11  -9.906   4.013  -1.240
   85    HD2  PRO  11           HD2      PRO  11  -7.860   5.532  -0.311
   86    HD3  PRO  11           HD3      PRO  11  -7.606   4.092  -1.318
   87    H    SER  12           H        SER  12  -8.925   7.667  -1.359
   88    HA   SER  12           HA       SER  12  -9.358  10.111  -2.850
   89    HB2  SER  12           HB2      SER  12 -11.546  10.589  -1.979
   90    HB3  SER  12           HB3      SER  12 -11.610   8.989  -2.717
   91    HG   SER  12           HG       SER  12 -12.613   8.983  -0.680
   92    H    ALA  13           H        ALA  13 -10.139  11.848  -1.042
   93    HA   ALA  13           HA       ALA  13  -7.924  11.985   0.770
   94    HB1  ALA  13           HB1      ALA  13  -8.832  14.155   1.403
   95    HB2  ALA  13           HB2      ALA  13 -10.316  13.806   0.517
   96    HB3  ALA  13           HB3      ALA  13  -8.791  13.981  -0.352
   97    H    GLY  14           H        GLY  14  -7.885  10.858   2.602
   98    HA2  GLY  14           HA2      GLY  14 -10.296  10.887   4.292
   99    HA3  GLY  14           HA3      GLY  14  -9.472   9.367   3.974
  100    H    LYS  15           H        LYS  15  -8.671   8.833   5.924
  101    HA   LYS  15           HA       LYS  15  -6.446  10.327   6.935
  102    HB2  LYS  15           HB2      LYS  15  -8.406  11.538   7.916
  103    HB3  LYS  15           HB3      LYS  15  -8.855  10.050   8.738
  104    HG2  LYS  15           HG2      LYS  15  -6.084  10.927   9.166
  105    HG3  LYS  15           HG3      LYS  15  -7.328  11.992   9.822
  106    HD2  LYS  15           HD2      LYS  15  -7.247   9.022  10.321
  107    HD3  LYS  15           HD3      LYS  15  -6.501  10.209  11.392
  108    HE2  LYS  15           HE2      LYS  15  -8.958  11.272  11.172
  109    HE3  LYS  15           HE3      LYS  15  -9.351   9.567  10.954
  110    HZ1  LYS  15           HZ1      LYS  15  -9.476  10.189  13.274
  111    HZ2  LYS  15           HZ2      LYS  15  -7.874  10.732  13.253
  112    HZ3  LYS  15           HZ3      LYS  15  -8.212   9.088  13.042
  113    H    LEU  16           H        LEU  16  -5.076   9.060   8.107
  114    HA   LEU  16           HA       LEU  16  -5.457   6.251   8.017
  115    HB2  LEU  16           HB2      LEU  16  -3.273   7.712   8.062
  116    HB3  LEU  16           HB3      LEU  16  -3.426   7.531   9.797
  117    HG   LEU  16           HG       LEU  16  -3.249   5.129   9.623
  118   HD11  LEU  16          HD11      LEU  16  -2.687   4.166   7.330
  119   HD12  LEU  16          HD12      LEU  16  -3.369   5.653   6.671
  120   HD13  LEU  16          HD13      LEU  16  -4.373   4.578   7.643
  121   HD21  LEU  16          HD21      LEU  16  -1.005   5.090   9.356
  122   HD22  LEU  16          HD22      LEU  16  -1.214   6.840   9.294
  123   HD23  LEU  16          HD23      LEU  16  -1.065   5.916   7.799
  124    H    THR  17           H        THR  17  -7.201   5.572   9.200
  125    HA   THR  17           HA       THR  17  -7.673   6.463  11.880
  126    HB   THR  17           HB       THR  17  -9.498   5.764  10.357
  127    HG1  THR  17           HG1      THR  17 -10.624   5.132  12.020
  128   HG21  THR  17          HG21      THR  17  -8.960   2.906  10.906
  129   HG22  THR  17          HG22      THR  17  -8.083   3.679   9.586
  130   HG23  THR  17          HG23      THR  17  -9.846   3.664   9.584
  131    H    GLN  18           H        GLN  18  -6.301   3.546  10.410
  132    HA   GLN  18           HA       GLN  18  -4.758   2.988  12.736
  133    HB2  GLN  18           HB2      GLN  18  -5.771   0.947  13.462
  134    HB3  GLN  18           HB3      GLN  18  -7.025   2.177  13.432
  135    HG2  GLN  18           HG2      GLN  18  -7.850   1.309  11.316
  136    HG3  GLN  18           HG3      GLN  18  -6.571   0.096  11.304
  137   HE21  GLN  18          HE21      GLN  18  -6.506  -1.194  13.445
  138   HE22  GLN  18          HE22      GLN  18  -8.033  -1.793  13.987
  139    H    TYR  19           H        TYR  19  -4.342   0.238  12.345
  140    HA   TYR  19           HA       TYR  19  -3.677  -0.146   9.545
  141    HB2  TYR  19           HB2      TYR  19  -1.287  -0.674  10.117
  142    HB3  TYR  19           HB3      TYR  19  -1.712   1.029  10.252
  143    HD1  TYR  19           HD2      TYR  19  -0.901  -2.024  12.136
  144    HD2  TYR  19           HD1      TYR  19  -1.688   2.149  12.379
  145    HE1  TYR  19           HE2      TYR  19  -0.063  -2.007  14.448
  146    HE2  TYR  19           HE1      TYR  19  -0.852   2.178  14.691
  147    HH   TYR  19           HH       TYR  19  -0.668  -0.050  16.610
  148    H    THR  20           H        THR  20  -3.491  -2.280   8.970
  149    HA   THR  20           HA       THR  20  -4.278  -4.204  11.023
  150    HB   THR  20           HB       THR  20  -5.014  -5.614   9.254
  151    HG1  THR  20           HG1      THR  20  -4.011  -5.639   7.431
  152   HG21  THR  20          HG21      THR  20  -6.313  -4.023   7.731
  153   HG22  THR  20          HG22      THR  20  -5.647  -2.738   8.739
  154   HG23  THR  20          HG23      THR  20  -6.658  -3.991   9.460
  155    H    VAL  21           H        VAL  21  -1.512  -3.250   9.261
  156    HA   VAL  21           HA       VAL  21  -0.014  -5.470  10.396
  157    HB   VAL  21           HB       VAL  21   1.132  -5.978   8.277
  158   HG11  VAL  21          HG11      VAL  21  -0.605  -7.337   7.317
  159   HG12  VAL  21          HG12      VAL  21  -1.853  -6.332   8.053
  160   HG13  VAL  21          HG13      VAL  21  -0.800  -7.315   9.070
  161   HG21  VAL  21          HG21      VAL  21   0.475  -3.701   7.275
  162   HG22  VAL  21          HG22      VAL  21  -1.034  -4.495   6.827
  163   HG23  VAL  21          HG23      VAL  21   0.501  -5.105   6.207
  164    H    GLU  22           H        GLU  22   2.124  -5.014  10.782
  165    HA   GLU  22           HA       GLU  22   2.844  -2.280  10.988
  166    HB2  GLU  22           HB2      GLU  22   5.033  -3.150  11.752
  167    HB3  GLU  22           HB3      GLU  22   3.677  -3.893  12.588
  168    HG2  GLU  22           HG2      GLU  22   4.174  -5.933  11.834
  169    HG3  GLU  22           HG3      GLU  22   4.523  -5.352  10.206
  170    H    ASP  23           H        ASP  23   5.328  -1.848  10.260
  171    HA   ASP  23           HA       ASP  23   5.218  -1.364   7.506
  172    HB2  ASP  23           HB2      ASP  23   7.580  -0.710   7.705
  173    HB3  ASP  23           HB3      ASP  23   6.622  -0.051   9.028
  174    H    GLY  24           H        GLY  24   5.558  -2.641   5.810
  175    HA2  GLY  24           HA2      GLY  24   6.476  -4.310   4.498
  176    HA3  GLY  24           HA3      GLY  24   7.584  -4.677   5.811
  177    H    GLY  25           H        GLY  25   4.162  -4.602   6.405
  178    HA2  GLY  25           HA2      GLY  25   4.153  -7.265   7.388
  179    HA3  GLY  25           HA3      GLY  25   2.741  -6.248   7.148
  180    H    HIS  26           H        HIS  26   4.273  -9.029   6.170
  181    HA   HIS  26           HA       HIS  26   3.719  -9.132   3.418
  182    HB2  HIS  26           HB2      HIS  26   3.918 -11.573   3.661
  183    HB3  HIS  26           HB3      HIS  26   5.210 -10.731   4.511
  184    HD1  HIS  26           HD1      HIS  26   2.317 -12.984   5.044
  185    HD2  HIS  26           HD2      HIS  26   5.043 -10.854   7.345
  186    HE1  HIS  26           HE1      HIS  26   2.097 -13.907   7.373
  187    HE2  HIS  26           HE2      HIS  26   3.819 -12.664   8.728
  188    H    VAL  27           H        VAL  27   1.844  -9.140   2.385
  189    HA   VAL  27           HA       VAL  27  -0.442 -10.550   3.525
  190    HB   VAL  27           HB       VAL  27  -1.975  -8.671   3.067
  191   HG11  VAL  27          HG11      VAL  27  -0.929  -9.097   5.323
  192   HG12  VAL  27          HG12      VAL  27  -1.535  -7.462   5.056
  193   HG13  VAL  27          HG13      VAL  27   0.196  -7.789   4.956
  194   HG21  VAL  27          HG21      VAL  27  -0.546  -7.537   1.393
  195   HG22  VAL  27          HG22      VAL  27   0.524  -7.023   2.697
  196   HG23  VAL  27          HG23      VAL  27  -1.141  -6.446   2.645
  197    H    GLU  28           H        GLU  28  -1.688 -11.526   2.017
  198    HA   GLU  28           HA       GLU  28  -0.780 -11.421  -0.728
  199    HB2  GLU  28           HB2      GLU  28  -2.174 -13.336  -1.099
  200    HB3  GLU  28           HB3      GLU  28  -1.339 -13.566   0.430
  201    HG2  GLU  28           HG2      GLU  28  -3.793 -12.270   0.981
  202    HG3  GLU  28           HG3      GLU  28  -4.125 -13.615  -0.109
  203    H    ALA  29           H        ALA  29  -2.360 -11.289  -2.521
  204    HA   ALA  29           HA       ALA  29  -3.666  -8.887  -2.651
  205    HB1  ALA  29           HB1      ALA  29  -3.167 -10.819  -4.435
  206    HB2  ALA  29           HB2      ALA  29  -4.291  -9.494  -4.738
  207    HB3  ALA  29           HB3      ALA  29  -4.899 -11.066  -4.219
  208    H    GLY  30           H        GLY  30  -5.551  -8.062  -1.974
  209    HA2  GLY  30           HA2      GLY  30  -7.857  -8.129  -1.453
  210    HA3  GLY  30           HA3      GLY  30  -7.733  -9.867  -1.233
  211    H    SER  31           H        SER  31  -5.271  -9.451   0.451
  212    HA   SER  31           HA       SER  31  -6.611  -9.343   2.963
  213    HB2  SER  31           HB2      SER  31  -3.666  -9.413   2.267
  214    HB3  SER  31           HB3      SER  31  -4.299  -9.542   3.908
  215    HG   SER  31           HG       SER  31  -4.093 -11.606   3.245
  216    H    SER  32           H        SER  32  -7.002  -7.653   4.235
  217    HA   SER  32           HA       SER  32  -6.413  -5.010   3.411
  218    HB2  SER  32           HB2      SER  32  -7.201  -4.526   5.868
  219    HB3  SER  32           HB3      SER  32  -8.354  -5.134   4.681
  220    HG   SER  32           HG       SER  32  -8.221  -6.207   6.841
  221    H    TYR  33           H        TYR  33  -4.857  -3.595   4.026
  222    HA   TYR  33           HA       TYR  33  -2.765  -4.635   5.822
  223    HB2  TYR  33           HB2      TYR  33  -1.132  -3.394   4.567
  224    HB3  TYR  33           HB3      TYR  33  -2.091  -4.339   3.433
  225    HD1  TYR  33           HD1      TYR  33  -1.345  -0.961   4.657
  226    HD2  TYR  33           HD2      TYR  33  -3.548  -3.259   1.835
  227    HE1  TYR  33           HE1      TYR  33  -1.828   1.083   3.378
  228    HE2  TYR  33           HE2      TYR  33  -4.037  -1.222   0.548
  229    HH   TYR  33           HH       TYR  33  -2.429   1.710   1.065
  230    H    ALA  34           H        ALA  34  -5.121  -2.236   5.440
  231    HA   ALA  34           HA       ALA  34  -4.513  -1.016   7.914
  232    HB1  ALA  34           HB1      ALA  34  -4.178   0.968   5.719
  233    HB2  ALA  34           HB2      ALA  34  -2.804  -0.041   6.173
  234    HB3  ALA  34           HB3      ALA  34  -3.569   1.001   7.374
  235    H    GLU  35           H        GLU  35  -5.756   1.343   7.818
  236    HA   GLU  35           HA       GLU  35  -8.257   1.056   6.353
  237    HB2  GLU  35           HB2      GLU  35  -8.360   1.505   9.326
  238    HB3  GLU  35           HB3      GLU  35  -9.672   1.070   8.240
  239    HG2  GLU  35           HG2      GLU  35  -8.312  -1.103   7.873
  240    HG3  GLU  35           HG3      GLU  35  -7.507  -0.644   9.372
  241    H    MET  36           H        MET  36  -9.647   3.004   6.598
  242    HA   MET  36           HA       MET  36  -8.341   5.395   7.585
  243    HB2  MET  36           HB2      MET  36  -8.371   6.582   5.482
  244    HB3  MET  36           HB3      MET  36  -7.431   5.109   5.296
  245    HG2  MET  36           HG2      MET  36  -9.791   4.179   4.496
  246    HG3  MET  36           HG3      MET  36 -10.016   5.879   4.087
  247    HE1  MET  36           HE1      MET  36 -10.353   4.504   1.569
  248    HE2  MET  36           HE2      MET  36  -9.749   3.017   2.301
  249    HE3  MET  36           HE3      MET  36  -9.002   3.643   0.831
  250    H    GLU  37           H        GLU  37  -9.831   6.576   8.565
  251    HA   GLU  37           HA       GLU  37 -12.645   6.092   8.004
  252    HB2  GLU  37           HB2      GLU  37 -11.671   6.195  10.347
  253    HB3  GLU  37           HB3      GLU  37 -11.487   7.926  10.101
  254    HG2  GLU  37           HG2      GLU  37 -13.919   8.090   9.706
  255    HG3  GLU  37           HG3      GLU  37 -14.063   6.371  10.074
  256    H    VAL  38           H        VAL  38 -13.462   7.199   6.351
  257    HA   VAL  38           HA       VAL  38 -12.539   9.907   5.785
  258    HB   VAL  38           HB       VAL  38 -14.698   8.566   4.204
  259   HG11  VAL  38          HG11      VAL  38 -14.325  10.631   3.305
  260   HG12  VAL  38          HG12      VAL  38 -13.142   9.694   2.392
  261   HG13  VAL  38          HG13      VAL  38 -12.626  10.654   3.779
  262   HG21  VAL  38          HG21      VAL  38 -11.762   7.896   4.037
  263   HG22  VAL  38          HG22      VAL  38 -12.956   7.476   2.809
  264   HG23  VAL  38          HG23      VAL  38 -13.083   6.796   4.431
  265    H    MET  39           H        MET  39 -14.333  11.495   5.109
  266    HA   MET  39           HA       MET  39 -15.896  12.106   7.337
  267    HB2  MET  39           HB2      MET  39 -16.527  13.024   4.537
  268    HB3  MET  39           HB3      MET  39 -16.829  13.871   6.048
  269    HG2  MET  39           HG2      MET  39 -14.135  13.570   6.142
  270    HG3  MET  39           HG3      MET  39 -14.407  13.735   4.408
  271    HE1  MET  39           HE1      MET  39 -16.118  17.169   4.080
  272    HE2  MET  39           HE2      MET  39 -16.460  15.471   3.749
  273    HE3  MET  39           HE3      MET  39 -14.923  16.175   3.246
  274    H    LYS  40           H        LYS  40 -16.570  10.118   4.559
  275    HA   LYS  40           HA       LYS  40 -19.402  10.019   4.961
  276    HB2  LYS  40           HB2      LYS  40 -18.433   9.686   2.746
  277    HB3  LYS  40           HB3      LYS  40 -17.552   8.278   3.322
  278    HG2  LYS  40           HG2      LYS  40 -19.303   7.234   2.349
  279    HG3  LYS  40           HG3      LYS  40 -19.985   7.473   3.958
  280    HD2  LYS  40           HD2      LYS  40 -21.695   8.489   2.942
  281    HD3  LYS  40           HD3      LYS  40 -20.585   9.827   2.638
  282    HE2  LYS  40           HE2      LYS  40 -21.617   9.231   0.564
  283    HE3  LYS  40           HE3      LYS  40 -19.934   8.710   0.508
  284    HZ1  LYS  40           HZ1      LYS  40 -22.131   6.882   1.278
  285    HZ2  LYS  40           HZ2      LYS  40 -20.553   6.482   0.819
  286    HZ3  LYS  40           HZ3      LYS  40 -21.641   7.080  -0.330
  287    H    MET  41           H        MET  41 -17.081   7.315   4.980
  288    HA   MET  41           HA       MET  41 -18.028   6.440   7.577
  289    HB2  MET  41           HB2      MET  41 -19.390   5.498   5.413
  290    HB3  MET  41           HB3      MET  41 -18.141   4.273   5.582
  291    HG2  MET  41           HG2      MET  41 -18.919   4.430   8.128
  292    HG3  MET  41           HG3      MET  41 -20.419   4.923   7.344
  293    HE1  MET  41           HE1      MET  41 -21.218   3.108   4.952
  294    HE2  MET  41           HE2      MET  41 -22.027   3.585   6.445
  295    HE3  MET  41           HE3      MET  41 -21.950   1.883   5.988
  296    H    ILE  42           H        ILE  42 -17.002   3.988   7.784
  297    HA   ILE  42           HA       ILE  42 -14.157   4.480   7.677
  298    HB   ILE  42           HB       ILE  42 -15.100   3.453   9.673
  299   HG12  ILE  42          HG12      ILE  42 -13.579   1.524   9.874
  300   HG13  ILE  42          HG13      ILE  42 -13.366   1.510   8.127
  301   HG21  ILE  42          HG21      ILE  42 -16.257   1.595   7.696
  302   HG22  ILE  42          HG22      ILE  42 -16.906   2.174   9.230
  303   HG23  ILE  42          HG23      ILE  42 -15.708   0.881   9.212
  304   HD11  ILE  42          HD11      ILE  42 -12.758   4.114   9.017
  305   HD12  ILE  42          HD12      ILE  42 -11.668   2.898   8.351
  306   HD13  ILE  42          HD13      ILE  42 -11.939   2.981  10.092
  307    H    MET  43           H        MET  43 -12.618   3.141   6.647
  308    HA   MET  43           HA       MET  43 -13.600   1.200   4.705
  309    HB2  MET  43           HB2      MET  43 -12.154   3.740   4.023
  310    HB3  MET  43           HB3      MET  43 -11.981   2.317   3.005
  311    HG2  MET  43           HG2      MET  43 -14.673   3.413   3.728
  312    HG3  MET  43           HG3      MET  43 -13.746   4.044   2.368
  313    HE1  MET  43           HE1      MET  43 -13.223   2.593   0.113
  314    HE2  MET  43           HE2      MET  43 -14.715   3.518   0.278
  315    HE3  MET  43           HE3      MET  43 -14.755   1.898  -0.417
  316    H    THR  44           H        THR  44 -11.958  -0.204   3.873
  317    HA   THR  44           HA       THR  44  -9.514  -0.245   5.520
  318    HB   THR  44           HB       THR  44 -10.300  -2.833   4.425
  319    HG1  THR  44           HG1      THR  44 -12.388  -2.124   4.781
  320   HG21  THR  44          HG21      THR  44  -9.868  -3.643   6.603
  321   HG22  THR  44          HG22      THR  44  -9.982  -2.027   7.298
  322   HG23  THR  44          HG23      THR  44  -8.631  -2.439   6.242
  323    H    LEU  45           H        LEU  45  -7.621  -0.323   4.478
  324    HA   LEU  45           HA       LEU  45  -7.668  -0.413   1.563
  325    HB2  LEU  45           HB2      LEU  45  -5.354   0.194   3.401
  326    HB3  LEU  45           HB3      LEU  45  -5.411   0.455   1.668
  327    HG   LEU  45           HG       LEU  45  -7.523   1.958   2.435
  328   HD11  LEU  45          HD11      LEU  45  -5.649   2.794   4.538
  329   HD12  LEU  45          HD12      LEU  45  -6.527   1.299   4.861
  330   HD13  LEU  45          HD13      LEU  45  -7.413   2.786   4.520
  331   HD21  LEU  45          HD21      LEU  45  -5.899   2.843   0.991
  332   HD22  LEU  45          HD22      LEU  45  -4.612   2.650   2.181
  333   HD23  LEU  45          HD23      LEU  45  -5.851   3.883   2.415
  334    H    ASN  46           H        ASN  46  -6.845  -2.035   0.369
  335    HA   ASN  46           HA       ASN  46  -5.337  -4.147   1.757
  336    HB2  ASN  46           HB2      ASN  46  -6.538  -5.778   0.217
  337    HB3  ASN  46           HB3      ASN  46  -7.505  -5.079   1.513
  338   HD21  ASN  46          HD21      ASN  46  -9.047  -3.495   1.009
  339   HD22  ASN  46          HD22      ASN  46  -9.667  -3.319  -0.594
  340    H    VAL  47           H        VAL  47  -4.356  -5.700   0.049
  341    HA   VAL  47           HA       VAL  47  -2.891  -4.021  -1.837
  342    HB   VAL  47           HB       VAL  47  -1.364  -5.935  -2.068
  343   HG11  VAL  47          HG11      VAL  47  -1.821  -5.459   0.860
  344   HG12  VAL  47          HG12      VAL  47  -1.218  -4.192  -0.208
  345   HG13  VAL  47          HG13      VAL  47  -0.296  -5.681   0.002
  346   HG21  VAL  47          HG21      VAL  47  -2.186  -7.972  -1.680
  347   HG22  VAL  47          HG22      VAL  47  -3.554  -7.328  -0.772
  348   HG23  VAL  47          HG23      VAL  47  -2.014  -7.616   0.039
  349    H    GLN  48           H        GLN  48  -2.641  -4.551  -4.032
  350    HA   GLN  48           HA       GLN  48  -4.965  -5.848  -5.180
  351    HB2  GLN  48           HB2      GLN  48  -3.833  -5.100  -7.368
  352    HB3  GLN  48           HB3      GLN  48  -4.470  -3.861  -6.298
  353    HG2  GLN  48           HG2      GLN  48  -2.272  -3.298  -7.246
  354    HG3  GLN  48           HG3      GLN  48  -2.272  -3.352  -5.485
  355   HE21  GLN  48          HE21      GLN  48  -0.692  -4.441  -4.559
  356   HE22  GLN  48          HE22      GLN  48   0.291  -5.645  -5.314
  357    H    GLU  49           H        GLU  49  -1.771  -6.711  -4.389
  358    HA   GLU  49           HA       GLU  49  -2.129  -9.303  -5.616
  359    HB2  GLU  49           HB2      GLU  49   0.011  -7.386  -6.500
  360    HB3  GLU  49           HB3      GLU  49   0.254  -9.124  -6.606
  361    HG2  GLU  49           HG2      GLU  49  -1.737  -9.308  -8.021
  362    HG3  GLU  49           HG3      GLU  49  -1.950  -7.561  -7.932
  363    H    ARG  50           H        ARG  50  -0.183 -10.742  -5.082
  364    HA   ARG  50           HA       ARG  50   0.217 -10.662  -2.275
  365    HB2  ARG  50           HB2      ARG  50   1.317 -12.381  -4.484
  366    HB3  ARG  50           HB3      ARG  50   1.879 -12.558  -2.828
  367    HG2  ARG  50           HG2      ARG  50   0.210 -14.165  -3.049
  368    HG3  ARG  50           HG3      ARG  50  -0.582 -12.832  -2.207
  369    HD2  ARG  50           HD2      ARG  50  -1.939 -13.828  -4.045
  370    HD3  ARG  50           HD3      ARG  50  -1.641 -12.099  -4.221
  371    HE   ARG  50           HE       ARG  50  -0.433 -12.528  -6.120
  372   HH11  ARG  50          HH11      ARG  50  -0.937 -15.518  -4.392
  373   HH12  ARG  50          HH12      ARG  50  -0.324 -16.507  -5.673
  374   HH21  ARG  50          HH21      ARG  50   0.375 -13.829  -7.807
  375   HH22  ARG  50          HH22      ARG  50   0.422 -15.549  -7.611
  376    H    GLY  51           H        GLY  51   1.906  -9.980  -1.064
  377    HA2  GLY  51           HA2      GLY  51   4.535  -9.677  -1.670
  378    HA3  GLY  51           HA3      GLY  51   3.811  -8.212  -2.314
  379    H    ARG  52           H        ARG  52   5.616  -7.718  -0.505
  380    HA   ARG  52           HA       ARG  52   4.354  -7.567   2.126
  381    HB2  ARG  52           HB2      ARG  52   7.135  -7.377   1.102
  382    HB3  ARG  52           HB3      ARG  52   6.750  -6.428   2.532
  383    HG2  ARG  52           HG2      ARG  52   7.425  -8.344   3.537
  384    HG3  ARG  52           HG3      ARG  52   5.714  -8.727   3.331
  385    HD2  ARG  52           HD2      ARG  52   7.018 -10.615   2.622
  386    HD3  ARG  52           HD3      ARG  52   6.280  -9.871   1.204
  387    HE   ARG  52           HE       ARG  52   8.371  -9.349   0.426
  388   HH11  ARG  52          HH11      ARG  52   8.603 -10.264   3.786
  389   HH12  ARG  52          HH12      ARG  52  10.334 -10.295   3.787
  390   HH21  ARG  52          HH21      ARG  52  10.648  -9.390   0.426
  391   HH22  ARG  52          HH22      ARG  52  11.495  -9.799   1.880
  392    H    VAL  53           H        VAL  53   3.267  -5.821   2.715
  393    HA   VAL  53           HA       VAL  53   3.382  -3.408   1.136
  394    HB   VAL  53           HB       VAL  53   1.823  -3.893   3.676
  395   HG11  VAL  53          HG11      VAL  53   1.486  -1.887   1.450
  396   HG12  VAL  53          HG12      VAL  53   2.010  -1.549   3.100
  397   HG13  VAL  53          HG13      VAL  53   0.366  -2.111   2.794
  398   HG21  VAL  53          HG21      VAL  53   0.725  -4.154   0.896
  399   HG22  VAL  53          HG22      VAL  53   0.029  -4.710   2.418
  400   HG23  VAL  53          HG23      VAL  53   1.436  -5.529   1.741
  401    H    LYS  54           H        LYS  54   4.453  -1.586   1.599
  402    HA   LYS  54           HA       LYS  54   5.770  -1.398   4.229
  403    HB2  LYS  54           HB2      LYS  54   6.760  -0.093   1.699
  404    HB3  LYS  54           HB3      LYS  54   7.627  -0.320   3.212
  405    HG2  LYS  54           HG2      LYS  54   7.664  -2.732   2.834
  406    HG3  LYS  54           HG3      LYS  54   6.790  -2.506   1.317
  407    HD2  LYS  54           HD2      LYS  54   8.926  -2.574   0.512
  408    HD3  LYS  54           HD3      LYS  54   8.796  -0.844   0.835
  409    HE2  LYS  54           HE2      LYS  54   9.780  -1.321   3.110
  410    HE3  LYS  54           HE3      LYS  54  10.123  -2.950   2.528
  411    HZ1  LYS  54           HZ1      LYS  54  11.152  -0.427   1.345
  412    HZ2  LYS  54           HZ2      LYS  54  11.464  -1.981   0.755
  413    HZ3  LYS  54           HZ3      LYS  54  12.043  -1.523   2.277
  414    H    TYR  55           H        TYR  55   4.731   0.037   5.445
  415    HA   TYR  55           HA       TYR  55   2.990   2.018   4.541
  416    HB2  TYR  55           HB2      TYR  55   4.370   1.441   7.116
  417    HB3  TYR  55           HB3      TYR  55   3.638   3.030   6.920
  418    HD1  TYR  55           HD1      TYR  55   2.443  -0.257   5.646
  419    HD2  TYR  55           HD2      TYR  55   1.780   2.973   8.334
  420    HE1  TYR  55           HE1      TYR  55   0.250  -1.202   6.232
  421    HE2  TYR  55           HE2      TYR  55  -0.415   2.036   8.928
  422    HH   TYR  55           HH       TYR  55  -1.345  -1.097   8.160
  423    H    ILE  56           H        ILE  56   3.220   4.075   3.886
  424    HA   ILE  56           HA       ILE  56   5.953   5.142   3.720
  425    HB   ILE  56           HB       ILE  56   3.554   5.400   1.977
  426   HG12  ILE  56          HG12      ILE  56   5.195   5.180   0.208
  427   HG13  ILE  56          HG13      ILE  56   6.513   5.392   1.355
  428   HG21  ILE  56          HG21      ILE  56   4.649   7.433   0.902
  429   HG22  ILE  56          HG22      ILE  56   5.539   7.612   2.414
  430   HG23  ILE  56          HG23      ILE  56   3.778   7.697   2.413
  431   HD11  ILE  56          HD11      ILE  56   5.833   3.289   2.454
  432   HD12  ILE  56          HD12      ILE  56   6.321   3.078   0.773
  433   HD13  ILE  56          HD13      ILE  56   4.610   3.069   1.203
  434    H    LYS  57           H        LYS  57   2.624   6.318   4.147
  435    HA   LYS  57           HA       LYS  57   3.444   8.784   5.312
  436    HB2  LYS  57           HB2      LYS  57   0.999   7.524   4.465
  437    HB3  LYS  57           HB3      LYS  57   0.774   8.265   6.045
  438    HG2  LYS  57           HG2      LYS  57   1.814   9.654   3.583
  439    HG3  LYS  57           HG3      LYS  57   0.180   9.788   4.236
  440    HD2  LYS  57           HD2      LYS  57   1.372  10.532   6.411
  441    HD3  LYS  57           HD3      LYS  57   2.758  10.824   5.358
  442    HE2  LYS  57           HE2      LYS  57   1.391  12.313   3.978
  443    HE3  LYS  57           HE3      LYS  57   0.007  12.019   5.030
  444    HZ1  LYS  57           HZ1      LYS  57   1.060  14.086   5.611
  445    HZ2  LYS  57           HZ2      LYS  57   2.558  13.326   5.806
  446    HZ3  LYS  57           HZ3      LYS  57   1.290  12.978   6.870
  447    H    ARG  58           H        ARG  58   2.628   9.463   7.512
  448    HA   ARG  58           HA       ARG  58   3.483   7.465   9.455
  449    HB2  ARG  58           HB2      ARG  58   3.331  10.421   9.374
  450    HB3  ARG  58           HB3      ARG  58   3.054   9.677  10.943
  451    HG2  ARG  58           HG2      ARG  58   5.281   8.357  10.066
  452    HG3  ARG  58           HG3      ARG  58   5.521   9.980   9.417
  453    HD2  ARG  58           HD2      ARG  58   4.815   9.418  12.291
  454    HD3  ARG  58           HD3      ARG  58   6.471   9.587  11.710
  455    HE   ARG  58           HE       ARG  58   5.024  11.834  10.893
  456   HH11  ARG  58          HH11      ARG  58   6.177  10.364  13.840
  457   HH12  ARG  58          HH12      ARG  58   6.312  11.869  14.686
  458   HH21  ARG  58          HH21      ARG  58   5.201  13.814  12.003
  459   HH22  ARG  58          HH22      ARG  58   5.757  13.828  13.643
  460    HA   PRO  59           HA       PRO  59  -0.463   6.588  11.194
  461    HB2  PRO  59           HB2      PRO  59  -0.066   6.840  13.883
  462    HB3  PRO  59           HB3      PRO  59   0.526   5.473  12.934
  463    HG2  PRO  59           HG2      PRO  59   1.990   7.916  13.855
  464    HG3  PRO  59           HG3      PRO  59   2.528   6.225  13.846
  465    HD2  PRO  59           HD2      PRO  59   3.310   7.985  11.960
  466    HD3  PRO  59           HD3      PRO  59   3.041   6.269  11.592
  467    H    GLY  60           H        GLY  60  -2.284   7.731  11.297
  468    HA2  GLY  60           HA2      GLY  60  -3.765   9.330  12.180
  469    HA3  GLY  60           HA3      GLY  60  -2.396  10.176  12.885
  470    H    ALA  61           H        ALA  61  -1.049   9.923  10.139
  471    HA   ALA  61           HA       ALA  61  -1.565  12.494   9.219
  472    HB1  ALA  61           HB1      ALA  61   0.474  11.325   8.661
  473    HB2  ALA  61           HB2      ALA  61  -0.349  11.822   7.183
  474    HB3  ALA  61           HB3      ALA  61  -0.429  10.142   7.714
  475    H    VAL  62           H        VAL  62  -2.839  13.362   7.634
  476    HA   VAL  62           HA       VAL  62  -5.235  11.914   6.973
  477    HB   VAL  62           HB       VAL  62  -5.942  13.974   5.836
  478   HG11  VAL  62          HG11      VAL  62  -6.335  13.767   8.219
  479   HG12  VAL  62          HG12      VAL  62  -5.963  15.442   7.809
  480   HG13  VAL  62          HG13      VAL  62  -4.735  14.425   8.562
  481   HG21  VAL  62          HG21      VAL  62  -3.164  14.935   6.508
  482   HG22  VAL  62          HG22      VAL  62  -4.482  15.985   5.987
  483   HG23  VAL  62          HG23      VAL  62  -3.867  14.737   4.903
  484    H    LEU  63           H        LEU  63  -5.612  10.766   5.194
  485    HA   LEU  63           HA       LEU  63  -3.591  10.619   3.132
  486    HB2  LEU  63           HB2      LEU  63  -6.194   9.150   3.533
  487    HB3  LEU  63           HB3      LEU  63  -5.112   8.858   2.186
  488    HG   LEU  63           HG       LEU  63  -4.738   7.158   3.828
  489   HD11  LEU  63          HD11      LEU  63  -2.400   8.850   4.443
  490   HD12  LEU  63          HD12      LEU  63  -2.768   8.609   2.735
  491   HD13  LEU  63          HD13      LEU  63  -2.481   7.218   3.781
  492   HD21  LEU  63          HD21      LEU  63  -3.896   9.125   5.901
  493   HD22  LEU  63          HD22      LEU  63  -4.498   7.477   6.086
  494   HD23  LEU  63          HD23      LEU  63  -5.614   8.785   5.691
  495    H    GLU  64           H        GLU  64  -3.780  11.266   1.027
  496    HA   GLU  64           HA       GLU  64  -6.130  12.917   0.391
  497    HB2  GLU  64           HB2      GLU  64  -4.376  14.417   0.355
  498    HB3  GLU  64           HB3      GLU  64  -3.216  13.217  -0.187
  499    HG2  GLU  64           HG2      GLU  64  -3.484  14.720  -1.964
  500    HG3  GLU  64           HG3      GLU  64  -4.382  13.276  -2.420
  501    H    ALA  65           H        ALA  65  -6.909  12.886  -1.774
  502    HA   ALA  65           HA       ALA  65  -7.155  10.312  -2.874
  503    HB1  ALA  65           HB1      ALA  65  -7.679  12.785  -4.477
  504    HB2  ALA  65           HB2      ALA  65  -8.700  12.371  -3.100
  505    HB3  ALA  65           HB3      ALA  65  -8.560  11.258  -4.460
  506    H    GLY  66           H        GLY  66  -5.423   9.259  -3.655
  507    HA2  GLY  66           HA2      GLY  66  -4.142   8.850  -5.660
  508    HA3  GLY  66           HA3      GLY  66  -3.919  10.586  -5.815
  509    H    CYS  67           H        CYS  67  -3.431  10.518  -2.750
  510    HA   CYS  67           HA       CYS  67  -0.615  10.567  -2.897
  511    HB2  CYS  67           HB2      CYS  67  -1.985  11.830  -1.236
  512    HB3  CYS  67           HB3      CYS  67  -2.324  10.310  -0.415
  513    HG   CYS  67           HG       CYS  67   0.641  11.131  -0.647
  514    H    VAL  68           H        VAL  68   0.938   9.173  -2.003
  515    HA   VAL  68           HA       VAL  68   0.246   6.378  -2.198
  516    HB   VAL  68           HB       VAL  68   2.923   7.500  -1.384
  517   HG11  VAL  68          HG11      VAL  68   3.809   5.439  -2.189
  518   HG12  VAL  68          HG12      VAL  68   2.252   4.970  -2.873
  519   HG13  VAL  68          HG13      VAL  68   2.458   5.052  -1.123
  520   HG21  VAL  68          HG21      VAL  68   2.917   8.556  -3.367
  521   HG22  VAL  68          HG22      VAL  68   1.553   7.618  -3.974
  522   HG23  VAL  68          HG23      VAL  68   3.182   6.946  -4.036
  523    H    VAL  69           H        VAL  69  -0.792   5.517  -0.500
  524    HA   VAL  69           HA       VAL  69  -0.243   6.362   2.206
  525    HB   VAL  69           HB       VAL  69  -1.978   4.057   1.319
  526   HG11  VAL  69          HG11      VAL  69  -1.500   5.480   3.878
  527   HG12  VAL  69          HG12      VAL  69  -1.847   3.778   3.574
  528   HG13  VAL  69          HG13      VAL  69  -3.150   4.966   3.524
  529   HG21  VAL  69          HG21      VAL  69  -2.616   6.988   1.573
  530   HG22  VAL  69          HG22      VAL  69  -3.851   5.728   1.571
  531   HG23  VAL  69          HG23      VAL  69  -2.814   5.949   0.161
  532    H    ALA  70           H        ALA  70   0.765   3.809   0.090
  533    HA   ALA  70           HA       ALA  70   2.741   2.925   1.950
  534    HB1  ALA  70           HB1      ALA  70   0.523   1.799   2.658
  535    HB2  ALA  70           HB2      ALA  70   1.979   0.812   2.530
  536    HB3  ALA  70           HB3      ALA  70   0.777   0.781   1.240
  537    H    ARG  71           H        ARG  71   3.261   0.393   0.908
  538    HA   ARG  71           HA       ARG  71   3.514   0.761  -1.983
  539    HB2  ARG  71           HB2      ARG  71   5.791   0.456  -0.041
  540    HB3  ARG  71           HB3      ARG  71   5.954  -0.029  -1.722
  541    HG2  ARG  71           HG2      ARG  71   5.085   2.729  -0.915
  542    HG3  ARG  71           HG3      ARG  71   6.779   2.281  -1.122
  543    HD2  ARG  71           HD2      ARG  71   5.133   1.440  -3.360
  544    HD3  ARG  71           HD3      ARG  71   5.057   3.181  -3.094
  545    HE   ARG  71           HE       ARG  71   7.305   1.668  -4.046
  546   HH11  ARG  71          HH11      ARG  71   6.312   4.598  -2.431
  547   HH12  ARG  71          HH12      ARG  71   7.738   5.474  -2.874
  548   HH21  ARG  71          HH21      ARG  71   9.182   2.819  -4.630
  549   HH22  ARG  71          HH22      ARG  71   9.368   4.465  -4.123
  550    H    LEU  72           H        LEU  72   4.914  -1.330  -2.760
  551    HA   LEU  72           HA       LEU  72   3.951  -3.704  -1.353
  552    HB2  LEU  72           HB2      LEU  72   2.797  -2.677  -3.755
  553    HB3  LEU  72           HB3      LEU  72   3.609  -4.184  -4.132
  554    HG   LEU  72           HG       LEU  72   1.201  -4.446  -3.569
  555   HD11  LEU  72          HD11      LEU  72   2.892  -6.256  -3.271
  556   HD12  LEU  72          HD12      LEU  72   1.485  -6.391  -2.216
  557   HD13  LEU  72          HD13      LEU  72   3.014  -5.788  -1.575
  558   HD21  LEU  72          HD21      LEU  72   1.403  -2.613  -1.746
  559   HD22  LEU  72          HD22      LEU  72   1.916  -3.944  -0.709
  560   HD23  LEU  72          HD23      LEU  72   0.329  -3.985  -1.476
  561    H    GLU  73           H        GLU  73   5.525  -5.143  -1.176
  562    HA   GLU  73           HA       GLU  73   7.940  -4.828  -2.765
  563    HB2  GLU  73           HB2      GLU  73   7.617  -5.367  -0.148
  564    HB3  GLU  73           HB3      GLU  73   7.732  -7.008  -0.766
  565    HG2  GLU  73           HG2      GLU  73   9.766  -5.048  -1.664
  566    HG3  GLU  73           HG3      GLU  73   9.856  -5.635  -0.004
  567    H    LEU  74           H        LEU  74   6.911  -5.546  -4.762
  568    HA   LEU  74           HA       LEU  74   5.835  -8.125  -5.096
  569    HB2  LEU  74           HB2      LEU  74   6.960  -6.059  -6.933
  570    HB3  LEU  74           HB3      LEU  74   6.660  -7.670  -7.556
  571    HG   LEU  74           HG       LEU  74   4.779  -6.221  -8.043
  572   HD11  LEU  74          HD11      LEU  74   3.983  -8.113  -5.842
  573   HD12  LEU  74          HD12      LEU  74   4.422  -8.631  -7.469
  574   HD13  LEU  74          HD13      LEU  74   3.017  -7.593  -7.223
  575   HD21  LEU  74          HD21      LEU  74   4.018  -5.944  -5.196
  576   HD22  LEU  74          HD22      LEU  74   3.736  -4.860  -6.559
  577   HD23  LEU  74          HD23      LEU  74   5.320  -4.909  -5.784
  578    H    ASP  75           H        ASP  75   9.087  -7.004  -4.827
  579    HA   ASP  75           HA       ASP  75  11.128  -7.995  -5.127
  580    HB2  ASP  75           HB2      ASP  75  10.279  -9.063  -3.070
  581    HB3  ASP  75           HB3      ASP  75   9.585 -10.359  -4.039
  582    H    ASP  76           H        ASP  76  10.105  -7.848  -7.559
  583    HA   ASP  76           HA       ASP  76   9.873 -10.404  -8.850
  584    HB2  ASP  76           HB2      ASP  76   9.918  -9.008 -10.954
  585    HB3  ASP  76           HB3      ASP  76   8.638  -8.600  -9.815
  586    H    LEU  77           H        LEU  77  11.439 -11.611  -9.716
  587    HA   LEU  77           HA       LEU  77  14.185 -10.680  -9.509
  588    HB2  LEU  77           HB2      LEU  77  12.903 -13.345 -10.006
  589    HB3  LEU  77           HB3      LEU  77  14.612 -13.104 -10.314
  590    HG   LEU  77           HG       LEU  77  14.900 -12.412  -7.941
  591   HD11  LEU  77          HD11      LEU  77  13.070 -13.005  -6.368
  592   HD12  LEU  77          HD12      LEU  77  12.007 -13.230  -7.757
  593   HD13  LEU  77          HD13      LEU  77  12.693 -11.641  -7.420
  594   HD21  LEU  77          HD21      LEU  77  15.367 -14.700  -8.654
  595   HD22  LEU  77          HD22      LEU  77  13.684 -15.140  -8.363
  596   HD23  LEU  77          HD23      LEU  77  14.716 -14.663  -7.015
  597    H    GLU  78           H        GLU  78  12.380  -9.601 -11.601
  598    HA   GLU  78           HA       GLU  78  13.184 -10.727 -14.099
  599    HB2  GLU  78           HB2      GLU  78  12.059  -8.820 -15.105
  600    HB3  GLU  78           HB3      GLU  78  11.063  -9.503 -13.828
  601    HG2  GLU  78           HG2      GLU  78  10.845  -7.291 -13.359
  602    HG3  GLU  78           HG3      GLU  78  12.254  -7.672 -12.370
  603    H    HIS  79           H        HIS  79  14.486  -8.345 -11.950
  604    HA   HIS  79           HA       HIS  79  16.046  -6.824 -13.676
  605    HB2  HIS  79           HB2      HIS  79  16.078  -7.472 -10.798
  606    HB3  HIS  79           HB3      HIS  79  17.617  -6.934 -11.463
  607    HD1  HIS  79           HD1      HIS  79  14.404  -5.702 -10.254
  608    HD2  HIS  79           HD2      HIS  79  17.455  -4.297 -12.700
  609    HE1  HIS  79           HE1      HIS  79  14.046  -3.218 -10.416
  610    HE2  HIS  79           HE2      HIS  79  15.852  -2.402 -11.972
  611    H    HIS  80           H        HIS  80  16.502 -10.067 -12.504
  612    HA   HIS  80           HA       HIS  80  19.221 -10.172 -13.571
  613    HB2  HIS  80           HB2      HIS  80  18.486 -11.179 -11.303
  614    HB3  HIS  80           HB3      HIS  80  17.782 -12.471 -12.270
  615    HD1  HIS  80           HD1      HIS  80  19.948 -13.299 -10.403
  616    HD2  HIS  80           HD2      HIS  80  20.743 -11.948 -14.251
  617    HE1  HIS  80           HE1      HIS  80  22.209 -14.230 -10.989
  618    HE2  HIS  80           HE2      HIS  80  22.707 -13.327 -13.287
  619    H    HIS  81           H        HIS  81  17.264  -9.790 -15.499
  620    HA   HIS  81           HA       HIS  81  17.059 -12.426 -16.793
  621    HB2  HIS  81           HB2      HIS  81  14.900 -11.302 -16.395
  622    HB3  HIS  81           HB3      HIS  81  15.455  -9.917 -17.329
  623    HD1  HIS  81           HD1      HIS  81  15.946 -13.513 -18.366
  624    HD2  HIS  81           HD2      HIS  81  13.710 -10.179 -19.439
  625    HE1  HIS  81           HE1      HIS  81  14.821 -14.126 -20.530
  626    HE2  HIS  81           HE2      HIS  81  13.543 -12.062 -21.204
  627    H    HIS  82           H        HIS  82  18.374 -12.800 -18.440
  628    HA   HIS  82           HA       HIS  82  19.811 -12.505 -20.177
  629    HB2  HIS  82           HB2      HIS  82  17.698 -11.359 -21.070
  630    HB3  HIS  82           HB3      HIS  82  18.494  -9.840 -20.672
  631    HD1  HIS  82           HD1      HIS  82  18.253  -9.497 -23.352
  632    HD2  HIS  82           HD2      HIS  82  20.993 -12.346 -22.071
  633    HE1  HIS  82           HE1      HIS  82  19.761  -9.912 -25.321
  634    HE2  HIS  82           HE2      HIS  82  21.358 -11.702 -24.549
  635    H    HIS  83           H        HIS  83  20.660 -11.662 -17.604
  636    HA   HIS  83           HA       HIS  83  22.338  -9.327 -18.224
  637    HB2  HIS  83           HB2      HIS  83  20.850  -9.226 -16.194
  638    HB3  HIS  83           HB3      HIS  83  21.811 -10.530 -15.502
  639    HD1  HIS  83           HD1      HIS  83  23.769  -9.821 -14.156
  640    HD2  HIS  83           HD2      HIS  83  22.507  -6.837 -16.757
  641    HE1  HIS  83           HE1      HIS  83  25.187  -7.815 -13.617
  642    HE2  HIS  83           HE2      HIS  83  24.349  -5.998 -15.148
  643    H    HIS  84           H        HIS  84  22.946 -11.911 -19.262
  644    HA   HIS  84           HA       HIS  84  25.126 -12.930 -17.626
  645    HB2  HIS  84           HB2      HIS  84  23.620 -14.507 -18.792
  646    HB3  HIS  84           HB3      HIS  84  24.142 -13.845 -20.337
  647    HD1  HIS  84           HD1      HIS  84  26.257 -14.916 -17.363
  648    HD2  HIS  84           HD2      HIS  84  25.679 -15.820 -21.378
  649    HE1  HIS  84           HE1      HIS  84  28.018 -16.619 -17.929
  650    HE2  HIS  84           HE2      HIS  84  27.593 -17.216 -20.339
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1   3.421   9.352 -14.142
    2    H2   MET   1           H2       MET   1   5.116   9.391 -14.391
    3    H3   MET   1           H3       MET   1   4.050   9.572 -15.724
    4    HA   MET   1           HA       MET   1   3.185   7.326 -15.168
    5    HB2  MET   1           HB2      MET   1   4.907   8.121 -16.963
    6    HB3  MET   1           HB3      MET   1   6.084   7.299 -15.948
    7    HG2  MET   1           HG2      MET   1   4.518   5.275 -16.120
    8    HG3  MET   1           HG3      MET   1   3.779   6.143 -17.465
    9    HE1  MET   1           HE1      MET   1   6.819   4.562 -15.930
   10    HE2  MET   1           HE2      MET   1   7.797   5.901 -16.533
   11    HE3  MET   1           HE3      MET   1   7.954   4.299 -17.254
   12    H    GLU   2           H        GLU   2   3.826   8.203 -12.556
   13    HA   GLU   2           HA       GLU   2   5.722   6.186 -11.585
   14    HB2  GLU   2           HB2      GLU   2   5.804   8.700 -10.930
   15    HB3  GLU   2           HB3      GLU   2   4.461   8.301  -9.868
   16    HG2  GLU   2           HG2      GLU   2   6.228   8.040  -8.449
   17    HG3  GLU   2           HG3      GLU   2   6.050   6.395  -9.058
   18    H    ASN   3           H        ASN   3   3.119   5.419 -12.518
   19    HA   ASN   3           HA       ASN   3   1.755   4.684 -10.021
   20    HB2  ASN   3           HB2      ASN   3  -0.135   4.037 -11.591
   21    HB3  ASN   3           HB3      ASN   3   0.235   5.757 -11.501
   22   HD21  ASN   3          HD21      ASN   3   1.090   6.794 -13.264
   23   HD22  ASN   3          HD22      ASN   3   1.179   6.069 -14.830
   24    H    ASP   4           H        ASP   4   3.835   3.214 -10.037
   25    HA   ASP   4           HA       ASP   4   3.603   0.840 -11.659
   26    HB2  ASP   4           HB2      ASP   4   5.546   1.927  -9.707
   27    HB3  ASP   4           HB3      ASP   4   5.454   0.171  -9.805
   28    HA   PRO   5           HA       PRO   5   1.193  -1.666  -8.955
   29    HB2  PRO   5           HB2      PRO   5   2.371  -4.100  -9.180
   30    HB3  PRO   5           HB3      PRO   5   1.411  -3.376 -10.475
   31    HG2  PRO   5           HG2      PRO   5   4.386  -3.463 -10.143
   32    HG3  PRO   5           HG3      PRO   5   3.415  -3.734 -11.602
   33    HD2  PRO   5           HD2      PRO   5   4.673  -1.389 -11.105
   34    HD3  PRO   5           HD3      PRO   5   3.134  -1.478 -11.987
   35    H    THR   6           H        THR   6   4.629  -1.485  -8.421
   36    HA   THR   6           HA       THR   6   4.445  -2.711  -5.788
   37    HB   THR   6           HB       THR   6   6.869  -2.417  -5.703
   38    HG1  THR   6           HG1      THR   6   6.608  -1.156  -8.227
   39   HG21  THR   6          HG21      THR   6   6.167  -3.393  -8.454
   40   HG22  THR   6          HG22      THR   6   5.936  -4.343  -6.986
   41   HG23  THR   6          HG23      THR   6   7.557  -3.840  -7.466
   42    H    VAL   7           H        VAL   7   2.911  -0.361  -6.071
   43    HA   VAL   7           HA       VAL   7   4.138   1.256  -3.987
   44    HB   VAL   7           HB       VAL   7   3.022   2.611  -6.436
   45   HG11  VAL   7          HG11      VAL   7   4.905   3.982  -4.641
   46   HG12  VAL   7          HG12      VAL   7   3.339   3.583  -3.934
   47   HG13  VAL   7          HG13      VAL   7   3.422   4.566  -5.396
   48   HG21  VAL   7          HG21      VAL   7   5.871   1.915  -5.765
   49   HG22  VAL   7          HG22      VAL   7   5.443   3.202  -6.891
   50   HG23  VAL   7          HG23      VAL   7   4.972   1.538  -7.234
   51    H    LEU   8           H        LEU   8   2.676   1.542  -2.453
   52    HA   LEU   8           HA       LEU   8  -0.141   1.138  -3.049
   53    HB2  LEU   8           HB2      LEU   8   1.403   0.395  -0.937
   54    HB3  LEU   8           HB3      LEU   8   0.652   1.847  -0.302
   55    HG   LEU   8           HG       LEU   8  -0.682  -0.016   0.365
   56   HD11  LEU   8          HD11      LEU   8  -2.756   0.729  -0.292
   57   HD12  LEU   8          HD12      LEU   8  -2.249   1.009  -1.957
   58   HD13  LEU   8          HD13      LEU   8  -1.747   2.121  -0.684
   59   HD21  LEU   8          HD21      LEU   8  -0.165  -1.791  -1.011
   60   HD22  LEU   8          HD22      LEU   8  -0.371  -0.846  -2.486
   61   HD23  LEU   8          HD23      LEU   8  -1.784  -1.370  -1.570
   62    H    ARG   9           H        ARG   9  -1.710   2.667  -2.927
   63    HA   ARG   9           HA       ARG   9  -1.097   5.315  -1.891
   64    HB2  ARG   9           HB2      ARG   9  -1.785   4.781  -4.779
   65    HB3  ARG   9           HB3      ARG   9  -2.000   6.356  -4.028
   66    HG2  ARG   9           HG2      ARG   9   0.296   6.670  -3.752
   67    HG3  ARG   9           HG3      ARG   9   0.648   4.956  -3.984
   68    HD2  ARG   9           HD2      ARG   9  -0.622   6.527  -6.184
   69    HD3  ARG   9           HD3      ARG   9   1.114   6.657  -5.904
   70    HE   ARG   9           HE       ARG   9   0.737   3.994  -6.003
   71   HH11  ARG   9          HH11      ARG   9  -0.241   6.586  -8.127
   72   HH12  ARG   9          HH12      ARG   9  -0.206   5.600  -9.550
   73   HH21  ARG   9          HH21      ARG   9   0.782   2.697  -7.873
   74   HH22  ARG   9          HH22      ARG   9   0.373   3.392  -9.406
   75    H    SER  10           H        SER  10  -2.875   6.385  -1.142
   76    HA   SER  10           HA       SER  10  -5.237   4.884  -0.696
   77    HB2  SER  10           HB2      SER  10  -4.261   7.602  -0.015
   78    HB3  SER  10           HB3      SER  10  -6.010   7.377  -0.022
   79    HG   SER  10           HG       SER  10  -5.457   6.783   1.980
   80    HA   PRO  11           HA       PRO  11  -7.551   5.896  -4.326
   81    HB2  PRO  11           HB2      PRO  11 -10.064   5.467  -3.432
   82    HB3  PRO  11           HB3      PRO  11  -8.925   4.147  -3.726
   83    HG2  PRO  11           HG2      PRO  11  -9.672   5.465  -1.143
   84    HG3  PRO  11           HG3      PRO  11  -9.458   3.740  -1.498
   85    HD2  PRO  11           HD2      PRO  11  -7.552   5.247  -0.279
   86    HD3  PRO  11           HD3      PRO  11  -7.169   3.858  -1.315
   87    H    SER  12           H        SER  12  -8.225   7.499  -1.288
   88    HA   SER  12           HA       SER  12  -8.801   9.961  -2.700
   89    HB2  SER  12           HB2      SER  12 -10.941  10.372  -1.662
   90    HB3  SER  12           HB3      SER  12 -11.019   8.811  -2.478
   91    HG   SER  12           HG       SER  12 -10.862   7.786  -0.527
   92    H    ALA  13           H        ALA  13  -9.456  11.674  -0.860
   93    HA   ALA  13           HA       ALA  13  -7.167  11.779   0.860
   94    HB1  ALA  13           HB1      ALA  13  -7.957  13.810  -0.162
   95    HB2  ALA  13           HB2      ALA  13  -8.120  13.947   1.589
   96    HB3  ALA  13           HB3      ALA  13  -9.539  13.620   0.594
   97    H    GLY  14           H        GLY  14  -7.028  10.817   2.771
   98    HA2  GLY  14           HA2      GLY  14  -9.386  10.804   4.521
   99    HA3  GLY  14           HA3      GLY  14  -8.577   9.281   4.187
  100    H    LYS  15           H        LYS  15  -7.754   8.787   6.149
  101    HA   LYS  15           HA       LYS  15  -5.457  10.250   7.040
  102    HB2  LYS  15           HB2      LYS  15  -7.419  11.508   8.033
  103    HB3  LYS  15           HB3      LYS  15  -7.763  10.066   8.978
  104    HG2  LYS  15           HG2      LYS  15  -4.995  11.035   9.144
  105    HG3  LYS  15           HG3      LYS  15  -6.218  12.112   9.820
  106    HD2  LYS  15           HD2      LYS  15  -6.320   9.213  10.504
  107    HD3  LYS  15           HD3      LYS  15  -5.104  10.227  11.284
  108    HE2  LYS  15           HE2      LYS  15  -6.846  10.422  12.766
  109    HE3  LYS  15           HE3      LYS  15  -7.143  11.810  11.720
  110    HZ1  LYS  15           HZ1      LYS  15  -8.831  10.635  10.576
  111    HZ2  LYS  15           HZ2      LYS  15  -9.132  10.416  12.225
  112    HZ3  LYS  15           HZ3      LYS  15  -8.432   9.169  11.322
  113    H    LEU  16           H        LEU  16  -4.105   9.008   8.285
  114    HA   LEU  16           HA       LEU  16  -4.518   6.203   8.250
  115    HB2  LEU  16           HB2      LEU  16  -2.308   7.518   8.199
  116    HB3  LEU  16           HB3      LEU  16  -2.475   7.615   9.939
  117    HG   LEU  16           HG       LEU  16  -2.347   5.218  10.154
  118   HD11  LEU  16          HD11      LEU  16  -1.846   3.863   8.070
  119   HD12  LEU  16          HD12      LEU  16  -2.441   5.246   7.151
  120   HD13  LEU  16          HD13      LEU  16  -3.511   4.408   8.276
  121   HD21  LEU  16          HD21      LEU  16  -0.107   5.090   9.901
  122   HD22  LEU  16          HD22      LEU  16  -0.273   6.806   9.528
  123   HD23  LEU  16          HD23      LEU  16  -0.155   5.627   8.222
  124    H    THR  17           H        THR  17  -6.268   5.558   9.440
  125    HA   THR  17           HA       THR  17  -6.739   6.501  12.104
  126    HB   THR  17           HB       THR  17  -8.564   5.783  10.585
  127    HG1  THR  17           HG1      THR  17  -9.701   5.200  12.258
  128   HG21  THR  17          HG21      THR  17  -7.974   2.937  11.206
  129   HG22  THR  17          HG22      THR  17  -7.200   3.699   9.818
  130   HG23  THR  17          HG23      THR  17  -8.959   3.634   9.921
  131    H    GLN  18           H        GLN  18  -5.432   3.527  10.685
  132    HA   GLN  18           HA       GLN  18  -3.861   2.996  13.003
  133    HB2  GLN  18           HB2      GLN  18  -6.425   2.133  13.290
  134    HB3  GLN  18           HB3      GLN  18  -5.680   0.714  12.566
  135    HG2  GLN  18           HG2      GLN  18  -3.855   1.258  14.448
  136    HG3  GLN  18           HG3      GLN  18  -5.292   1.913  15.231
  137   HE21  GLN  18          HE21      GLN  18  -3.440  -0.728  15.059
  138   HE22  GLN  18          HE22      GLN  18  -4.602  -1.954  15.419
  139    H    TYR  19           H        TYR  19  -3.500   0.231  12.664
  140    HA   TYR  19           HA       TYR  19  -2.885  -0.225   9.863
  141    HB2  TYR  19           HB2      TYR  19  -0.495  -0.751  10.374
  142    HB3  TYR  19           HB3      TYR  19  -0.897   0.955  10.539
  143    HD1  TYR  19           HD1      TYR  19  -1.109   1.961  12.796
  144    HD2  TYR  19           HD2      TYR  19   0.235  -2.038  12.247
  145    HE1  TYR  19           HE1      TYR  19  -0.213   1.955  15.085
  146    HE2  TYR  19           HE2      TYR  19   1.134  -2.056  14.536
  147    HH   TYR  19           HH       TYR  19   0.353  -0.397  16.834
  148    H    THR  20           H        THR  20  -2.734  -2.373   9.334
  149    HA   THR  20           HA       THR  20  -3.509  -4.241  11.442
  150    HB   THR  20           HB       THR  20  -4.287  -5.683   9.718
  151    HG1  THR  20           HG1      THR  20  -3.404  -5.729   7.825
  152   HG21  THR  20          HG21      THR  20  -5.588  -4.106   8.175
  153   HG22  THR  20          HG22      THR  20  -4.901  -2.812   9.157
  154   HG23  THR  20          HG23      THR  20  -5.915  -4.045   9.906
  155    H    VAL  21           H        VAL  21  -0.743  -3.331   9.688
  156    HA   VAL  21           HA       VAL  21   0.725  -5.580  10.804
  157    HB   VAL  21           HB       VAL  21   1.882  -6.064   8.683
  158   HG11  VAL  21          HG11      VAL  21   0.122  -7.388   7.684
  159   HG12  VAL  21          HG12      VAL  21  -1.107  -6.408   8.484
  160   HG13  VAL  21          HG13      VAL  21  -0.030  -7.425   9.441
  161   HG21  VAL  21          HG21      VAL  21   1.116  -3.736   7.746
  162   HG22  VAL  21          HG22      VAL  21  -0.268  -4.662   7.165
  163   HG23  VAL  21          HG23      VAL  21   1.364  -5.103   6.660
  164    H    GLU  22           H        GLU  22   2.879  -5.158  11.184
  165    HA   GLU  22           HA       GLU  22   3.618  -2.434  11.451
  166    HB2  GLU  22           HB2      GLU  22   5.746  -3.285  12.271
  167    HB3  GLU  22           HB3      GLU  22   4.416  -4.197  12.973
  168    HG2  GLU  22           HG2      GLU  22   5.078  -5.607  10.680
  169    HG3  GLU  22           HG3      GLU  22   6.628  -5.099  11.349
  170    H    ASP  23           H        ASP  23   6.098  -1.995  10.719
  171    HA   ASP  23           HA       ASP  23   5.974  -1.447   7.978
  172    HB2  ASP  23           HB2      ASP  23   8.339  -0.806   8.179
  173    HB3  ASP  23           HB3      ASP  23   7.391  -0.175   9.522
  174    H    GLY  24           H        GLY  24   6.279  -2.693   6.256
  175    HA2  GLY  24           HA2      GLY  24   7.189  -4.326   4.894
  176    HA3  GLY  24           HA3      GLY  24   8.307  -4.729   6.189
  177    H    GLY  25           H        GLY  25   4.882  -4.664   6.790
  178    HA2  GLY  25           HA2      GLY  25   4.868  -7.338   7.730
  179    HA3  GLY  25           HA3      GLY  25   3.454  -6.326   7.480
  180    H    HIS  26           H        HIS  26   5.016  -9.088   6.497
  181    HA   HIS  26           HA       HIS  26   4.508  -9.166   3.736
  182    HB2  HIS  26           HB2      HIS  26   4.659 -11.634   3.993
  183    HB3  HIS  26           HB3      HIS  26   5.987 -10.780   4.772
  184    HD1  HIS  26           HD1      HIS  26   6.028 -10.782   7.378
  185    HD2  HIS  26           HD2      HIS  26   2.996 -13.072   5.696
  186    HE1  HIS  26           HE1      HIS  26   5.152 -12.216   9.249
  187    HE2  HIS  26           HE2      HIS  26   3.378 -13.655   8.187
  188    H    VAL  27           H        VAL  27   2.654  -9.182   2.666
  189    HA   VAL  27           HA       VAL  27   0.350 -10.597   3.764
  190    HB   VAL  27           HB       VAL  27  -1.177  -8.723   3.293
  191   HG11  VAL  27          HG11      VAL  27  -0.301  -9.096   5.563
  192   HG12  VAL  27          HG12      VAL  27  -0.649  -7.396   5.249
  193   HG13  VAL  27          HG13      VAL  27   1.017  -7.974   5.222
  194   HG21  VAL  27          HG21      VAL  27   1.283  -7.009   3.002
  195   HG22  VAL  27          HG22      VAL  27  -0.401  -6.527   2.797
  196   HG23  VAL  27          HG23      VAL  27   0.351  -7.618   1.634
  197    H    GLU  28           H        GLU  28  -0.946 -11.500   2.230
  198    HA   GLU  28           HA       GLU  28   0.044 -11.460  -0.489
  199    HB2  GLU  28           HB2      GLU  28  -1.406 -13.319  -0.886
  200    HB3  GLU  28           HB3      GLU  28  -0.654 -13.565   0.683
  201    HG2  GLU  28           HG2      GLU  28  -3.054 -12.158   1.135
  202    HG3  GLU  28           HG3      GLU  28  -3.420 -13.462   0.007
  203    H    ALA  29           H        ALA  29  -1.447 -11.231  -2.331
  204    HA   ALA  29           HA       ALA  29  -2.657  -8.780  -2.482
  205    HB1  ALA  29           HB1      ALA  29  -3.377  -9.368  -4.584
  206    HB2  ALA  29           HB2      ALA  29  -3.799 -11.011  -4.098
  207    HB3  ALA  29           HB3      ALA  29  -2.107 -10.562  -4.314
  208    H    GLY  30           H        GLY  30  -4.516  -7.893  -1.825
  209    HA2  GLY  30           HA2      GLY  30  -6.840  -7.864  -1.391
  210    HA3  GLY  30           HA3      GLY  30  -6.808  -9.613  -1.232
  211    H    SER  31           H        SER  31  -4.363  -9.302   0.550
  212    HA   SER  31           HA       SER  31  -5.786  -9.283   3.017
  213    HB2  SER  31           HB2      SER  31  -3.869 -10.725   2.802
  214    HB3  SER  31           HB3      SER  31  -2.827  -9.362   2.396
  215    HG   SER  31           HG       SER  31  -2.904  -8.670   4.465
  216    H    SER  32           H        SER  32  -6.193  -7.651   4.361
  217    HA   SER  32           HA       SER  32  -5.592  -4.977   3.654
  218    HB2  SER  32           HB2      SER  32  -6.575  -4.427   5.891
  219    HB3  SER  32           HB3      SER  32  -7.604  -5.462   4.901
  220    HG   SER  32           HG       SER  32  -6.077  -6.120   7.173
  221    H    TYR  33           H        TYR  33  -4.015  -3.618   4.293
  222    HA   TYR  33           HA       TYR  33  -1.967  -4.706   6.108
  223    HB2  TYR  33           HB2      TYR  33  -0.311  -3.455   4.917
  224    HB3  TYR  33           HB3      TYR  33  -1.283  -4.306   3.721
  225    HD1  TYR  33           HD1      TYR  33  -0.539  -1.018   5.198
  226    HD2  TYR  33           HD2      TYR  33  -2.632  -3.105   2.138
  227    HE1  TYR  33           HE1      TYR  33  -0.967   1.113   4.048
  228    HE2  TYR  33           HE2      TYR  33  -3.065  -0.980   0.978
  229    HH   TYR  33           HH       TYR  33  -1.461   1.731   1.443
  230    H    ALA  34           H        ALA  34  -4.289  -2.255   5.714
  231    HA   ALA  34           HA       ALA  34  -3.777  -1.135   8.259
  232    HB1  ALA  34           HB1      ALA  34  -3.348   0.969   6.221
  233    HB2  ALA  34           HB2      ALA  34  -2.006  -0.131   6.538
  234    HB3  ALA  34           HB3      ALA  34  -2.697   0.819   7.853
  235    H    GLU  35           H        GLU  35  -4.955   1.286   8.127
  236    HA   GLU  35           HA       GLU  35  -7.407   1.052   6.574
  237    HB2  GLU  35           HB2      GLU  35  -7.615   1.501   9.540
  238    HB3  GLU  35           HB3      GLU  35  -8.891   1.085   8.404
  239    HG2  GLU  35           HG2      GLU  35  -7.579  -1.112   8.091
  240    HG3  GLU  35           HG3      GLU  35  -6.783  -0.664   9.599
  241    H    MET  36           H        MET  36  -8.789   3.028   6.836
  242    HA   MET  36           HA       MET  36  -7.440   5.388   7.838
  243    HB2  MET  36           HB2      MET  36  -7.445   6.585   5.737
  244    HB3  MET  36           HB3      MET  36  -6.522   5.100   5.555
  245    HG2  MET  36           HG2      MET  36  -8.750   4.122   4.665
  246    HG3  MET  36           HG3      MET  36  -9.196   5.812   4.437
  247    HE1  MET  36           HE1      MET  36  -8.168   6.587   1.198
  248    HE2  MET  36           HE2      MET  36  -9.399   6.424   2.450
  249    HE3  MET  36           HE3      MET  36  -9.148   5.123   1.286
  250    H    GLU  37           H        GLU  37  -8.908   6.612   8.802
  251    HA   GLU  37           HA       GLU  37 -11.729   6.171   8.243
  252    HB2  GLU  37           HB2      GLU  37 -10.749   6.282  10.585
  253    HB3  GLU  37           HB3      GLU  37 -10.547   8.009  10.323
  254    HG2  GLU  37           HG2      GLU  37 -13.232   7.006   9.736
  255    HG3  GLU  37           HG3      GLU  37 -12.737   6.836  11.420
  256    H    VAL  38           H        VAL  38 -12.531   7.276   6.582
  257    HA   VAL  38           HA       VAL  38 -11.565   9.965   5.994
  258    HB   VAL  38           HB       VAL  38 -13.749   8.669   4.416
  259   HG11  VAL  38          HG11      VAL  38 -12.115   9.715   2.609
  260   HG12  VAL  38          HG12      VAL  38 -11.614  10.686   3.994
  261   HG13  VAL  38          HG13      VAL  38 -13.299  10.693   3.476
  262   HG21  VAL  38          HG21      VAL  38 -12.024   7.511   3.039
  263   HG22  VAL  38          HG22      VAL  38 -12.221   6.836   4.657
  264   HG23  VAL  38          HG23      VAL  38 -10.842   7.876   4.297
  265    H    MET  39           H        MET  39 -13.357  11.557   5.278
  266    HA   MET  39           HA       MET  39 -14.898  12.230   7.504
  267    HB2  MET  39           HB2      MET  39 -15.529  13.094   4.685
  268    HB3  MET  39           HB3      MET  39 -15.831  13.973   6.178
  269    HG2  MET  39           HG2      MET  39 -13.141  13.668   6.289
  270    HG3  MET  39           HG3      MET  39 -13.402  13.786   4.550
  271    HE1  MET  39           HE1      MET  39 -13.617  17.333   3.868
  272    HE2  MET  39           HE2      MET  39 -14.898  16.175   3.509
  273    HE3  MET  39           HE3      MET  39 -13.209  15.679   3.413
  274    H    LYS  40           H        LYS  40 -15.605  10.190   4.775
  275    HA   LYS  40           HA       LYS  40 -18.443  10.125   5.213
  276    HB2  LYS  40           HB2      LYS  40 -16.528   8.645   3.447
  277    HB3  LYS  40           HB3      LYS  40 -18.160   8.028   3.664
  278    HG2  LYS  40           HG2      LYS  40 -18.335   9.318   1.754
  279    HG3  LYS  40           HG3      LYS  40 -18.912  10.405   3.019
  280    HD2  LYS  40           HD2      LYS  40 -16.754  11.502   3.106
  281    HD3  LYS  40           HD3      LYS  40 -16.098  10.363   1.929
  282    HE2  LYS  40           HE2      LYS  40 -18.026  11.201   0.415
  283    HE3  LYS  40           HE3      LYS  40 -18.084  12.567   1.527
  284    HZ1  LYS  40           HZ1      LYS  40 -16.667  13.023  -0.377
  285    HZ2  LYS  40           HZ2      LYS  40 -15.694  11.691  -0.003
  286    HZ3  LYS  40           HZ3      LYS  40 -15.761  13.011   1.052
  287    H    MET  41           H        MET  41 -16.170   7.386   5.226
  288    HA   MET  41           HA       MET  41 -17.074   6.569   7.858
  289    HB2  MET  41           HB2      MET  41 -17.850   5.179   5.340
  290    HB3  MET  41           HB3      MET  41 -17.438   4.185   6.731
  291    HG2  MET  41           HG2      MET  41 -19.109   5.683   8.004
  292    HG3  MET  41           HG3      MET  41 -19.686   6.124   6.397
  293    HE1  MET  41           HE1      MET  41 -20.314   4.479   4.630
  294    HE2  MET  41           HE2      MET  41 -21.077   2.917   4.927
  295    HE3  MET  41           HE3      MET  41 -19.319   3.041   4.860
  296    H    ILE  42           H        ILE  42 -16.060   4.164   8.172
  297    HA   ILE  42           HA       ILE  42 -13.215   4.593   7.922
  298    HB   ILE  42           HB       ILE  42 -14.095   3.709  10.014
  299   HG12  ILE  42          HG12      ILE  42 -12.598   1.770  10.277
  300   HG13  ILE  42          HG13      ILE  42 -12.454   1.644   8.527
  301   HG21  ILE  42          HG21      ILE  42 -16.025   2.527   9.340
  302   HG22  ILE  42          HG22      ILE  42 -14.935   1.327  10.035
  303   HG23  ILE  42          HG23      ILE  42 -15.095   1.463   8.284
  304   HD11  ILE  42          HD11      ILE  42 -11.770   4.287   9.229
  305   HD12  ILE  42          HD12      ILE  42 -10.727   3.013   8.598
  306   HD13  ILE  42          HD13      ILE  42 -10.928   3.208  10.340
  307    H    MET  43           H        MET  43 -11.740   3.170   6.919
  308    HA   MET  43           HA       MET  43 -12.824   1.127   5.142
  309    HB2  MET  43           HB2      MET  43 -11.395   3.607   4.250
  310    HB3  MET  43           HB3      MET  43 -11.240   2.121   3.323
  311    HG2  MET  43           HG2      MET  43 -13.916   3.261   4.043
  312    HG3  MET  43           HG3      MET  43 -13.028   3.790   2.614
  313    HE1  MET  43           HE1      MET  43 -14.210   1.490   0.037
  314    HE2  MET  43           HE2      MET  43 -12.630   2.174   0.419
  315    HE3  MET  43           HE3      MET  43 -14.087   3.146   0.632
  316    H    THR  44           H        THR  44 -11.125  -0.230   4.176
  317    HA   THR  44           HA       THR  44  -8.710  -0.304   5.866
  318    HB   THR  44           HB       THR  44  -9.460  -2.855   4.655
  319    HG1  THR  44           HG1      THR  44 -11.555  -2.177   5.028
  320   HG21  THR  44          HG21      THR  44  -9.010  -3.758   6.782
  321   HG22  THR  44          HG22      THR  44  -9.185  -2.188   7.567
  322   HG23  THR  44          HG23      THR  44  -7.806  -2.497   6.511
  323    H    LEU  45           H        LEU  45  -6.794  -0.341   4.860
  324    HA   LEU  45           HA       LEU  45  -6.784  -0.304   1.944
  325    HB2  LEU  45           HB2      LEU  45  -4.544   0.255   3.889
  326    HB3  LEU  45           HB3      LEU  45  -4.495   0.519   2.156
  327    HG   LEU  45           HG       LEU  45  -6.638   2.034   2.789
  328   HD11  LEU  45          HD11      LEU  45  -5.831   1.356   5.273
  329   HD12  LEU  45          HD12      LEU  45  -6.661   2.861   4.879
  330   HD13  LEU  45          HD13      LEU  45  -4.904   2.835   5.024
  331   HD21  LEU  45          HD21      LEU  45  -5.029   3.956   2.814
  332   HD22  LEU  45          HD22      LEU  45  -4.833   2.841   1.462
  333   HD23  LEU  45          HD23      LEU  45  -3.719   2.775   2.828
  334    H    ASN  46           H        ASN  46  -6.046  -1.925   0.719
  335    HA   ASN  46           HA       ASN  46  -4.492  -4.059   2.022
  336    HB2  ASN  46           HB2      ASN  46  -5.706  -5.719   0.675
  337    HB3  ASN  46           HB3      ASN  46  -6.800  -4.821   1.724
  338   HD21  ASN  46          HD21      ASN  46  -8.160  -3.241   0.802
  339   HD22  ASN  46          HD22      ASN  46  -8.566  -3.284  -0.876
  340    H    VAL  47           H        VAL  47  -3.473  -5.535   0.306
  341    HA   VAL  47           HA       VAL  47  -2.095  -3.804  -1.598
  342    HB   VAL  47           HB       VAL  47  -0.500  -5.654  -1.848
  343   HG11  VAL  47          HG11      VAL  47  -1.062  -5.032   1.049
  344   HG12  VAL  47          HG12      VAL  47  -0.208  -3.969  -0.070
  345   HG13  VAL  47          HG13      VAL  47   0.481  -5.535   0.358
  346   HG21  VAL  47          HG21      VAL  47  -1.281  -7.718  -1.496
  347   HG22  VAL  47          HG22      VAL  47  -2.621  -7.134  -0.510
  348   HG23  VAL  47          HG23      VAL  47  -1.037  -7.395   0.221
  349    H    GLN  48           H        GLN  48  -1.855  -4.329  -3.798
  350    HA   GLN  48           HA       GLN  48  -4.149  -5.707  -4.912
  351    HB2  GLN  48           HB2      GLN  48  -3.094  -4.917  -7.116
  352    HB3  GLN  48           HB3      GLN  48  -3.731  -3.695  -6.026
  353    HG2  GLN  48           HG2      GLN  48  -1.569  -3.084  -7.034
  354    HG3  GLN  48           HG3      GLN  48  -1.527  -3.130  -5.273
  355   HE21  GLN  48          HE21      GLN  48   0.061  -4.226  -4.358
  356   HE22  GLN  48          HE22      GLN  48   1.068  -5.392  -5.139
  357    H    GLU  49           H        GLU  49  -0.947  -6.489  -4.124
  358    HA   GLU  49           HA       GLU  49  -1.221  -9.072  -5.392
  359    HB2  GLU  49           HB2      GLU  49   0.839  -7.064  -6.247
  360    HB3  GLU  49           HB3      GLU  49   1.191  -8.784  -6.331
  361    HG2  GLU  49           HG2      GLU  49  -0.776  -9.099  -7.766
  362    HG3  GLU  49           HG3      GLU  49  -1.072  -7.362  -7.713
  363    H    ARG  50           H        ARG  50   0.732 -10.478  -4.847
  364    HA   ARG  50           HA       ARG  50   1.118 -10.415  -2.038
  365    HB2  ARG  50           HB2      ARG  50   2.316 -12.090  -4.239
  366    HB3  ARG  50           HB3      ARG  50   2.765 -12.300  -2.552
  367    HG2  ARG  50           HG2      ARG  50   1.125 -13.900  -2.870
  368    HG3  ARG  50           HG3      ARG  50   0.240 -12.562  -2.134
  369    HD2  ARG  50           HD2      ARG  50  -0.945 -13.577  -4.056
  370    HD3  ARG  50           HD3      ARG  50  -0.591 -11.864  -4.282
  371    HE   ARG  50           HE       ARG  50   1.431 -13.548  -5.392
  372   HH11  ARG  50          HH11      ARG  50  -1.728 -12.187  -5.978
  373   HH12  ARG  50          HH12      ARG  50  -1.580 -12.264  -7.702
  374   HH21  ARG  50          HH21      ARG  50   1.629 -13.650  -7.659
  375   HH22  ARG  50          HH22      ARG  50   0.326 -13.095  -8.656
  376    H    GLY  51           H        GLY  51   2.910  -9.920  -0.814
  377    HA2  GLY  51           HA2      GLY  51   5.492  -9.511  -1.432
  378    HA3  GLY  51           HA3      GLY  51   4.751  -8.032  -2.024
  379    H    ARG  52           H        ARG  52   6.557  -7.551  -0.231
  380    HA   ARG  52           HA       ARG  52   5.347  -7.518   2.428
  381    HB2  ARG  52           HB2      ARG  52   8.090  -7.265   1.351
  382    HB3  ARG  52           HB3      ARG  52   7.734  -6.287   2.768
  383    HG2  ARG  52           HG2      ARG  52   8.447  -8.161   3.813
  384    HG3  ARG  52           HG3      ARG  52   6.746  -8.594   3.634
  385    HD2  ARG  52           HD2      ARG  52   7.794 -10.491   2.849
  386    HD3  ARG  52           HD3      ARG  52   7.523  -9.590   1.357
  387    HE   ARG  52           HE       ARG  52  10.061  -8.989   2.490
  388   HH11  ARG  52          HH11      ARG  52   8.345 -11.403   0.645
  389   HH12  ARG  52          HH12      ARG  52   9.770 -12.000  -0.136
  390   HH21  ARG  52          HH21      ARG  52  11.938  -9.773   1.464
  391   HH22  ARG  52          HH22      ARG  52  11.810 -11.075   0.329
  392    H    VAL  53           H        VAL  53   4.196  -5.836   3.071
  393    HA   VAL  53           HA       VAL  53   4.215  -3.368   1.574
  394    HB   VAL  53           HB       VAL  53   2.686  -4.009   4.099
  395   HG11  VAL  53          HG11      VAL  53   2.282  -1.910   1.971
  396   HG12  VAL  53          HG12      VAL  53   2.791  -1.636   3.637
  397   HG13  VAL  53          HG13      VAL  53   1.168  -2.237   3.299
  398   HG21  VAL  53          HG21      VAL  53   1.615  -4.188   1.299
  399   HG22  VAL  53          HG22      VAL  53   0.902  -4.798   2.792
  400   HG23  VAL  53          HG23      VAL  53   2.334  -5.575   2.117
  401    H    LYS  54           H        LYS  54   5.459  -1.677   1.998
  402    HA   LYS  54           HA       LYS  54   6.624  -1.421   4.685
  403    HB2  LYS  54           HB2      LYS  54   8.179   0.175   3.100
  404    HB3  LYS  54           HB3      LYS  54   8.564  -1.478   3.553
  405    HG2  LYS  54           HG2      LYS  54   7.724  -2.320   1.495
  406    HG3  LYS  54           HG3      LYS  54   7.050  -0.749   1.063
  407    HD2  LYS  54           HD2      LYS  54   9.981  -1.396   1.382
  408    HD3  LYS  54           HD3      LYS  54   9.129  -1.181  -0.148
  409    HE2  LYS  54           HE2      LYS  54   8.529   1.114   1.281
  410    HE3  LYS  54           HE3      LYS  54  10.219   0.802   1.672
  411    HZ1  LYS  54           HZ1      LYS  54   9.573   2.176  -0.429
  412    HZ2  LYS  54           HZ2      LYS  54   9.366   0.651  -1.132
  413    HZ3  LYS  54           HZ3      LYS  54  10.868   1.087  -0.487
  414    H    TYR  55           H        TYR  55   5.615   0.092   5.825
  415    HA   TYR  55           HA       TYR  55   3.915   2.051   4.807
  416    HB2  TYR  55           HB2      TYR  55   5.258   1.597   7.431
  417    HB3  TYR  55           HB3      TYR  55   4.494   3.157   7.146
  418    HD1  TYR  55           HD2      TYR  55   3.405  -0.221   6.022
  419    HD2  TYR  55           HD1      TYR  55   2.606   3.130   8.518
  420    HE1  TYR  55           HE2      TYR  55   1.222  -1.188   6.611
  421    HE2  TYR  55           HE1      TYR  55   0.421   2.172   9.115
  422    HH   TYR  55           HH       TYR  55  -0.435  -1.047   8.390
  423    H    ILE  56           H        ILE  56   4.158   4.107   4.134
  424    HA   ILE  56           HA       ILE  56   6.904   5.139   3.944
  425    HB   ILE  56           HB       ILE  56   4.513   5.389   2.179
  426   HG12  ILE  56          HG12      ILE  56   6.141   5.037   0.424
  427   HG13  ILE  56          HG13      ILE  56   7.469   5.256   1.559
  428   HG21  ILE  56          HG21      ILE  56   5.698   7.338   1.034
  429   HG22  ILE  56          HG22      ILE  56   6.571   7.543   2.552
  430   HG23  ILE  56          HG23      ILE  56   4.814   7.689   2.519
  431   HD11  ILE  56          HD11      ILE  56   5.470   3.009   1.614
  432   HD12  ILE  56          HD12      ILE  56   6.832   3.218   2.715
  433   HD13  ILE  56          HD13      ILE  56   7.121   2.913   1.002
  434    H    LYS  57           H        LYS  57   3.573   6.308   4.346
  435    HA   LYS  57           HA       LYS  57   4.371   8.829   5.400
  436    HB2  LYS  57           HB2      LYS  57   1.931   7.493   4.649
  437    HB3  LYS  57           HB3      LYS  57   1.721   8.314   6.190
  438    HG2  LYS  57           HG2      LYS  57   2.645   9.556   3.607
  439    HG3  LYS  57           HG3      LYS  57   1.072   9.767   4.378
  440    HD2  LYS  57           HD2      LYS  57   2.342  10.677   6.381
  441    HD3  LYS  57           HD3      LYS  57   3.758  10.732   5.329
  442    HE2  LYS  57           HE2      LYS  57   2.412  12.127   3.743
  443    HE3  LYS  57           HE3      LYS  57   1.148  12.195   4.970
  444    HZ1  LYS  57           HZ1      LYS  57   2.580  13.352   6.436
  445    HZ2  LYS  57           HZ2      LYS  57   2.703  14.128   4.938
  446    HZ3  LYS  57           HZ3      LYS  57   3.934  13.090   5.454
  447    H    ARG  58           H        ARG  58   3.501   9.574   7.580
  448    HA   ARG  58           HA       ARG  58   4.451   7.695   9.598
  449    HB2  ARG  58           HB2      ARG  58   4.267  10.618   9.349
  450    HB3  ARG  58           HB3      ARG  58   3.864  10.006  10.948
  451    HG2  ARG  58           HG2      ARG  58   6.153   8.623  10.327
  452    HG3  ARG  58           HG3      ARG  58   6.442  10.213   9.617
  453    HD2  ARG  58           HD2      ARG  58   5.404  10.898  12.028
  454    HD3  ARG  58           HD3      ARG  58   6.243   9.402  12.436
  455    HE   ARG  58           HE       ARG  58   7.431  11.920  11.722
  456   HH11  ARG  58          HH11      ARG  58   7.907   8.465  11.850
  457   HH12  ARG  58          HH12      ARG  58   9.634   8.580  11.906
  458   HH21  ARG  58          HH21      ARG  58   9.702  12.073  11.795
  459   HH22  ARG  58          HH22      ARG  58  10.654  10.627  11.875
  460    HA   PRO  59           HA       PRO  59   0.545   6.770  11.410
  461    HB2  PRO  59           HB2      PRO  59   0.920   7.174  14.078
  462    HB3  PRO  59           HB3      PRO  59   1.599   5.797  13.202
  463    HG2  PRO  59           HG2      PRO  59   2.910   8.368  14.001
  464    HG3  PRO  59           HG3      PRO  59   3.545   6.714  14.086
  465    HD2  PRO  59           HD2      PRO  59   4.231   8.419  12.109
  466    HD3  PRO  59           HD3      PRO  59   4.084   6.670  11.841
  467    H    GLY  60           H        GLY  60  -1.313   7.853  11.416
  468    HA2  GLY  60           HA2      GLY  60  -2.874   9.434  12.167
  469    HA3  GLY  60           HA3      GLY  60  -1.565  10.341  12.909
  470    H    ALA  61           H        ALA  61  -0.181   9.945  10.129
  471    HA   ALA  61           HA       ALA  61  -0.611  12.509   9.152
  472    HB1  ALA  61           HB1      ALA  61   1.370  11.263   8.581
  473    HB2  ALA  61           HB2      ALA  61   0.528  11.724   7.102
  474    HB3  ALA  61           HB3      ALA  61   0.411  10.071   7.704
  475    H    VAL  62           H        VAL  62  -1.944  13.408   7.661
  476    HA   VAL  62           HA       VAL  62  -4.366  11.995   7.021
  477    HB   VAL  62           HB       VAL  62  -3.520  14.722   6.040
  478   HG11  VAL  62          HG11      VAL  62  -6.294  13.642   6.484
  479   HG12  VAL  62          HG12      VAL  62  -5.458  13.552   4.933
  480   HG13  VAL  62          HG13      VAL  62  -5.824  15.122   5.648
  481   HG21  VAL  62          HG21      VAL  62  -3.385  14.610   8.487
  482   HG22  VAL  62          HG22      VAL  62  -5.046  14.021   8.548
  483   HG23  VAL  62          HG23      VAL  62  -4.708  15.647   7.954
  484    H    LEU  63           H        LEU  63  -4.699  10.796   5.274
  485    HA   LEU  63           HA       LEU  63  -2.754  10.762   3.136
  486    HB2  LEU  63           HB2      LEU  63  -5.246   9.157   3.673
  487    HB3  LEU  63           HB3      LEU  63  -4.275   8.950   2.228
  488    HG   LEU  63           HG       LEU  63  -3.668   7.238   3.782
  489   HD11  LEU  63          HD11      LEU  63  -1.477   9.279   4.009
  490   HD12  LEU  63          HD12      LEU  63  -1.869   8.480   2.486
  491   HD13  LEU  63          HD13      LEU  63  -1.339   7.526   3.872
  492   HD21  LEU  63          HD21      LEU  63  -3.362   7.493   6.015
  493   HD22  LEU  63          HD22      LEU  63  -4.429   8.872   5.749
  494   HD23  LEU  63          HD23      LEU  63  -2.686   9.114   5.851
  495    H    GLU  64           H        GLU  64  -3.091  11.319   1.007
  496    HA   GLU  64           HA       GLU  64  -5.542  12.860   0.466
  497    HB2  GLU  64           HB2      GLU  64  -4.343  14.530  -0.505
  498    HB3  GLU  64           HB3      GLU  64  -3.083  13.927   0.559
  499    HG2  GLU  64           HG2      GLU  64  -2.616  12.388  -1.583
  500    HG3  GLU  64           HG3      GLU  64  -3.312  13.798  -2.379
  501    H    ALA  65           H        ALA  65  -6.256  12.888  -1.789
  502    HA   ALA  65           HA       ALA  65  -6.452  10.301  -2.865
  503    HB1  ALA  65           HB1      ALA  65  -6.936  12.749  -4.519
  504    HB2  ALA  65           HB2      ALA  65  -8.000  12.350  -3.171
  505    HB3  ALA  65           HB3      ALA  65  -7.810  11.217  -4.509
  506    H    GLY  66           H        GLY  66  -4.342   9.508  -3.147
  507    HA2  GLY  66           HA2      GLY  66  -3.106   9.021  -5.289
  508    HA3  GLY  66           HA3      GLY  66  -2.839  10.755  -5.364
  509    H    CYS  67           H        CYS  67  -2.598  10.507  -2.256
  510    HA   CYS  67           HA       CYS  67   0.223  10.545  -2.188
  511    HB2  CYS  67           HB2      CYS  67  -1.137  11.746  -0.541
  512    HB3  CYS  67           HB3      CYS  67  -1.751  10.219   0.082
  513    HG   CYS  67           HG       CYS  67   0.581   9.725   1.077
  514    H    VAL  68           H        VAL  68   1.715   9.065  -1.410
  515    HA   VAL  68           HA       VAL  68   0.972   6.295  -1.735
  516    HB   VAL  68           HB       VAL  68   3.661   7.361  -0.879
  517   HG11  VAL  68          HG11      VAL  68   4.537   5.303  -1.657
  518   HG12  VAL  68          HG12      VAL  68   3.009   4.860  -2.419
  519   HG13  VAL  68          HG13      VAL  68   3.138   4.903  -0.660
  520   HG21  VAL  68          HG21      VAL  68   4.271   7.300  -3.270
  521   HG22  VAL  68          HG22      VAL  68   3.030   8.503  -2.917
  522   HG23  VAL  68          HG23      VAL  68   2.585   6.971  -3.670
  523    H    VAL  69           H        VAL  69  -0.015   5.292  -0.105
  524    HA   VAL  69           HA       VAL  69   0.431   6.051   2.642
  525    HB   VAL  69           HB       VAL  69  -1.164   3.700   1.625
  526   HG11  VAL  69          HG11      VAL  69  -0.714   3.570   3.982
  527   HG12  VAL  69          HG12      VAL  69  -2.401   4.028   3.752
  528   HG13  VAL  69          HG13      VAL  69  -1.211   5.246   4.212
  529   HG21  VAL  69          HG21      VAL  69  -1.741   6.592   1.598
  530   HG22  VAL  69          HG22      VAL  69  -3.031   5.552   2.200
  531   HG23  VAL  69          HG23      VAL  69  -2.376   5.297   0.583
  532    H    ALA  70           H        ALA  70   1.617   3.640   0.457
  533    HA   ALA  70           HA       ALA  70   3.595   2.784   2.326
  534    HB1  ALA  70           HB1      ALA  70   1.280   1.494   2.744
  535    HB2  ALA  70           HB2      ALA  70   2.861   0.756   3.001
  536    HB3  ALA  70           HB3      ALA  70   1.979   0.454   1.504
  537    H    ARG  71           H        ARG  71   4.384   0.406   1.251
  538    HA   ARG  71           HA       ARG  71   4.574   0.783  -1.641
  539    HB2  ARG  71           HB2      ARG  71   6.789   1.079   0.305
  540    HB3  ARG  71           HB3      ARG  71   7.148   0.151  -1.144
  541    HG2  ARG  71           HG2      ARG  71   6.116   2.978  -1.048
  542    HG3  ARG  71           HG3      ARG  71   7.758   2.470  -1.447
  543    HD2  ARG  71           HD2      ARG  71   5.912   1.054  -3.105
  544    HD3  ARG  71           HD3      ARG  71   5.551   2.778  -3.183
  545    HE   ARG  71           HE       ARG  71   7.859   1.442  -4.242
  546   HH11  ARG  71          HH11      ARG  71   6.619   4.481  -3.059
  547   HH12  ARG  71          HH12      ARG  71   7.770   5.435  -3.933
  548   HH21  ARG  71          HH21      ARG  71   9.375   2.694  -5.392
  549   HH22  ARG  71          HH22      ARG  71   9.335   4.420  -5.258
  550    H    LEU  72           H        LEU  72   4.681  -1.089  -2.767
  551    HA   LEU  72           HA       LEU  72   4.538  -3.560  -1.212
  552    HB2  LEU  72           HB2      LEU  72   3.330  -2.592  -3.641
  553    HB3  LEU  72           HB3      LEU  72   4.141  -4.118  -3.940
  554    HG   LEU  72           HG       LEU  72   1.862  -4.587  -3.396
  555   HD11  LEU  72          HD11      LEU  72   3.762  -5.963  -2.369
  556   HD12  LEU  72          HD12      LEU  72   2.142  -6.164  -1.701
  557   HD13  LEU  72          HD13      LEU  72   3.330  -5.177  -0.850
  558   HD21  LEU  72          HD21      LEU  72   1.945  -3.516  -0.659
  559   HD22  LEU  72          HD22      LEU  72   0.630  -3.537  -1.834
  560   HD23  LEU  72          HD23      LEU  72   1.888  -2.306  -1.942
  561    H    GLU  73           H        GLU  73   6.233  -4.845  -1.033
  562    HA   GLU  73           HA       GLU  73   8.552  -4.430  -2.741
  563    HB2  GLU  73           HB2      GLU  73   8.872  -4.595  -0.310
  564    HB3  GLU  73           HB3      GLU  73   8.184  -6.213  -0.327
  565    HG2  GLU  73           HG2      GLU  73  10.532  -6.453  -0.220
  566    HG3  GLU  73           HG3      GLU  73  10.042  -6.894  -1.855
  567    H    LEU  74           H        LEU  74   7.469  -5.300  -4.651
  568    HA   LEU  74           HA       LEU  74   6.564  -7.960  -4.824
  569    HB2  LEU  74           HB2      LEU  74   7.270  -5.809  -6.715
  570    HB3  LEU  74           HB3      LEU  74   7.379  -7.436  -7.357
  571    HG   LEU  74           HG       LEU  74   5.194  -6.318  -7.779
  572   HD11  LEU  74          HD11      LEU  74   5.027  -8.770  -6.035
  573   HD12  LEU  74          HD12      LEU  74   5.435  -8.768  -7.750
  574   HD13  LEU  74          HD13      LEU  74   3.838  -8.238  -7.224
  575   HD21  LEU  74          HD21      LEU  74   5.321  -5.329  -5.326
  576   HD22  LEU  74          HD22      LEU  74   4.409  -6.793  -4.955
  577   HD23  LEU  74          HD23      LEU  74   3.780  -5.635  -6.127
  578    H    ASP  75           H        ASP  75   9.727  -6.495  -5.395
  579    HA   ASP  75           HA       ASP  75  11.762  -7.408  -5.935
  580    HB2  ASP  75           HB2      ASP  75  11.250  -7.896  -3.432
  581    HB3  ASP  75           HB3      ASP  75  11.087  -9.568  -3.962
  582    H    ASP  76           H        ASP  76  10.235  -8.129  -7.946
  583    HA   ASP  76           HA       ASP  76  10.070 -10.983  -8.279
  584    HB2  ASP  76           HB2      ASP  76   9.379 -10.379 -10.618
  585    HB3  ASP  76           HB3      ASP  76   8.385  -9.660  -9.354
  586    H    LEU  77           H        LEU  77  12.209  -8.397  -9.359
  587    HA   LEU  77           HA       LEU  77  14.272  -8.418 -10.323
  588    HB2  LEU  77           HB2      LEU  77  14.259 -11.299  -9.421
  589    HB3  LEU  77           HB3      LEU  77  15.662 -10.457 -10.049
  590    HG   LEU  77           HG       LEU  77  15.554  -8.887  -8.145
  591   HD11  LEU  77          HD11      LEU  77  13.191 -10.586  -7.442
  592   HD12  LEU  77          HD12      LEU  77  13.318  -8.828  -7.505
  593   HD13  LEU  77          HD13      LEU  77  14.100  -9.723  -6.200
  594   HD21  LEU  77          HD21      LEU  77  16.908 -10.991  -8.112
  595   HD22  LEU  77          HD22      LEU  77  15.589 -11.755  -7.227
  596   HD23  LEU  77          HD23      LEU  77  16.449 -10.387  -6.520
  597    H    GLU  78           H        GLU  78  11.738  -9.440 -11.715
  598    HA   GLU  78           HA       GLU  78  11.101 -10.465 -13.649
  599    HB2  GLU  78           HB2      GLU  78  12.285  -9.585 -15.610
  600    HB3  GLU  78           HB3      GLU  78  11.988  -8.329 -14.416
  601    HG2  GLU  78           HG2      GLU  78  14.223  -8.210 -13.799
  602    HG3  GLU  78           HG3      GLU  78  14.594  -9.793 -14.482
  603    H    HIS  79           H        HIS  79  12.700 -12.200 -12.013
  604    HA   HIS  79           HA       HIS  79  14.704 -13.543 -13.435
  605    HB2  HIS  79           HB2      HIS  79  14.375 -15.371 -11.858
  606    HB3  HIS  79           HB3      HIS  79  14.312 -13.827 -11.015
  607    HD1  HIS  79           HD1      HIS  79  12.955 -16.653 -10.189
  608    HD2  HIS  79           HD2      HIS  79  11.064 -13.275 -11.699
  609    HE1  HIS  79           HE1      HIS  79  10.562 -16.830  -9.437
  610    HE2  HIS  79           HE2      HIS  79   9.459 -14.730 -10.287
  611    H    HIS  80           H        HIS  80  11.239 -13.706 -13.642
  612    HA   HIS  80           HA       HIS  80  11.211 -16.173 -15.136
  613    HB2  HIS  80           HB2      HIS  80   9.348 -15.097 -13.599
  614    HB3  HIS  80           HB3      HIS  80   8.882 -14.300 -15.098
  615    HD1  HIS  80           HD1      HIS  80   7.562 -15.651 -16.755
  616    HD2  HIS  80           HD2      HIS  80   9.173 -17.978 -13.712
  617    HE1  HIS  80           HE1      HIS  80   6.544 -17.932 -17.042
  618    HE2  HIS  80           HE2      HIS  80   7.469 -19.300 -15.139
  619    H    HIS  81           H        HIS  81   9.837 -16.084 -17.261
  620    HA   HIS  81           HA       HIS  81  11.177 -14.143 -19.003
  621    HB2  HIS  81           HB2      HIS  81  11.235 -16.725 -19.344
  622    HB3  HIS  81           HB3      HIS  81   9.613 -16.508 -19.993
  623    HD1  HIS  81           HD1      HIS  81  12.918 -14.682 -20.545
  624    HD2  HIS  81           HD2      HIS  81   9.778 -16.371 -22.677
  625    HE1  HIS  81           HE1      HIS  81  13.467 -14.295 -22.968
  626    HE2  HIS  81           HE2      HIS  81  11.596 -15.404 -24.241
  627    H    HIS  82           H        HIS  82   9.761 -12.398 -18.494
  628    HA   HIS  82           HA       HIS  82   7.473 -12.282 -20.223
  629    HB2  HIS  82           HB2      HIS  82   6.766 -13.350 -17.927
  630    HB3  HIS  82           HB3      HIS  82   6.835 -11.685 -17.358
  631    HD1  HIS  82           HD1      HIS  82   4.897 -13.957 -19.612
  632    HD2  HIS  82           HD2      HIS  82   4.795 -10.018 -18.293
  633    HE1  HIS  82           HE1      HIS  82   2.653 -13.069 -20.319
  634    HE2  HIS  82           HE2      HIS  82   2.580 -10.712 -19.433
  635    H    HIS  83           H        HIS  83   7.132 -10.244 -20.911
  636    HA   HIS  83           HA       HIS  83   8.973  -8.207 -20.169
  637    HB2  HIS  83           HB2      HIS  83   7.731  -6.798 -21.757
  638    HB3  HIS  83           HB3      HIS  83   8.099  -8.375 -22.449
  639    HD1  HIS  83           HD1      HIS  83   6.184  -9.567 -23.478
  640    HD2  HIS  83           HD2      HIS  83   4.939  -6.668 -20.775
  641    HE1  HIS  83           HE1      HIS  83   3.676  -9.519 -23.652
  642    HE2  HIS  83           HE2      HIS  83   2.940  -7.818 -21.946
  643    H    HIS  84           H        HIS  84   7.977  -5.887 -19.819
  644    HA   HIS  84           HA       HIS  84   5.651  -5.773 -18.147
  645    HB2  HIS  84           HB2      HIS  84   6.840  -4.976 -16.119
  646    HB3  HIS  84           HB3      HIS  84   7.194  -6.658 -16.500
  647    HD1  HIS  84           HD1      HIS  84   8.762  -3.232 -17.007
  648    HD2  HIS  84           HD2      HIS  84   9.845  -7.221 -16.583
  649    HE1  HIS  84           HE1      HIS  84  11.276  -3.240 -16.921
  650    HE2  HIS  84           HE2      HIS  84  11.905  -5.656 -16.577
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1   5.950   7.877 -14.504
    2    H2   MET   1           H2       MET   1   4.305   8.055 -14.951
    3    H3   MET   1           H3       MET   1   5.496   9.082 -15.638
    4    HA   MET   1           HA       MET   1   5.956   9.998 -13.482
    5    HB2  MET   1           HB2      MET   1   4.292  10.952 -15.098
    6    HB3  MET   1           HB3      MET   1   3.026  10.096 -14.227
    7    HG2  MET   1           HG2      MET   1   2.883  12.171 -13.285
    8    HG3  MET   1           HG3      MET   1   3.981  11.369 -12.163
    9    HE1  MET   1           HE1      MET   1   3.450  14.260 -14.649
   10    HE2  MET   1           HE2      MET   1   4.663  15.312 -13.920
   11    HE3  MET   1           HE3      MET   1   3.403  14.592 -12.918
   12    H    GLU   2           H        GLU   2   6.285   7.882 -12.228
   13    HA   GLU   2           HA       GLU   2   5.907   6.661 -10.347
   14    HB2  GLU   2           HB2      GLU   2   3.786   8.682  -9.636
   15    HB3  GLU   2           HB3      GLU   2   4.756   7.702  -8.545
   16    HG2  GLU   2           HG2      GLU   2   6.768   8.956  -9.442
   17    HG3  GLU   2           HG3      GLU   2   5.614  10.066 -10.179
   18    H    ASN   3           H        ASN   3   4.705   5.601 -12.492
   19    HA   ASN   3           HA       ASN   3   2.149   4.623 -11.411
   20    HB2  ASN   3           HB2      ASN   3   1.820   6.170 -13.359
   21    HB3  ASN   3           HB3      ASN   3   2.730   5.034 -14.351
   22   HD21  ASN   3          HD21      ASN   3   1.749   3.240 -15.114
   23   HD22  ASN   3          HD22      ASN   3   0.086   2.856 -14.848
   24    H    ASP   4           H        ASP   4   2.568   2.614 -10.758
   25    HA   ASP   4           HA       ASP   4   3.445   0.652 -12.672
   26    HB2  ASP   4           HB2      ASP   4   5.266   1.682 -10.588
   27    HB3  ASP   4           HB3      ASP   4   5.173  -0.073 -10.701
   28    HA   PRO   5           HA       PRO   5   0.939  -2.010 -10.217
   29    HB2  PRO   5           HB2      PRO   5   2.204  -4.401 -10.374
   30    HB3  PRO   5           HB3      PRO   5   1.356  -3.677 -11.745
   31    HG2  PRO   5           HG2      PRO   5   4.285  -3.687 -11.120
   32    HG3  PRO   5           HG3      PRO   5   3.471  -3.959 -12.673
   33    HD2  PRO   5           HD2      PRO   5   4.602  -1.586 -12.010
   34    HD3  PRO   5           HD3      PRO   5   3.170  -1.706 -13.052
   35    H    THR   6           H        THR   6   4.311  -1.748  -9.378
   36    HA   THR   6           HA       THR   6   3.916  -3.006  -6.785
   37    HB   THR   6           HB       THR   6   6.275  -2.854  -6.499
   38    HG1  THR   6           HG1      THR   6   7.564  -1.567  -7.763
   39   HG21  THR   6          HG21      THR   6   7.184  -3.601  -8.784
   40   HG22  THR   6          HG22      THR   6   5.498  -3.548  -9.297
   41   HG23  THR   6          HG23      THR   6   5.984  -4.608  -7.974
   42    H    VAL   7           H        VAL   7   2.321  -0.787  -7.053
   43    HA   VAL   7           HA       VAL   7   3.412   0.931  -4.984
   44    HB   VAL   7           HB       VAL   7   2.955   2.988  -6.071
   45   HG11  VAL   7          HG11      VAL   7   4.652   3.027  -7.688
   46   HG12  VAL   7          HG12      VAL   7   4.339   1.363  -8.182
   47   HG13  VAL   7          HG13      VAL   7   5.090   1.693  -6.621
   48   HG21  VAL   7          HG21      VAL   7   1.342   1.303  -7.752
   49   HG22  VAL   7          HG22      VAL   7   2.351   2.387  -8.709
   50   HG23  VAL   7          HG23      VAL   7   1.256   3.043  -7.491
   51    H    LEU   8           H        LEU   8   1.665   2.583  -4.289
   52    HA   LEU   8           HA       LEU   8  -1.048   1.597  -4.642
   53    HB2  LEU   8           HB2      LEU   8   0.361   0.595  -2.554
   54    HB3  LEU   8           HB3      LEU   8  -0.316   2.033  -1.815
   55    HG   LEU   8           HG       LEU   8  -1.784   0.210  -1.345
   56   HD11  LEU   8          HD11      LEU   8  -3.790   1.139  -1.990
   57   HD12  LEU   8          HD12      LEU   8  -3.208   1.542  -3.605
   58   HD13  LEU   8          HD13      LEU   8  -2.683   2.494  -2.216
   59   HD21  LEU   8          HD21      LEU   8  -1.291  -0.455  -4.182
   60   HD22  LEU   8          HD22      LEU   8  -2.908  -0.786  -3.560
   61   HD23  LEU   8          HD23      LEU   8  -1.499  -1.512  -2.786
   62    H    ARG   9           H        ARG   9  -2.538   3.191  -4.512
   63    HA   ARG   9           HA       ARG   9  -1.872   5.710  -3.210
   64    HB2  ARG   9           HB2      ARG   9  -2.355   5.398  -6.163
   65    HB3  ARG   9           HB3      ARG   9  -2.696   6.913  -5.339
   66    HG2  ARG   9           HG2      ARG   9  -0.571   7.499  -5.497
   67    HG3  ARG   9           HG3      ARG   9  -0.089   6.063  -4.596
   68    HD2  ARG   9           HD2      ARG   9  -0.063   4.767  -6.668
   69    HD3  ARG   9           HD3      ARG   9  -0.558   6.199  -7.571
   70    HE   ARG   9           HE       ARG   9   1.616   6.877  -7.565
   71   HH11  ARG   9          HH11      ARG   9   1.182   4.597  -4.959
   72   HH12  ARG   9          HH12      ARG   9   2.860   4.575  -4.533
   73   HH21  ARG   9          HH21      ARG   9   3.822   6.850  -7.005
   74   HH22  ARG   9          HH22      ARG   9   4.359   5.855  -5.693
   75    H    SER  10           H        SER  10  -3.652   6.903  -2.583
   76    HA   SER  10           HA       SER  10  -6.075   5.470  -2.244
   77    HB2  SER  10           HB2      SER  10  -5.227   7.177  -0.640
   78    HB3  SER  10           HB3      SER  10  -5.587   8.429  -1.829
   79    HG   SER  10           HG       SER  10  -7.227   7.896  -0.125
   80    HA   PRO  11           HA       PRO  11  -8.156   6.588  -5.992
   81    HB2  PRO  11           HB2      PRO  11 -10.701   6.048  -5.283
   82    HB3  PRO  11           HB3      PRO  11  -9.508   4.771  -5.550
   83    HG2  PRO  11           HG2      PRO  11 -10.464   5.962  -2.975
   84    HG3  PRO  11           HG3      PRO  11 -10.175   4.261  -3.381
   85    HD2  PRO  11           HD2      PRO  11  -8.401   5.782  -1.982
   86    HD3  PRO  11           HD3      PRO  11  -7.912   4.431  -3.024
   87    H    SER  12           H        SER  12  -9.002   8.038  -2.929
   88    HA   SER  12           HA       SER  12  -9.607  10.537  -4.262
   89    HB2  SER  12           HB2      SER  12 -11.764  10.820  -3.032
   90    HB3  SER  12           HB3      SER  12 -11.812   9.533  -4.237
   91    HG   SER  12           HG       SER  12 -11.350   9.151  -1.462
   92    H    ALA  13           H        ALA  13 -10.432  12.114  -2.316
   93    HA   ALA  13           HA       ALA  13  -8.158  12.278  -0.581
   94    HB1  ALA  13           HB1      ALA  13  -9.239  14.268  -1.565
   95    HB2  ALA  13           HB2      ALA  13  -9.125  14.352   0.193
   96    HB3  ALA  13           HB3      ALA  13 -10.663  13.957  -0.573
   97    H    GLY  14           H        GLY  14  -7.981  11.010   1.150
   98    HA2  GLY  14           HA2      GLY  14 -10.345  10.731   2.895
   99    HA3  GLY  14           HA3      GLY  14  -9.333   9.346   2.514
  100    H    LYS  15           H        LYS  15  -8.732   8.944   4.626
  101    HA   LYS  15           HA       LYS  15  -6.523  10.490   5.595
  102    HB2  LYS  15           HB2      LYS  15  -8.647  11.686   6.416
  103    HB3  LYS  15           HB3      LYS  15  -8.870  10.296   7.469
  104    HG2  LYS  15           HG2      LYS  15  -6.181  11.369   7.629
  105    HG3  LYS  15           HG3      LYS  15  -7.411  12.569   8.031
  106    HD2  LYS  15           HD2      LYS  15  -7.557   9.825   9.211
  107    HD3  LYS  15           HD3      LYS  15  -6.453  11.020   9.894
  108    HE2  LYS  15           HE2      LYS  15  -8.223  11.635  11.128
  109    HE3  LYS  15           HE3      LYS  15  -8.740  12.471   9.664
  110    HZ1  LYS  15           HZ1      LYS  15 -10.509  11.108  10.591
  111    HZ2  LYS  15           HZ2      LYS  15  -9.547   9.724  10.454
  112    HZ3  LYS  15           HZ3      LYS  15 -10.055  10.541   9.063
  113    H    LEU  16           H        LEU  16  -5.178   9.263   6.815
  114    HA   LEU  16           HA       LEU  16  -5.613   6.467   6.922
  115    HB2  LEU  16           HB2      LEU  16  -3.399   7.833   6.841
  116    HB3  LEU  16           HB3      LEU  16  -3.558   7.878   8.584
  117    HG   LEU  16           HG       LEU  16  -3.428   5.475   8.725
  118   HD11  LEU  16          HD11      LEU  16  -2.864   4.249   6.524
  119   HD12  LEU  16          HD12      LEU  16  -3.643   5.626   5.745
  120   HD13  LEU  16          HD13      LEU  16  -4.549   4.627   6.882
  121   HD21  LEU  16          HD21      LEU  16  -1.357   7.069   8.185
  122   HD22  LEU  16          HD22      LEU  16  -1.246   5.990   6.795
  123   HD23  LEU  16          HD23      LEU  16  -1.186   5.331   8.430
  124    H    THR  17           H        THR  17  -7.344   5.865   8.146
  125    HA   THR  17           HA       THR  17  -7.807   6.926  10.770
  126    HB   THR  17           HB       THR  17  -9.627   6.137   9.250
  127    HG1  THR  17           HG1      THR  17 -10.694   5.936  11.024
  128   HG21  THR  17          HG21      THR  17  -9.186   3.341  10.110
  129   HG22  THR  17          HG22      THR  17  -8.245   3.941   8.744
  130   HG23  THR  17          HG23      THR  17 -10.007   3.980   8.685
  131    H    GLN  18           H        GLN  18  -6.417   3.962   9.447
  132    HA   GLN  18           HA       GLN  18  -4.912   3.491  11.819
  133    HB2  GLN  18           HB2      GLN  18  -7.461   2.569  12.039
  134    HB3  GLN  18           HB3      GLN  18  -6.665   1.163  11.344
  135    HG2  GLN  18           HG2      GLN  18  -5.600   0.681  13.243
  136    HG3  GLN  18           HG3      GLN  18  -5.184   2.367  13.549
  137   HE21  GLN  18          HE21      GLN  18  -7.196  -0.226  14.374
  138   HE22  GLN  18          HE22      GLN  18  -8.235   0.610  15.471
  139    H    TYR  19           H        TYR  19  -4.558   0.680  11.470
  140    HA   TYR  19           HA       TYR  19  -3.778   0.293   8.699
  141    HB2  TYR  19           HB2      TYR  19  -1.439  -0.205   9.249
  142    HB3  TYR  19           HB3      TYR  19  -1.843   1.461   9.650
  143    HD1  TYR  19           HD2      TYR  19  -1.270  -1.901  11.088
  144    HD2  TYR  19           HD1      TYR  19  -1.647   2.264  11.870
  145    HE1  TYR  19           HE2      TYR  19  -0.456  -2.264  13.380
  146    HE2  TYR  19           HE1      TYR  19  -0.833   1.913  14.164
  147    HH   TYR  19           HH       TYR  19  -0.854  -0.736  15.738
  148    H    THR  20           H        THR  20  -3.669  -1.835   8.115
  149    HA   THR  20           HA       THR  20  -4.583  -3.748  10.122
  150    HB   THR  20           HB       THR  20  -5.318  -5.112   8.327
  151    HG1  THR  20           HG1      THR  20  -4.403  -5.119   6.434
  152   HG21  THR  20          HG21      THR  20  -6.481  -3.485   6.747
  153   HG22  THR  20          HG22      THR  20  -5.781  -2.213   7.749
  154   HG23  THR  20          HG23      THR  20  -6.880  -3.393   8.463
  155    H    VAL  21           H        VAL  21  -1.744  -2.905   8.389
  156    HA   VAL  21           HA       VAL  21  -0.334  -5.136   9.612
  157    HB   VAL  21           HB       VAL  21   0.830  -5.731   7.520
  158   HG11  VAL  21          HG11      VAL  21  -0.947  -7.070   6.574
  159   HG12  VAL  21          HG12      VAL  21  -2.163  -6.037   7.324
  160   HG13  VAL  21          HG13      VAL  21  -1.106  -7.027   8.330
  161   HG21  VAL  21          HG21      VAL  21   0.645  -3.846   6.144
  162   HG22  VAL  21          HG22      VAL  21  -1.104  -3.756   6.351
  163   HG23  VAL  21          HG23      VAL  21  -0.396  -5.044   5.377
  164    H    GLU  22           H        GLU  22   1.872  -4.787   9.892
  165    HA   GLU  22           HA       GLU  22   2.668  -2.078  10.136
  166    HB2  GLU  22           HB2      GLU  22   4.808  -2.972  10.882
  167    HB3  GLU  22           HB3      GLU  22   3.484  -3.853  11.632
  168    HG2  GLU  22           HG2      GLU  22   4.109  -5.224   9.259
  169    HG3  GLU  22           HG3      GLU  22   5.642  -4.836  10.038
  170    H    ASP  23           H        ASP  23   5.142  -1.700   9.330
  171    HA   ASP  23           HA       ASP  23   4.943  -1.133   6.596
  172    HB2  ASP  23           HB2      ASP  23   7.331  -0.560   6.722
  173    HB3  ASP  23           HB3      ASP  23   6.444   0.093   8.096
  174    H    GLY  24           H        GLY  24   5.513  -2.205   4.779
  175    HA2  GLY  24           HA2      GLY  24   6.214  -3.915   3.413
  176    HA3  GLY  24           HA3      GLY  24   7.358  -4.346   4.676
  177    H    GLY  25           H        GLY  25   3.933  -4.231   5.309
  178    HA2  GLY  25           HA2      GLY  25   3.892  -6.896   6.275
  179    HA3  GLY  25           HA3      GLY  25   2.488  -5.870   6.022
  180    H    HIS  26           H        HIS  26   4.000  -8.665   5.062
  181    HA   HIS  26           HA       HIS  26   3.483  -8.758   2.302
  182    HB2  HIS  26           HB2      HIS  26   3.521 -11.261   2.642
  183    HB3  HIS  26           HB3      HIS  26   4.938 -10.401   3.234
  184    HD1  HIS  26           HD1      HIS  26   2.035 -12.434   4.365
  185    HD2  HIS  26           HD2      HIS  26   5.220 -10.358   6.043
  186    HE1  HIS  26           HE1      HIS  26   2.132 -13.178   6.765
  187    HE2  HIS  26           HE2      HIS  26   4.119 -11.973   7.738
  188    H    VAL  27           H        VAL  27   1.630  -8.731   1.245
  189    HA   VAL  27           HA       VAL  27  -0.685 -10.135   2.331
  190    HB   VAL  27           HB       VAL  27  -2.202  -8.251   1.949
  191   HG11  VAL  27          HG11      VAL  27  -1.129  -8.675   4.177
  192   HG12  VAL  27          HG12      VAL  27  -1.694  -7.023   3.923
  193   HG13  VAL  27          HG13      VAL  27   0.024  -7.399   3.788
  194   HG21  VAL  27          HG21      VAL  27  -0.839  -7.097   0.243
  195   HG22  VAL  27          HG22      VAL  27   0.284  -6.600   1.509
  196   HG23  VAL  27          HG23      VAL  27  -1.380  -6.016   1.527
  197    H    GLU  28           H        GLU  28  -1.924 -11.064   0.793
  198    HA   GLU  28           HA       GLU  28  -1.005 -10.889  -1.948
  199    HB2  GLU  28           HB2      GLU  28  -2.414 -12.789  -2.372
  200    HB3  GLU  28           HB3      GLU  28  -1.558 -13.068  -0.862
  201    HG2  GLU  28           HG2      GLU  28  -4.012 -11.785  -0.253
  202    HG3  GLU  28           HG3      GLU  28  -4.346 -13.116  -1.360
  203    H    ALA  29           H        ALA  29  -2.612 -10.727  -3.733
  204    HA   ALA  29           HA       ALA  29  -3.903  -8.314  -3.801
  205    HB1  ALA  29           HB1      ALA  29  -4.660  -8.894  -5.875
  206    HB2  ALA  29           HB2      ALA  29  -5.107 -10.527  -5.378
  207    HB3  ALA  29           HB3      ALA  29  -3.413 -10.123  -5.657
  208    H    GLY  30           H        GLY  30  -5.686  -7.490  -2.921
  209    HA2  GLY  30           HA2      GLY  30  -8.025  -7.563  -2.435
  210    HA3  GLY  30           HA3      GLY  30  -7.893  -9.302  -2.220
  211    H    SER  31           H        SER  31  -5.407  -8.909  -0.584
  212    HA   SER  31           HA       SER  31  -6.697  -8.784   1.953
  213    HB2  SER  31           HB2      SER  31  -3.823  -9.033   1.087
  214    HB3  SER  31           HB3      SER  31  -4.259  -8.868   2.788
  215    HG   SER  31           HG       SER  31  -5.399 -10.837   1.105
  216    H    SER  32           H        SER  32  -7.044  -7.091   3.231
  217    HA   SER  32           HA       SER  32  -6.446  -4.456   2.393
  218    HB2  SER  32           HB2      SER  32  -7.192  -3.953   4.854
  219    HB3  SER  32           HB3      SER  32  -8.368  -4.569   3.693
  220    HG   SER  32           HG       SER  32  -8.408  -5.690   5.709
  221    H    TYR  33           H        TYR  33  -4.873  -3.053   2.970
  222    HA   TYR  33           HA       TYR  33  -2.740  -4.099   4.713
  223    HB2  TYR  33           HB2      TYR  33  -1.152  -2.813   3.435
  224    HB3  TYR  33           HB3      TYR  33  -2.122  -3.766   2.317
  225    HD1  TYR  33           HD1      TYR  33  -1.586  -0.366   3.663
  226    HD2  TYR  33           HD2      TYR  33  -3.458  -2.719   0.654
  227    HE1  TYR  33           HE1      TYR  33  -2.140   1.680   2.418
  228    HE2  TYR  33           HE2      TYR  33  -4.017  -0.679  -0.601
  229    HH   TYR  33           HH       TYR  33  -2.685   2.381   0.176
  230    H    ALA  34           H        ALA  34  -5.128  -1.730   4.433
  231    HA   ALA  34           HA       ALA  34  -4.465  -0.520   6.899
  232    HB1  ALA  34           HB1      ALA  34  -4.156   1.373   4.589
  233    HB2  ALA  34           HB2      ALA  34  -2.778   0.521   5.286
  234    HB3  ALA  34           HB3      ALA  34  -3.732   1.619   6.283
  235    H    GLU  35           H        GLU  35  -5.788   1.784   6.899
  236    HA   GLU  35           HA       GLU  35  -8.316   1.436   5.488
  237    HB2  GLU  35           HB2      GLU  35  -8.382   1.881   8.458
  238    HB3  GLU  35           HB3      GLU  35  -9.678   1.352   7.396
  239    HG2  GLU  35           HG2      GLU  35  -8.094  -0.716   7.041
  240    HG3  GLU  35           HG3      GLU  35  -7.452  -0.204   8.600
  241    H    MET  36           H        MET  36  -9.618   3.317   5.433
  242    HA   MET  36           HA       MET  36  -8.591   5.748   6.627
  243    HB2  MET  36           HB2      MET  36  -8.312   6.961   4.576
  244    HB3  MET  36           HB3      MET  36  -7.346   5.496   4.473
  245    HG2  MET  36           HG2      MET  36  -8.290   5.398   2.432
  246    HG3  MET  36           HG3      MET  36  -9.576   4.594   3.330
  247    HE1  MET  36           HE1      MET  36  -9.799   5.921   0.474
  248    HE2  MET  36           HE2      MET  36 -11.281   6.876   0.530
  249    HE3  MET  36           HE3      MET  36 -11.262   5.238   1.185
  250    H    GLU  37           H        GLU  37 -10.254   6.902   7.333
  251    HA   GLU  37           HA       GLU  37 -12.932   6.245   6.407
  252    HB2  GLU  37           HB2      GLU  37 -12.252   6.502   8.862
  253    HB3  GLU  37           HB3      GLU  37 -12.218   8.233   8.555
  254    HG2  GLU  37           HG2      GLU  37 -14.513   8.340   8.192
  255    HG3  GLU  37           HG3      GLU  37 -14.644   6.603   7.918
  256    H    VAL  38           H        VAL  38 -14.495   8.012   6.039
  257    HA   VAL  38           HA       VAL  38 -13.346  10.496   5.019
  258    HB   VAL  38           HB       VAL  38 -15.330   9.147   3.244
  259   HG11  VAL  38          HG11      VAL  38 -14.911  11.200   2.377
  260   HG12  VAL  38          HG12      VAL  38 -13.580  10.330   1.615
  261   HG13  VAL  38          HG13      VAL  38 -13.291  11.286   3.069
  262   HG21  VAL  38          HG21      VAL  38 -13.581   8.013   1.988
  263   HG22  VAL  38          HG22      VAL  38 -13.640   7.411   3.645
  264   HG23  VAL  38          HG23      VAL  38 -12.375   8.540   3.162
  265    H    MET  39           H        MET  39 -15.236  11.954   4.203
  266    HA   MET  39           HA       MET  39 -16.933  12.462   6.355
  267    HB2  MET  39           HB2      MET  39 -17.525  13.295   3.519
  268    HB3  MET  39           HB3      MET  39 -17.948  14.135   5.004
  269    HG2  MET  39           HG2      MET  39 -15.270  14.090   5.238
  270    HG3  MET  39           HG3      MET  39 -15.430  14.119   3.483
  271    HE1  MET  39           HE1      MET  39 -15.637  17.675   2.766
  272    HE2  MET  39           HE2      MET  39 -16.581  16.328   2.130
  273    HE3  MET  39           HE3      MET  39 -14.876  16.103   2.519
  274    H    LYS  40           H        LYS  40 -17.354  10.438   3.546
  275    HA   LYS  40           HA       LYS  40 -20.184  10.091   3.901
  276    HB2  LYS  40           HB2      LYS  40 -18.110   8.758   2.176
  277    HB3  LYS  40           HB3      LYS  40 -19.757   8.149   2.261
  278    HG2  LYS  40           HG2      LYS  40 -19.324  11.032   1.664
  279    HG3  LYS  40           HG3      LYS  40 -19.031   9.839   0.397
  280    HD2  LYS  40           HD2      LYS  40 -21.326   8.938   0.832
  281    HD3  LYS  40           HD3      LYS  40 -21.592  10.303   1.919
  282    HE2  LYS  40           HE2      LYS  40 -22.525  10.973  -0.125
  283    HE3  LYS  40           HE3      LYS  40 -20.961  11.784  -0.056
  284    HZ1  LYS  40           HZ1      LYS  40 -21.580   9.301  -1.564
  285    HZ2  LYS  40           HZ2      LYS  40 -20.051  10.016  -1.460
  286    HZ3  LYS  40           HZ3      LYS  40 -21.317  10.835  -2.228
  287    H    MET  41           H        MET  41 -17.648   7.594   3.893
  288    HA   MET  41           HA       MET  41 -18.524   6.598   6.469
  289    HB2  MET  41           HB2      MET  41 -18.894   5.038   3.915
  290    HB3  MET  41           HB3      MET  41 -18.829   4.268   5.494
  291    HG2  MET  41           HG2      MET  41 -20.831   6.340   4.626
  292    HG3  MET  41           HG3      MET  41 -21.120   4.605   4.750
  293    HE1  MET  41           HE1      MET  41 -23.229   5.536   6.008
  294    HE2  MET  41           HE2      MET  41 -22.764   7.188   6.415
  295    HE3  MET  41           HE3      MET  41 -23.223   6.062   7.692
  296    H    ILE  42           H        ILE  42 -17.287   4.314   6.756
  297    HA   ILE  42           HA       ILE  42 -14.492   5.007   6.536
  298    HB   ILE  42           HB       ILE  42 -15.291   4.014   8.608
  299   HG12  ILE  42          HG12      ILE  42 -13.637   2.205   8.846
  300   HG13  ILE  42          HG13      ILE  42 -13.482   2.114   7.095
  301   HG21  ILE  42          HG21      ILE  42 -17.098   2.671   8.027
  302   HG22  ILE  42          HG22      ILE  42 -15.865   1.508   8.513
  303   HG23  ILE  42          HG23      ILE  42 -16.179   1.796   6.802
  304   HD11  ILE  42          HD11      ILE  42 -13.022   4.796   7.836
  305   HD12  ILE  42          HD12      ILE  42 -11.876   3.623   7.187
  306   HD13  ILE  42          HD13      ILE  42 -12.091   3.774   8.931
  307    H    MET  43           H        MET  43 -12.889   3.754   5.504
  308    HA   MET  43           HA       MET  43 -13.802   1.669   3.669
  309    HB2  MET  43           HB2      MET  43 -12.203   4.079   2.791
  310    HB3  MET  43           HB3      MET  43 -12.567   2.681   1.788
  311    HG2  MET  43           HG2      MET  43 -15.027   3.236   2.268
  312    HG3  MET  43           HG3      MET  43 -14.418   4.803   2.798
  313    HE1  MET  43           HE1      MET  43 -16.227   3.435  -0.112
  314    HE2  MET  43           HE2      MET  43 -14.897   2.285   0.013
  315    HE3  MET  43           HE3      MET  43 -15.045   3.309  -1.415
  316    H    THR  44           H        THR  44 -12.099   0.333   2.832
  317    HA   THR  44           HA       THR  44  -9.641   0.442   4.454
  318    HB   THR  44           HB       THR  44 -10.296  -2.201   3.413
  319    HG1  THR  44           HG1      THR  44 -12.410  -1.701   3.750
  320   HG21  THR  44          HG21      THR  44 -10.032  -2.849   5.777
  321   HG22  THR  44          HG22      THR  44  -9.818  -1.147   6.187
  322   HG23  THR  44          HG23      THR  44  -8.654  -1.955   5.136
  323    H    LEU  45           H        LEU  45  -7.752   0.436   3.398
  324    HA   LEU  45           HA       LEU  45  -7.818   0.295   0.484
  325    HB2  LEU  45           HB2      LEU  45  -5.602   1.123   2.358
  326    HB3  LEU  45           HB3      LEU  45  -5.536   1.212   0.609
  327    HG   LEU  45           HG       LEU  45  -7.859   2.621   1.461
  328   HD11  LEU  45          HD11      LEU  45  -5.387   3.170   3.059
  329   HD12  LEU  45          HD12      LEU  45  -7.057   3.022   3.606
  330   HD13  LEU  45          HD13      LEU  45  -6.547   4.449   2.704
  331   HD21  LEU  45          HD21      LEU  45  -6.639   3.039  -0.595
  332   HD22  LEU  45          HD22      LEU  45  -5.228   3.560   0.326
  333   HD23  LEU  45          HD23      LEU  45  -6.715   4.506   0.381
  334    H    ASN  46           H        ASN  46  -7.485  -1.614  -0.427
  335    HA   ASN  46           HA       ASN  46  -5.630  -3.496   0.874
  336    HB2  ASN  46           HB2      ASN  46  -6.894  -5.123  -0.810
  337    HB3  ASN  46           HB3      ASN  46  -7.551  -4.742   0.777
  338   HD21  ASN  46          HD21      ASN  46  -7.489  -3.012  -2.322
  339   HD22  ASN  46          HD22      ASN  46  -9.197  -2.773  -2.415
  340    H    VAL  47           H        VAL  47  -4.743  -5.125  -0.871
  341    HA   VAL  47           HA       VAL  47  -3.341  -3.466  -2.822
  342    HB   VAL  47           HB       VAL  47  -1.875  -5.446  -3.126
  343   HG11  VAL  47          HG11      VAL  47  -1.999  -4.977  -0.187
  344   HG12  VAL  47          HG12      VAL  47  -1.701  -3.607  -1.257
  345   HG13  VAL  47          HG13      VAL  47  -0.607  -4.990  -1.271
  346   HG21  VAL  47          HG21      VAL  47  -3.850  -6.982  -2.312
  347   HG22  VAL  47          HG22      VAL  47  -3.103  -6.727  -0.735
  348   HG23  VAL  47          HG23      VAL  47  -2.170  -7.446  -2.047
  349    H    GLN  48           H        GLN  48  -3.278  -3.903  -5.019
  350    HA   GLN  48           HA       GLN  48  -5.616  -5.263  -6.051
  351    HB2  GLN  48           HB2      GLN  48  -5.139  -4.223  -8.135
  352    HB3  GLN  48           HB3      GLN  48  -4.828  -3.023  -6.891
  353    HG2  GLN  48           HG2      GLN  48  -2.610  -4.700  -8.001
  354    HG3  GLN  48           HG3      GLN  48  -3.170  -3.254  -8.836
  355   HE21  GLN  48          HE21      GLN  48  -1.252  -4.498  -6.332
  356   HE22  GLN  48          HE22      GLN  48  -0.738  -2.994  -5.653
  357    H    GLU  49           H        GLU  49  -2.382  -6.071  -5.442
  358    HA   GLU  49           HA       GLU  49  -2.722  -8.612  -6.781
  359    HB2  GLU  49           HB2      GLU  49  -0.546  -6.673  -7.568
  360    HB3  GLU  49           HB3      GLU  49  -0.471  -8.395  -7.917
  361    HG2  GLU  49           HG2      GLU  49  -2.512  -8.224  -9.238
  362    HG3  GLU  49           HG3      GLU  49  -2.603  -6.500  -8.879
  363    H    ARG  50           H        ARG  50  -0.696 -10.007  -6.399
  364    HA   ARG  50           HA       ARG  50  -0.226 -10.092  -3.604
  365    HB2  ARG  50           HB2      ARG  50   0.766 -11.640  -5.965
  366    HB3  ARG  50           HB3      ARG  50   1.560 -11.842  -4.409
  367    HG2  ARG  50           HG2      ARG  50   0.010 -13.523  -4.339
  368    HG3  ARG  50           HG3      ARG  50  -0.873 -12.219  -3.542
  369    HD2  ARG  50           HD2      ARG  50  -2.310 -11.939  -5.286
  370    HD3  ARG  50           HD3      ARG  50  -1.118 -12.429  -6.489
  371    HE   ARG  50           HE       ARG  50  -1.672 -14.704  -5.065
  372   HH11  ARG  50          HH11      ARG  50  -3.538 -12.415  -6.925
  373   HH12  ARG  50          HH12      ARG  50  -4.722 -13.582  -7.409
  374   HH21  ARG  50          HH21      ARG  50  -3.229 -16.241  -5.700
  375   HH22  ARG  50          HH22      ARG  50  -4.547 -15.754  -6.713
  376    H    GLY  51           H        GLY  51   1.414  -9.336  -2.391
  377    HA2  GLY  51           HA2      GLY  51   4.032  -8.919  -3.026
  378    HA3  GLY  51           HA3      GLY  51   3.236  -7.453  -3.578
  379    H    ARG  52           H        ARG  52   5.094  -7.074  -1.733
  380    HA   ARG  52           HA       ARG  52   3.841  -7.088   0.897
  381    HB2  ARG  52           HB2      ARG  52   6.617  -6.628  -0.117
  382    HB3  ARG  52           HB3      ARG  52   6.164  -6.025   1.473
  383    HG2  ARG  52           HG2      ARG  52   5.285  -8.467   1.803
  384    HG3  ARG  52           HG3      ARG  52   6.434  -8.825   0.513
  385    HD2  ARG  52           HD2      ARG  52   7.949  -7.265   2.104
  386    HD3  ARG  52           HD3      ARG  52   6.899  -8.016   3.304
  387    HE   ARG  52           HE       ARG  52   7.782 -10.080   1.732
  388   HH11  ARG  52          HH11      ARG  52   9.294  -7.618   3.689
  389   HH12  ARG  52          HH12      ARG  52  10.672  -8.593   4.074
  390   HH21  ARG  52          HH21      ARG  52   9.594 -11.365   2.237
  391   HH22  ARG  52          HH22      ARG  52  10.842 -10.720   3.250
  392    H    VAL  53           H        VAL  53   2.958  -5.371   1.820
  393    HA   VAL  53           HA       VAL  53   2.802  -2.893   0.334
  394    HB   VAL  53           HB       VAL  53   1.608  -3.527   3.035
  395   HG11  VAL  53          HG11      VAL  53   1.556  -1.201   1.263
  396   HG12  VAL  53          HG12      VAL  53   1.188  -1.327   2.983
  397   HG13  VAL  53          HG13      VAL  53  -0.039  -1.740   1.785
  398   HG21  VAL  53          HG21      VAL  53  -0.098  -3.538   0.631
  399   HG22  VAL  53          HG22      VAL  53  -0.149  -4.561   2.067
  400   HG23  VAL  53          HG23      VAL  53   1.018  -4.895   0.788
  401    H    LYS  54           H        LYS  54   4.043  -1.168   0.643
  402    HA   LYS  54           HA       LYS  54   5.580  -0.983   3.152
  403    HB2  LYS  54           HB2      LYS  54   6.398   0.234   0.517
  404    HB3  LYS  54           HB3      LYS  54   7.379   0.022   1.961
  405    HG2  LYS  54           HG2      LYS  54   7.055  -2.482   1.608
  406    HG3  LYS  54           HG3      LYS  54   6.470  -2.054  -0.001
  407    HD2  LYS  54           HD2      LYS  54   8.531  -1.535  -0.748
  408    HD3  LYS  54           HD3      LYS  54   8.997  -0.772   0.774
  409    HE2  LYS  54           HE2      LYS  54   9.312  -3.002   1.768
  410    HE3  LYS  54           HE3      LYS  54   8.901  -3.736   0.219
  411    HZ1  LYS  54           HZ1      LYS  54  11.215  -1.946   0.734
  412    HZ2  LYS  54           HZ2      LYS  54  10.816  -2.621  -0.764
  413    HZ3  LYS  54           HZ3      LYS  54  11.286  -3.622   0.515
  414    H    TYR  55           H        TYR  55   4.602   0.472   4.405
  415    HA   TYR  55           HA       TYR  55   2.903   2.515   3.567
  416    HB2  TYR  55           HB2      TYR  55   4.350   1.876   6.086
  417    HB3  TYR  55           HB3      TYR  55   3.694   3.501   5.921
  418    HD1  TYR  55           HD2      TYR  55   2.285   0.282   4.691
  419    HD2  TYR  55           HD1      TYR  55   1.889   3.537   7.402
  420    HE1  TYR  55           HE2      TYR  55   0.070  -0.551   5.358
  421    HE2  TYR  55           HE1      TYR  55  -0.327   2.713   8.077
  422    HH   TYR  55           HH       TYR  55  -1.468  -0.386   7.248
  423    H    ILE  56           H        ILE  56   3.180   4.549   2.878
  424    HA   ILE  56           HA       ILE  56   5.936   5.541   2.636
  425    HB   ILE  56           HB       ILE  56   3.505   5.847   0.942
  426   HG12  ILE  56          HG12      ILE  56   5.104   5.560  -0.863
  427   HG13  ILE  56          HG13      ILE  56   6.450   5.726   0.260
  428   HG21  ILE  56          HG21      ILE  56   4.697   7.825  -0.184
  429   HG22  ILE  56          HG22      ILE  56   5.543   8.007   1.352
  430   HG23  ILE  56          HG23      ILE  56   3.785   8.135   1.294
  431   HD11  ILE  56          HD11      ILE  56   4.425   3.503   0.304
  432   HD12  ILE  56          HD12      ILE  56   5.849   3.652   1.335
  433   HD13  ILE  56          HD13      ILE  56   6.038   3.404  -0.401
  434    H    LYS  57           H        LYS  57   2.653   6.838   3.062
  435    HA   LYS  57           HA       LYS  57   3.567   9.272   4.225
  436    HB2  LYS  57           HB2      LYS  57   1.066   8.092   3.389
  437    HB3  LYS  57           HB3      LYS  57   0.881   8.908   4.937
  438    HG2  LYS  57           HG2      LYS  57   2.096  10.188   2.500
  439    HG3  LYS  57           HG3      LYS  57   0.393  10.321   2.944
  440    HD2  LYS  57           HD2      LYS  57   1.408  11.090   5.253
  441    HD3  LYS  57           HD3      LYS  57   2.800  11.498   4.247
  442    HE2  LYS  57           HE2      LYS  57   1.300  12.829   2.793
  443    HE3  LYS  57           HE3      LYS  57  -0.027  12.488   3.902
  444    HZ1  LYS  57           HZ1      LYS  57   1.027  14.660   4.289
  445    HZ2  LYS  57           HZ2      LYS  57   2.482  13.882   4.661
  446    HZ3  LYS  57           HZ3      LYS  57   1.124  13.647   5.641
  447    H    ARG  58           H        ARG  58   2.582   9.965   6.414
  448    HA   ARG  58           HA       ARG  58   3.451   7.996   8.383
  449    HB2  ARG  58           HB2      ARG  58   3.199  10.945   8.297
  450    HB3  ARG  58           HB3      ARG  58   2.896  10.191   9.856
  451    HG2  ARG  58           HG2      ARG  58   5.196   8.950   9.049
  452    HG3  ARG  58           HG3      ARG  58   5.400  10.583   8.413
  453    HD2  ARG  58           HD2      ARG  58   4.457  11.093  10.912
  454    HD3  ARG  58           HD3      ARG  58   5.384   9.619  11.187
  455    HE   ARG  58           HE       ARG  58   7.268  10.876  11.002
  456   HH11  ARG  58          HH11      ARG  58   4.724  12.489   9.240
  457   HH12  ARG  58          HH12      ARG  58   5.706  13.852   8.822
  458   HH21  ARG  58          HH21      ARG  58   8.561  12.669  10.455
  459   HH22  ARG  58          HH22      ARG  58   7.885  13.955   9.512
  460    HA   PRO  59           HA       PRO  59  -0.514   6.975   9.996
  461    HB2  PRO  59           HB2      PRO  59  -0.223   7.277  12.698
  462    HB3  PRO  59           HB3      PRO  59   0.446   5.917  11.788
  463    HG2  PRO  59           HG2      PRO  59   1.797   8.417  12.726
  464    HG3  PRO  59           HG3      PRO  59   2.390   6.746  12.754
  465    HD2  PRO  59           HD2      PRO  59   3.179   8.509  10.876
  466    HD3  PRO  59           HD3      PRO  59   2.974   6.782  10.516
  467    H    GLY  60           H        GLY  60  -2.391   8.030  10.058
  468    HA2  GLY  60           HA2      GLY  60  -3.959   9.588  10.844
  469    HA3  GLY  60           HA3      GLY  60  -2.653  10.490  11.596
  470    H    ALA  61           H        ALA  61  -1.245  10.183   8.841
  471    HA   ALA  61           HA       ALA  61  -1.734  12.750   7.893
  472    HB1  ALA  61           HB1      ALA  61  -0.659  10.398   6.341
  473    HB2  ALA  61           HB2      ALA  61   0.288  11.469   7.374
  474    HB3  ALA  61           HB3      ALA  61  -0.476  12.100   5.915
  475    H    VAL  62           H        VAL  62  -3.086  13.632   6.435
  476    HA   VAL  62           HA       VAL  62  -5.437  12.152   5.702
  477    HB   VAL  62           HB       VAL  62  -5.607  14.506   6.354
  478   HG11  VAL  62          HG11      VAL  62  -4.123  15.117   3.801
  479   HG12  VAL  62          HG12      VAL  62  -3.445  15.243   5.425
  480   HG13  VAL  62          HG13      VAL  62  -4.782  16.288   4.944
  481   HG21  VAL  62          HG21      VAL  62  -6.925  15.307   4.342
  482   HG22  VAL  62          HG22      VAL  62  -7.397  13.748   5.018
  483   HG23  VAL  62          HG23      VAL  62  -6.428  13.814   3.546
  484    H    LEU  63           H        LEU  63  -5.785  11.085   3.866
  485    HA   LEU  63           HA       LEU  63  -3.759  11.087   1.805
  486    HB2  LEU  63           HB2      LEU  63  -6.330   9.544   2.127
  487    HB3  LEU  63           HB3      LEU  63  -5.242   9.344   0.767
  488    HG   LEU  63           HG       LEU  63  -4.827   7.572   2.319
  489   HD11  LEU  63          HD11      LEU  63  -2.553   9.372   2.963
  490   HD12  LEU  63          HD12      LEU  63  -2.892   9.022   1.268
  491   HD13  LEU  63          HD13      LEU  63  -2.551   7.704   2.390
  492   HD21  LEU  63          HD21      LEU  63  -4.369   7.859   4.619
  493   HD22  LEU  63          HD22      LEU  63  -5.796   8.838   4.281
  494   HD23  LEU  63          HD23      LEU  63  -4.218   9.608   4.448
  495    H    GLU  64           H        GLU  64  -4.094  11.576  -0.383
  496    HA   GLU  64           HA       GLU  64  -6.456  13.245  -0.944
  497    HB2  GLU  64           HB2      GLU  64  -3.718  13.733  -2.108
  498    HB3  GLU  64           HB3      GLU  64  -5.123  14.788  -2.177
  499    HG2  GLU  64           HG2      GLU  64  -3.558  14.094   0.299
  500    HG3  GLU  64           HG3      GLU  64  -3.460  15.607  -0.601
  501    H    ALA  65           H        ALA  65  -7.031  13.392  -3.232
  502    HA   ALA  65           HA       ALA  65  -7.196  10.870  -4.451
  503    HB1  ALA  65           HB1      ALA  65  -7.555  13.495  -5.877
  504    HB2  ALA  65           HB2      ALA  65  -8.756  12.827  -4.771
  505    HB3  ALA  65           HB3      ALA  65  -8.320  11.947  -6.236
  506    H    GLY  66           H        GLY  66  -5.088  10.039  -4.649
  507    HA2  GLY  66           HA2      GLY  66  -3.700   9.585  -6.668
  508    HA3  GLY  66           HA3      GLY  66  -3.473  11.324  -6.767
  509    H    CYS  67           H        CYS  67  -3.396  11.046  -3.619
  510    HA   CYS  67           HA       CYS  67  -0.592  11.242  -3.405
  511    HB2  CYS  67           HB2      CYS  67  -2.645  11.966  -1.810
  512    HB3  CYS  67           HB3      CYS  67  -2.124  10.504  -0.978
  513    HG   CYS  67           HG       CYS  67  -0.536  13.130  -1.159
  514    H    VAL  68           H        VAL  68   0.939   9.837  -2.552
  515    HA   VAL  68           HA       VAL  68   0.396   7.040  -3.001
  516    HB   VAL  68           HB       VAL  68   2.952   8.247  -1.951
  517   HG11  VAL  68          HG11      VAL  68   3.645   6.141  -3.503
  518   HG12  VAL  68          HG12      VAL  68   2.099   5.585  -2.862
  519   HG13  VAL  68          HG13      VAL  68   3.395   6.048  -1.760
  520   HG21  VAL  68          HG21      VAL  68   3.436   7.830  -4.579
  521   HG22  VAL  68          HG22      VAL  68   2.960   9.385  -3.896
  522   HG23  VAL  68          HG23      VAL  68   1.748   8.338  -4.634
  523    H    VAL  69           H        VAL  69  -0.770   6.074  -1.446
  524    HA   VAL  69           HA       VAL  69  -0.378   6.694   1.347
  525    HB   VAL  69           HB       VAL  69  -2.078   4.496   0.173
  526   HG11  VAL  69          HG11      VAL  69  -1.831   4.129   2.481
  527   HG12  VAL  69          HG12      VAL  69  -3.381   4.954   2.312
  528   HG13  VAL  69          HG13      VAL  69  -1.961   5.848   2.853
  529   HG21  VAL  69          HG21      VAL  69  -2.444   7.401   0.186
  530   HG22  VAL  69          HG22      VAL  69  -3.806   6.498   0.848
  531   HG23  VAL  69          HG23      VAL  69  -3.235   6.161  -0.786
  532    H    ALA  70           H        ALA  70   0.705   4.271  -0.903
  533    HA   ALA  70           HA       ALA  70   2.571   3.233   0.996
  534    HB1  ALA  70           HB1      ALA  70   0.250   2.119   1.455
  535    HB2  ALA  70           HB2      ALA  70   1.725   1.152   1.470
  536    HB3  ALA  70           HB3      ALA  70   0.675   1.137   0.052
  537    H    ARG  71           H        ARG  71   3.257   0.858  -0.064
  538    HA   ARG  71           HA       ARG  71   3.544   1.184  -2.953
  539    HB2  ARG  71           HB2      ARG  71   5.721   1.415  -0.953
  540    HB3  ARG  71           HB3      ARG  71   6.073   0.448  -2.379
  541    HG2  ARG  71           HG2      ARG  71   4.986   3.243  -2.542
  542    HG3  ARG  71           HG3      ARG  71   6.713   2.884  -2.487
  543    HD2  ARG  71           HD2      ARG  71   5.300   1.274  -4.451
  544    HD3  ARG  71           HD3      ARG  71   5.131   3.002  -4.751
  545    HE   ARG  71           HE       ARG  71   7.496   1.419  -5.061
  546   HH11  ARG  71          HH11      ARG  71   6.308   4.631  -4.391
  547   HH12  ARG  71          HH12      ARG  71   7.742   5.416  -4.959
  548   HH21  ARG  71          HH21      ARG  71   9.384   2.450  -5.809
  549   HH22  ARG  71          HH22      ARG  71   9.489   4.179  -5.765
  550    H    LEU  72           H        LEU  72   3.613  -0.728  -4.040
  551    HA   LEU  72           HA       LEU  72   3.308  -3.147  -2.429
  552    HB2  LEU  72           HB2      LEU  72   2.158  -2.176  -4.862
  553    HB3  LEU  72           HB3      LEU  72   2.962  -3.700  -5.188
  554    HG   LEU  72           HG       LEU  72   0.617  -4.061  -4.656
  555   HD11  LEU  72          HD11      LEU  72   2.479  -5.641  -3.899
  556   HD12  LEU  72          HD12      LEU  72   0.892  -5.829  -3.155
  557   HD13  LEU  72          HD13      LEU  72   2.184  -5.007  -2.280
  558   HD21  LEU  72          HD21      LEU  72   0.730  -1.961  -3.039
  559   HD22  LEU  72          HD22      LEU  72   0.986  -3.223  -1.834
  560   HD23  LEU  72          HD23      LEU  72  -0.468  -3.239  -2.833
  561    H    GLU  73           H        GLU  73   4.314  -5.157  -3.204
  562    HA   GLU  73           HA       GLU  73   6.788  -4.804  -4.717
  563    HB2  GLU  73           HB2      GLU  73   6.969  -4.687  -2.044
  564    HB3  GLU  73           HB3      GLU  73   7.011  -6.434  -2.243
  565    HG2  GLU  73           HG2      GLU  73   8.840  -5.899  -4.023
  566    HG3  GLU  73           HG3      GLU  73   8.966  -4.376  -3.144
  567    H    LEU  74           H        LEU  74   6.040  -6.076  -6.372
  568    HA   LEU  74           HA       LEU  74   4.638  -8.491  -6.070
  569    HB2  LEU  74           HB2      LEU  74   6.159  -7.197  -8.284
  570    HB3  LEU  74           HB3      LEU  74   5.708  -8.883  -8.455
  571    HG   LEU  74           HG       LEU  74   4.105  -7.309  -9.512
  572   HD11  LEU  74          HD11      LEU  74   3.368  -9.271  -7.418
  573   HD12  LEU  74          HD12      LEU  74   3.034  -9.278  -9.150
  574   HD13  LEU  74          HD13      LEU  74   2.083  -8.256  -8.072
  575   HD21  LEU  74          HD21      LEU  74   3.740  -6.412  -6.663
  576   HD22  LEU  74          HD22      LEU  74   2.550  -6.113  -7.930
  577   HD23  LEU  74          HD23      LEU  74   4.172  -5.434  -8.066
  578    H    ASP  75           H        ASP  75   5.327 -10.295  -5.166
  579    HA   ASP  75           HA       ASP  75   8.098 -10.857  -4.748
  580    HB2  ASP  75           HB2      ASP  75   5.513 -12.130  -4.034
  581    HB3  ASP  75           HB3      ASP  75   6.918 -13.189  -4.104
  582    H    ASP  76           H        ASP  76   8.407 -10.640  -7.206
  583    HA   ASP  76           HA       ASP  76   7.661 -12.887  -8.818
  584    HB2  ASP  76           HB2      ASP  76   9.146 -11.856 -10.516
  585    HB3  ASP  76           HB3      ASP  76   7.976 -10.716  -9.858
  586    H    LEU  77           H        LEU  77   9.193 -14.325  -9.874
  587    HA   LEU  77           HA       LEU  77  11.129 -15.338  -7.972
  588    HB2  LEU  77           HB2      LEU  77   9.438 -16.655  -9.494
  589    HB3  LEU  77           HB3      LEU  77  10.719 -16.519 -10.684
  590    HG   LEU  77           HG       LEU  77  12.239 -17.538  -8.862
  591   HD11  LEU  77          HD11      LEU  77  10.756 -17.321  -6.980
  592   HD12  LEU  77          HD12      LEU  77  11.024 -19.033  -7.310
  593   HD13  LEU  77          HD13      LEU  77   9.514 -18.266  -7.802
  594   HD21  LEU  77          HD21      LEU  77  11.589 -18.686 -10.916
  595   HD22  LEU  77          HD22      LEU  77  10.078 -19.194 -10.160
  596   HD23  LEU  77          HD23      LEU  77  11.618 -19.797  -9.547
  597    H    GLU  78           H        GLU  78  11.111 -13.503 -10.904
  598    HA   GLU  78           HA       GLU  78  13.805 -14.055 -11.674
  599    HB2  GLU  78           HB2      GLU  78  11.650 -12.219 -12.540
  600    HB3  GLU  78           HB3      GLU  78  13.293 -11.686 -12.870
  601    HG2  GLU  78           HG2      GLU  78  12.861 -12.824 -14.785
  602    HG3  GLU  78           HG3      GLU  78  13.540 -14.128 -13.812
  603    H    HIS  79           H        HIS  79  15.147 -13.709  -9.922
  604    HA   HIS  79           HA       HIS  79  15.307 -10.941  -8.934
  605    HB2  HIS  79           HB2      HIS  79  16.326 -11.812  -6.915
  606    HB3  HIS  79           HB3      HIS  79  14.810 -12.656  -7.210
  607    HD1  HIS  79           HD1      HIS  79  18.144 -13.318  -6.221
  608    HD2  HIS  79           HD2      HIS  79  15.422 -15.243  -8.702
  609    HE1  HIS  79           HE1      HIS  79  18.961 -15.689  -6.405
  610    HE2  HIS  79           HE2      HIS  79  17.347 -16.812  -7.979
  611    H    HIS  80           H        HIS  80  17.061 -13.576 -10.384
  612    HA   HIS  80           HA       HIS  80  19.214 -13.806 -11.117
  613    HB2  HIS  80           HB2      HIS  80  19.949 -12.023 -12.596
  614    HB3  HIS  80           HB3      HIS  80  18.220 -12.288 -12.793
  615    HD1  HIS  80           HD1      HIS  80  20.693  -9.795 -11.485
  616    HD2  HIS  80           HD2      HIS  80  16.595 -10.141 -12.075
  617    HE1  HIS  80           HE1      HIS  80  19.769  -7.480 -11.152
  618    HE2  HIS  80           HE2      HIS  80  17.277  -7.731 -11.431
  619    H    HIS  81           H        HIS  81  19.233 -13.402  -8.406
  620    HA   HIS  81           HA       HIS  81  21.726 -11.887  -8.069
  621    HB2  HIS  81           HB2      HIS  81  19.202 -11.644  -6.467
  622    HB3  HIS  81           HB3      HIS  81  20.759 -11.355  -5.699
  623    HD1  HIS  81           HD1      HIS  81  22.271  -9.675  -7.582
  624    HD2  HIS  81           HD2      HIS  81  18.166  -9.242  -7.109
  625    HE1  HIS  81           HE1      HIS  81  21.745  -7.346  -8.372
  626    HE2  HIS  81           HE2      HIS  81  19.244  -7.138  -8.158
  627    H    HIS  82           H        HIS  82  23.046 -13.637  -7.900
  628    HA   HIS  82           HA       HIS  82  22.351 -15.730  -5.969
  629    HB2  HIS  82           HB2      HIS  82  23.101 -16.255  -8.363
  630    HB3  HIS  82           HB3      HIS  82  24.709 -15.759  -7.847
  631    HD1  HIS  82           HD1      HIS  82  25.666 -18.130  -8.150
  632    HD2  HIS  82           HD2      HIS  82  22.531 -17.912  -5.431
  633    HE1  HIS  82           HE1      HIS  82  25.673 -20.333  -6.937
  634    HE2  HIS  82           HE2      HIS  82  23.823 -20.144  -5.237
  635    H    HIS  83           H        HIS  83  22.803 -14.590  -4.060
  636    HA   HIS  83           HA       HIS  83  25.562 -13.699  -3.663
  637    HB2  HIS  83           HB2      HIS  83  23.745 -12.149  -3.030
  638    HB3  HIS  83           HB3      HIS  83  23.145 -13.341  -1.881
  639    HD1  HIS  83           HD1      HIS  83  24.043 -13.166   0.427
  640    HD2  HIS  83           HD2      HIS  83  26.465 -11.232  -2.340
  641    HE1  HIS  83           HE1      HIS  83  25.821 -12.012   1.781
  642    HE2  HIS  83           HE2      HIS  83  27.224 -10.778   0.091
  643    H    HIS  84           H        HIS  84  23.368 -16.211  -2.793
  644    HA   HIS  84           HA       HIS  84  24.573 -17.097  -0.408
  645    HB2  HIS  84           HB2      HIS  84  22.875 -18.460  -2.486
  646    HB3  HIS  84           HB3      HIS  84  23.509 -19.341  -1.100
  647    HD1  HIS  84           HD1      HIS  84  21.298 -16.356  -1.862
  648    HD2  HIS  84           HD2      HIS  84  22.019 -19.103   1.171
  649    HE1  HIS  84           HE1      HIS  84  19.519 -15.934  -0.136
  650    HE2  HIS  84           HE2      HIS  84  19.923 -17.666   1.649
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1   0.410  12.281 -16.146
    2    H2   MET   1           H2       MET   1   1.923  11.720 -15.567
    3    H3   MET   1           H3       MET   1   1.370  11.244 -17.121
    4    HA   MET   1           HA       MET   1   0.068  10.580 -14.566
    5    HB2  MET   1           HB2      MET   1  -0.458   9.938 -17.463
    6    HB3  MET   1           HB3      MET   1  -1.089   8.931 -16.167
    7    HG2  MET   1           HG2      MET   1  -2.141  11.030 -15.230
    8    HG3  MET   1           HG3      MET   1  -1.721  11.805 -16.756
    9    HE1  MET   1           HE1      MET   1  -4.088  12.471 -17.374
   10    HE2  MET   1           HE2      MET   1  -4.742  11.834 -15.864
   11    HE3  MET   1           HE3      MET   1  -5.485  11.395 -17.402
   12    H    GLU   2           H        GLU   2   2.200   9.934 -13.786
   13    HA   GLU   2           HA       GLU   2   3.092   7.382 -14.962
   14    HB2  GLU   2           HB2      GLU   2   4.680   9.425 -14.996
   15    HB3  GLU   2           HB3      GLU   2   4.848   9.139 -13.269
   16    HG2  GLU   2           HG2      GLU   2   5.304   6.925 -15.223
   17    HG3  GLU   2           HG3      GLU   2   6.564   8.114 -14.899
   18    H    ASN   3           H        ASN   3   2.432   5.736 -13.756
   19    HA   ASN   3           HA       ASN   3   2.861   5.835 -10.870
   20    HB2  ASN   3           HB2      ASN   3   0.513   6.523 -11.219
   21    HB3  ASN   3           HB3      ASN   3   0.216   5.026 -12.098
   22   HD21  ASN   3          HD21      ASN   3  -0.888   3.660 -10.917
   23   HD22  ASN   3          HD22      ASN   3  -0.688   3.374  -9.225
   24    H    ASP   4           H        ASP   4   4.189   4.182 -10.537
   25    HA   ASP   4           HA       ASP   4   4.150   1.841 -12.223
   26    HB2  ASP   4           HB2      ASP   4   5.892   2.887 -10.045
   27    HB3  ASP   4           HB3      ASP   4   5.909   1.150 -10.338
   28    HA   PRO   5           HA       PRO   5   1.574  -0.789  -9.807
   29    HB2  PRO   5           HB2      PRO   5   2.887  -3.178  -9.979
   30    HB3  PRO   5           HB3      PRO   5   1.938  -2.488 -11.301
   31    HG2  PRO   5           HG2      PRO   5   4.899  -2.430 -10.862
   32    HG3  PRO   5           HG3      PRO   5   3.994  -2.720 -12.360
   33    HD2  PRO   5           HD2      PRO   5   5.118  -0.333 -11.809
   34    HD3  PRO   5           HD3      PRO   5   3.586  -0.469 -12.697
   35    H    THR   6           H        THR   6   4.973  -0.589  -9.034
   36    HA   THR   6           HA       THR   6   4.599  -1.811  -6.419
   37    HB   THR   6           HB       THR   6   7.010  -1.541  -6.166
   38    HG1  THR   6           HG1      THR   6   8.180  -0.333  -7.481
   39   HG21  THR   6          HG21      THR   6   6.577  -2.464  -8.984
   40   HG22  THR   6          HG22      THR   6   6.101  -3.424  -7.583
   41   HG23  THR   6          HG23      THR   6   7.795  -2.997  -7.825
   42    H    VAL   7           H        VAL   7   3.065   0.482  -6.721
   43    HA   VAL   7           HA       VAL   7   4.202   2.146  -4.624
   44    HB   VAL   7           HB       VAL   7   3.102   3.452  -7.106
   45   HG11  VAL   7          HG11      VAL   7   4.902   4.880  -5.266
   46   HG12  VAL   7          HG12      VAL   7   3.319   4.456  -4.613
   47   HG13  VAL   7          HG13      VAL   7   3.437   5.429  -6.079
   48   HG21  VAL   7          HG21      VAL   7   5.997   3.077  -6.343
   49   HG22  VAL   7          HG22      VAL   7   5.400   4.028  -7.703
   50   HG23  VAL   7          HG23      VAL   7   5.170   2.279  -7.681
   51    H    LEU   8           H        LEU   8   2.700   2.417  -3.123
   52    HA   LEU   8           HA       LEU   8  -0.087   1.905  -3.766
   53    HB2  LEU   8           HB2      LEU   8   1.445   1.276  -1.603
   54    HB3  LEU   8           HB3      LEU   8   0.612   2.705  -1.021
   55    HG   LEU   8           HG       LEU   8  -0.667   0.825  -0.334
   56   HD11  LEU   8          HD11      LEU   8  -2.747   1.427  -1.104
   57   HD12  LEU   8          HD12      LEU   8  -2.192   1.641  -2.763
   58   HD13  LEU   8          HD13      LEU   8  -1.797   2.847  -1.539
   59   HD21  LEU   8          HD21      LEU   8  -0.111  -1.022  -1.536
   60   HD22  LEU   8          HD22      LEU   8  -0.075  -0.152  -3.069
   61   HD23  LEU   8          HD23      LEU   8  -1.619  -0.615  -2.355
   62    H    ARG   9           H        ARG   9  -1.733   3.373  -3.637
   63    HA   ARG   9           HA       ARG   9  -1.213   6.064  -2.681
   64    HB2  ARG   9           HB2      ARG   9  -2.106   5.573  -5.527
   65    HB3  ARG   9           HB3      ARG   9  -1.914   7.141  -4.756
   66    HG2  ARG   9           HG2      ARG   9   0.536   6.394  -4.396
   67    HG3  ARG   9           HG3      ARG   9   0.180   5.212  -5.656
   68    HD2  ARG   9           HD2      ARG   9  -0.753   7.305  -6.924
   69    HD3  ARG   9           HD3      ARG   9   0.296   8.189  -5.817
   70    HE   ARG   9           HE       ARG   9   1.639   6.028  -7.125
   71   HH11  ARG   9          HH11      ARG   9   0.616   9.346  -7.477
   72   HH12  ARG   9          HH12      ARG   9   1.841   9.732  -8.637
   73   HH21  ARG   9          HH21      ARG   9   3.252   6.534  -8.652
   74   HH22  ARG   9          HH22      ARG   9   3.338   8.136  -9.305
   75    H    SER  10           H        SER  10  -2.997   7.020  -1.864
   76    HA   SER  10           HA       SER  10  -5.326   5.457  -1.463
   77    HB2  SER  10           HB2      SER  10  -6.083   8.001  -0.761
   78    HB3  SER  10           HB3      SER  10  -5.238   6.872   0.298
   79    HG   SER  10           HG       SER  10  -4.128   8.937  -1.291
   80    HA   PRO  11           HA       PRO  11  -7.671   6.564  -5.049
   81    HB2  PRO  11           HB2      PRO  11 -10.162   5.991  -4.183
   82    HB3  PRO  11           HB3      PRO  11  -8.973   4.731  -4.535
   83    HG2  PRO  11           HG2      PRO  11  -9.776   5.893  -1.895
   84    HG3  PRO  11           HG3      PRO  11  -9.491   4.198  -2.331
   85    HD2  PRO  11           HD2      PRO  11  -7.651   5.728  -1.036
   86    HD3  PRO  11           HD3      PRO  11  -7.211   4.398  -2.125
   87    H    SER  12           H        SER  12  -8.396   7.973  -1.929
   88    HA   SER  12           HA       SER  12  -9.074  10.485  -3.204
   89    HB2  SER  12           HB2      SER  12 -11.217  10.758  -2.125
   90    HB3  SER  12           HB3      SER  12 -11.244   9.241  -3.024
   91    HG   SER  12           HG       SER  12 -11.330   9.693  -0.295
   92    H    ALA  13           H        ALA  13  -9.751  12.083  -1.282
   93    HA   ALA  13           HA       ALA  13  -7.456  12.164   0.431
   94    HB1  ALA  13           HB1      ALA  13  -8.486  14.264   1.281
   95    HB2  ALA  13           HB2      ALA  13  -9.873  13.953   0.236
   96    HB3  ALA  13           HB3      ALA  13  -8.280  14.226  -0.471
   97    H    GLY  14           H        GLY  14  -7.291  11.045   2.253
   98    HA2  GLY  14           HA2      GLY  14  -9.563  11.003   4.099
   99    HA3  GLY  14           HA3      GLY  14  -8.912   9.455   3.580
  100    H    LYS  15           H        LYS  15  -8.978  11.099   6.204
  101    HA   LYS  15           HA       LYS  15  -6.209  11.528   6.796
  102    HB2  LYS  15           HB2      LYS  15  -8.083  12.766   7.891
  103    HB3  LYS  15           HB3      LYS  15  -8.504  11.284   8.741
  104    HG2  LYS  15           HG2      LYS  15  -5.696  12.098   8.991
  105    HG3  LYS  15           HG3      LYS  15  -6.866  13.207   9.710
  106    HD2  LYS  15           HD2      LYS  15  -7.106  10.278  10.238
  107    HD3  LYS  15           HD3      LYS  15  -5.888  11.216  11.105
  108    HE2  LYS  15           HE2      LYS  15  -8.741  12.128  10.980
  109    HE3  LYS  15           HE3      LYS  15  -8.225  10.927  12.164
  110    HZ1  LYS  15           HZ1      LYS  15  -6.981  13.605  11.857
  111    HZ2  LYS  15           HZ2      LYS  15  -6.668  12.473  13.075
  112    HZ3  LYS  15           HZ3      LYS  15  -8.175  13.237  12.998
  113    H    LEU  16           H        LEU  16  -4.790  10.249   7.882
  114    HA   LEU  16           HA       LEU  16  -5.174   7.450   7.776
  115    HB2  LEU  16           HB2      LEU  16  -2.975   8.676   7.637
  116    HB3  LEU  16           HB3      LEU  16  -3.087   8.931   9.364
  117    HG   LEU  16           HG       LEU  16  -2.932   6.569   9.797
  118   HD11  LEU  16          HD11      LEU  16  -2.538   5.005   7.857
  119   HD12  LEU  16          HD12      LEU  16  -3.126   6.296   6.809
  120   HD13  LEU  16          HD13      LEU  16  -4.185   5.607   8.039
  121   HD21  LEU  16          HD21      LEU  16  -0.704   6.394   9.442
  122   HD22  LEU  16          HD22      LEU  16  -0.889   8.080   8.958
  123   HD23  LEU  16          HD23      LEU  16  -0.831   6.812   7.734
  124    H    THR  17           H        THR  17  -6.897   6.777   8.999
  125    HA   THR  17           HA       THR  17  -7.278   7.609  11.709
  126    HB   THR  17           HB       THR  17  -9.152   6.952  10.237
  127    HG1  THR  17           HG1      THR  17 -10.227   6.261  11.913
  128   HG21  THR  17          HG21      THR  17  -8.492   4.082  10.675
  129   HG22  THR  17          HG22      THR  17  -7.825   4.937   9.284
  130   HG23  THR  17          HG23      THR  17  -9.572   4.824   9.495
  131    H    GLN  18           H        GLN  18  -6.037   4.666  10.154
  132    HA   GLN  18           HA       GLN  18  -4.389   4.070  12.403
  133    HB2  GLN  18           HB2      GLN  18  -6.976   3.192  12.693
  134    HB3  GLN  18           HB3      GLN  18  -6.183   1.781  12.007
  135    HG2  GLN  18           HG2      GLN  18  -5.457   1.271  14.029
  136    HG3  GLN  18           HG3      GLN  18  -4.459   2.724  13.997
  137   HE21  GLN  18          HE21      GLN  18  -7.876   1.879  14.489
  138   HE22  GLN  18          HE22      GLN  18  -8.102   2.889  15.873
  139    H    TYR  19           H        TYR  19  -4.072   1.310  11.989
  140    HA   TYR  19           HA       TYR  19  -3.538   0.918   9.161
  141    HB2  TYR  19           HB2      TYR  19  -1.142   0.321   9.629
  142    HB3  TYR  19           HB3      TYR  19  -1.511   2.035   9.792
  143    HD1  TYR  19           HD1      TYR  19  -0.930  -1.082  11.712
  144    HD2  TYR  19           HD2      TYR  19  -1.146   3.166  11.832
  145    HE1  TYR  19           HE1      TYR  19   0.005  -1.105  13.986
  146    HE2  TYR  19           HE2      TYR  19  -0.211   3.154  14.106
  147    HH   TYR  19           HH       TYR  19  -0.238   1.000  16.097
  148    H    THR  20           H        THR  20  -3.416  -1.223   8.574
  149    HA   THR  20           HA       THR  20  -4.200  -3.127  10.645
  150    HB   THR  20           HB       THR  20  -5.011  -4.516   8.896
  151    HG1  THR  20           HG1      THR  20  -4.039  -4.580   7.058
  152   HG21  THR  20          HG21      THR  20  -6.293  -2.898   7.390
  153   HG22  THR  20          HG22      THR  20  -5.568  -1.625   8.372
  154   HG23  THR  20          HG23      THR  20  -6.601  -2.840   9.126
  155    H    VAL  21           H        VAL  21  -1.417  -2.202   8.948
  156    HA   VAL  21           HA       VAL  21   0.009  -4.516   9.977
  157    HB   VAL  21           HB       VAL  21   1.172  -4.936   7.847
  158   HG11  VAL  21          HG11      VAL  21  -0.602  -6.185   6.780
  159   HG12  VAL  21          HG12      VAL  21  -1.821  -5.216   7.609
  160   HG13  VAL  21          HG13      VAL  21  -0.771  -6.292   8.533
  161   HG21  VAL  21          HG21      VAL  21   0.624  -2.618   6.939
  162   HG22  VAL  21          HG22      VAL  21  -0.946  -3.288   6.494
  163   HG23  VAL  21          HG23      VAL  21   0.530  -3.965   5.804
  164    H    GLU  22           H        GLU  22   2.133  -4.118  10.453
  165    HA   GLU  22           HA       GLU  22   2.915  -1.413  10.777
  166    HB2  GLU  22           HB2      GLU  22   5.040  -2.348  11.595
  167    HB3  GLU  22           HB3      GLU  22   3.652  -3.143  12.325
  168    HG2  GLU  22           HG2      GLU  22   4.215  -5.130  11.497
  169    HG3  GLU  22           HG3      GLU  22   4.569  -4.466   9.902
  170    H    ASP  23           H        ASP  23   5.446  -1.046  10.132
  171    HA   ASP  23           HA       ASP  23   5.418  -0.435   7.402
  172    HB2  ASP  23           HB2      ASP  23   7.895  -0.772   9.101
  173    HB3  ASP  23           HB3      ASP  23   7.710   0.237   7.670
  174    H    GLY  24           H        GLY  24   5.827  -1.602   5.636
  175    HA2  GLY  24           HA2      GLY  24   6.668  -3.262   4.273
  176    HA3  GLY  24           HA3      GLY  24   7.742  -3.726   5.585
  177    H    GLY  25           H        GLY  25   4.308  -3.560   6.108
  178    HA2  GLY  25           HA2      GLY  25   4.182  -6.246   7.001
  179    HA3  GLY  25           HA3      GLY  25   2.809  -5.184   6.733
  180    H    HIS  26           H        HIS  26   4.321  -7.972   5.736
  181    HA   HIS  26           HA       HIS  26   3.864  -7.988   2.964
  182    HB2  HIS  26           HB2      HIS  26   3.937 -10.475   3.195
  183    HB3  HIS  26           HB3      HIS  26   5.292  -9.653   3.963
  184    HD1  HIS  26           HD1      HIS  26   2.383 -11.829   4.680
  185    HD2  HIS  26           HD2      HIS  26   5.251  -9.705   6.808
  186    HE1  HIS  26           HE1      HIS  26   2.251 -12.697   7.036
  187    HE2  HIS  26           HE2      HIS  26   4.056 -11.460   8.285
  188    H    VAL  27           H        VAL  27   2.026  -7.930   1.868
  189    HA   VAL  27           HA       VAL  27  -0.321  -9.336   2.883
  190    HB   VAL  27           HB       VAL  27  -1.811  -7.431   2.447
  191   HG11  VAL  27          HG11      VAL  27  -0.939  -7.865   4.717
  192   HG12  VAL  27          HG12      VAL  27  -1.304  -6.163   4.436
  193   HG13  VAL  27          HG13      VAL  27   0.368  -6.723   4.407
  194   HG21  VAL  27          HG21      VAL  27  -0.984  -5.886   1.043
  195   HG22  VAL  27          HG22      VAL  27   0.687  -6.232   1.487
  196   HG23  VAL  27          HG23      VAL  27  -0.294  -5.173   2.501
  197    H    GLU  28           H        GLU  28  -1.580 -10.195   1.297
  198    HA   GLU  28           HA       GLU  28  -0.540 -10.070  -1.401
  199    HB2  GLU  28           HB2      GLU  28  -1.966 -11.918  -1.882
  200    HB3  GLU  28           HB3      GLU  28  -1.281 -12.205  -0.289
  201    HG2  GLU  28           HG2      GLU  28  -3.677 -10.810   0.134
  202    HG3  GLU  28           HG3      GLU  28  -4.024 -12.032  -1.087
  203    H    ALA  29           H        ALA  29  -1.952  -9.728  -3.263
  204    HA   ALA  29           HA       ALA  29  -3.181  -7.281  -3.323
  205    HB1  ALA  29           HB1      ALA  29  -2.520  -8.850  -5.253
  206    HB2  ALA  29           HB2      ALA  29  -3.910  -7.786  -5.474
  207    HB3  ALA  29           HB3      ALA  29  -4.155  -9.491  -5.095
  208    H    GLY  30           H        GLY  30  -5.080  -6.448  -2.706
  209    HA2  GLY  30           HA2      GLY  30  -7.429  -6.489  -2.387
  210    HA3  GLY  30           HA3      GLY  30  -7.356  -8.240  -2.262
  211    H    SER  31           H        SER  31  -5.028  -8.001  -0.381
  212    HA   SER  31           HA       SER  31  -6.548  -7.988   2.029
  213    HB2  SER  31           HB2      SER  31  -4.630  -9.473   1.784
  214    HB3  SER  31           HB3      SER  31  -3.555  -8.089   1.586
  215    HG   SER  31           HG       SER  31  -3.783  -7.589   3.691
  216    H    SER  32           H        SER  32  -6.896  -6.400   3.454
  217    HA   SER  32           HA       SER  32  -6.258  -3.720   2.808
  218    HB2  SER  32           HB2      SER  32  -7.493  -3.113   4.714
  219    HB3  SER  32           HB3      SER  32  -8.233  -4.632   4.207
  220    HG   SER  32           HG       SER  32  -7.535  -4.245   6.548
  221    H    TYR  33           H        TYR  33  -4.753  -2.322   3.626
  222    HA   TYR  33           HA       TYR  33  -2.699  -3.498   5.383
  223    HB2  TYR  33           HB2      TYR  33  -0.999  -2.273   4.203
  224    HB3  TYR  33           HB3      TYR  33  -1.953  -3.164   3.022
  225    HD1  TYR  33           HD1      TYR  33  -1.336   0.188   4.453
  226    HD2  TYR  33           HD2      TYR  33  -3.153  -2.032   1.312
  227    HE1  TYR  33           HE1      TYR  33  -1.736   2.275   3.217
  228    HE2  TYR  33           HE2      TYR  33  -3.558   0.049   0.067
  229    HH   TYR  33           HH       TYR  33  -3.181   3.141   1.483
  230    H    ALA  34           H        ALA  34  -4.985  -1.030   5.024
  231    HA   ALA  34           HA       ALA  34  -4.385   0.116   7.534
  232    HB1  ALA  34           HB1      ALA  34  -3.972   2.150   5.402
  233    HB2  ALA  34           HB2      ALA  34  -2.630   1.090   5.831
  234    HB3  ALA  34           HB3      ALA  34  -3.373   2.113   7.060
  235    H    GLU  35           H        GLU  35  -5.566   2.513   7.468
  236    HA   GLU  35           HA       GLU  35  -8.048   2.324   5.959
  237    HB2  GLU  35           HB2      GLU  35  -8.274   2.749   8.916
  238    HB3  GLU  35           HB3      GLU  35  -9.501   2.216   7.777
  239    HG2  GLU  35           HG2      GLU  35  -8.092   0.097   7.538
  240    HG3  GLU  35           HG3      GLU  35  -7.263   0.642   8.994
  241    H    MET  36           H        MET  36  -9.417   4.289   6.283
  242    HA   MET  36           HA       MET  36  -8.043   6.621   7.329
  243    HB2  MET  36           HB2      MET  36  -7.926   7.848   5.322
  244    HB3  MET  36           HB3      MET  36  -7.291   6.260   4.916
  245    HG2  MET  36           HG2      MET  36  -9.812   5.829   4.241
  246    HG3  MET  36           HG3      MET  36  -9.802   7.582   4.059
  247    HE1  MET  36           HE1      MET  36  -6.437   7.708   1.842
  248    HE2  MET  36           HE2      MET  36  -6.981   8.133   3.465
  249    HE3  MET  36           HE3      MET  36  -7.813   8.790   2.055
  250    H    GLU  37           H        GLU  37  -9.451   7.945   8.270
  251    HA   GLU  37           HA       GLU  37 -12.295   7.448   7.905
  252    HB2  GLU  37           HB2      GLU  37 -11.142   7.695  10.175
  253    HB3  GLU  37           HB3      GLU  37 -11.050   9.415   9.818
  254    HG2  GLU  37           HG2      GLU  37 -13.318   9.715   9.995
  255    HG3  GLU  37           HG3      GLU  37 -13.679   8.030   9.625
  256    H    VAL  38           H        VAL  38 -13.209   8.467   6.247
  257    HA   VAL  38           HA       VAL  38 -12.315  11.136   5.481
  258    HB   VAL  38           HB       VAL  38 -14.568   9.739   4.097
  259   HG11  VAL  38          HG11      VAL  38 -14.214  11.725   3.041
  260   HG12  VAL  38          HG12      VAL  38 -13.064  10.728   2.150
  261   HG13  VAL  38          HG13      VAL  38 -12.501  11.769   3.457
  262   HG21  VAL  38          HG21      VAL  38 -11.660   8.985   3.845
  263   HG22  VAL  38          HG22      VAL  38 -12.900   8.553   2.669
  264   HG23  VAL  38          HG23      VAL  38 -13.000   7.942   4.320
  265    H    MET  39           H        MET  39 -14.164  12.675   4.802
  266    HA   MET  39           HA       MET  39 -15.584  13.430   7.082
  267    HB2  MET  39           HB2      MET  39 -16.261  14.148   4.226
  268    HB3  MET  39           HB3      MET  39 -16.712  15.046   5.669
  269    HG2  MET  39           HG2      MET  39 -13.922  14.795   5.752
  270    HG3  MET  39           HG3      MET  39 -14.330  15.213   4.089
  271    HE1  MET  39           HE1      MET  39 -14.803  18.848   4.156
  272    HE2  MET  39           HE2      MET  39 -15.174  17.366   3.275
  273    HE3  MET  39           HE3      MET  39 -13.522  17.689   3.801
  274    H    LYS  40           H        LYS  40 -16.415  11.261   4.493
  275    HA   LYS  40           HA       LYS  40 -19.223  11.187   5.090
  276    HB2  LYS  40           HB2      LYS  40 -17.432   9.475   3.371
  277    HB3  LYS  40           HB3      LYS  40 -19.146   9.141   3.576
  278    HG2  LYS  40           HG2      LYS  40 -18.274  11.854   2.698
  279    HG3  LYS  40           HG3      LYS  40 -18.309  10.525   1.538
  280    HD2  LYS  40           HD2      LYS  40 -20.617  10.243   1.751
  281    HD3  LYS  40           HD3      LYS  40 -20.675  11.121   3.281
  282    HE2  LYS  40           HE2      LYS  40 -21.610  12.539   1.614
  283    HE3  LYS  40           HE3      LYS  40 -20.019  13.182   2.019
  284    HZ1  LYS  40           HZ1      LYS  40 -20.519  13.108  -0.398
  285    HZ2  LYS  40           HZ2      LYS  40 -20.534  11.419  -0.310
  286    HZ3  LYS  40           HZ3      LYS  40 -19.114  12.270   0.035
  287    H    MET  41           H        MET  41 -16.922   8.473   5.099
  288    HA   MET  41           HA       MET  41 -17.656   7.771   7.814
  289    HB2  MET  41           HB2      MET  41 -18.915   6.538   5.540
  290    HB3  MET  41           HB3      MET  41 -17.953   5.344   6.399
  291    HG2  MET  41           HG2      MET  41 -19.302   5.349   8.199
  292    HG3  MET  41           HG3      MET  41 -19.642   7.075   8.076
  293    HE1  MET  41           HE1      MET  41 -21.758   8.075   7.006
  294    HE2  MET  41           HE2      MET  41 -22.099   7.165   8.478
  295    HE3  MET  41           HE3      MET  41 -23.172   7.023   7.086
  296    H    ILE  42           H        ILE  42 -16.678   5.219   7.929
  297    HA   ILE  42           HA       ILE  42 -13.838   5.697   7.706
  298    HB   ILE  42           HB       ILE  42 -14.694   4.619   9.713
  299   HG12  ILE  42          HG12      ILE  42 -13.186   2.670   9.786
  300   HG13  ILE  42          HG13      ILE  42 -13.052   2.709   8.031
  301   HG21  ILE  42          HG21      ILE  42 -16.623   3.492   8.947
  302   HG22  ILE  42          HG22      ILE  42 -15.523   2.241   9.527
  303   HG23  ILE  42          HG23      ILE  42 -15.695   2.531   7.795
  304   HD11  ILE  42          HD11      ILE  42 -12.379   5.279   8.972
  305   HD12  ILE  42          HD12      ILE  42 -11.331   4.074   8.222
  306   HD13  ILE  42          HD13      ILE  42 -11.525   4.106   9.974
  307    H    MET  43           H        MET  43 -12.357   4.381   6.570
  308    HA   MET  43           HA       MET  43 -13.437   2.505   4.615
  309    HB2  MET  43           HB2      MET  43 -11.973   5.042   3.947
  310    HB3  MET  43           HB3      MET  43 -11.897   3.650   2.875
  311    HG2  MET  43           HG2      MET  43 -14.501   4.831   3.781
  312    HG3  MET  43           HG3      MET  43 -13.636   5.423   2.363
  313    HE1  MET  43           HE1      MET  43 -15.793   3.594   0.003
  314    HE2  MET  43           HE2      MET  43 -14.949   5.059   0.505
  315    HE3  MET  43           HE3      MET  43 -16.421   4.560   1.338
  316    H    THR  44           H        THR  44 -11.866   1.084   3.713
  317    HA   THR  44           HA       THR  44  -9.344   0.993   5.237
  318    HB   THR  44           HB       THR  44 -10.190  -1.572   4.147
  319    HG1  THR  44           HG1      THR  44 -12.264  -0.917   4.555
  320   HG21  THR  44          HG21      THR  44  -8.477  -1.199   5.931
  321   HG22  THR  44          HG22      THR  44  -9.706  -2.407   6.302
  322   HG23  THR  44          HG23      THR  44  -9.804  -0.800   7.022
  323    H    LEU  45           H        LEU  45  -7.499   0.896   4.104
  324    HA   LEU  45           HA       LEU  45  -7.688   0.882   1.196
  325    HB2  LEU  45           HB2      LEU  45  -5.522   1.609   3.143
  326    HB3  LEU  45           HB3      LEU  45  -5.162   1.371   1.445
  327    HG   LEU  45           HG       LEU  45  -5.427   3.687   1.701
  328   HD11  LEU  45          HD11      LEU  45  -8.154   2.817   0.787
  329   HD12  LEU  45          HD12      LEU  45  -6.700   2.621  -0.193
  330   HD13  LEU  45          HD13      LEU  45  -7.233   4.234   0.281
  331   HD21  LEU  45          HD21      LEU  45  -6.657   4.674   3.276
  332   HD22  LEU  45          HD22      LEU  45  -6.965   3.053   3.899
  333   HD23  LEU  45          HD23      LEU  45  -8.116   3.808   2.796
  334    H    ASN  46           H        ASN  46  -6.459  -0.492  -0.132
  335    HA   ASN  46           HA       ASN  46  -5.241  -2.826   1.155
  336    HB2  ASN  46           HB2      ASN  46  -6.392  -4.315  -0.498
  337    HB3  ASN  46           HB3      ASN  46  -7.477  -3.573   0.673
  338   HD21  ASN  46          HD21      ASN  46  -8.788  -1.817  -0.004
  339   HD22  ASN  46          HD22      ASN  46  -9.207  -1.623  -1.669
  340    H    VAL  47           H        VAL  47  -4.123  -4.233  -0.541
  341    HA   VAL  47           HA       VAL  47  -2.548  -2.456  -2.242
  342    HB   VAL  47           HB       VAL  47  -1.119  -4.541  -2.553
  343   HG11  VAL  47          HG11      VAL  47  -1.104  -4.024   0.338
  344   HG12  VAL  47          HG12      VAL  47  -1.063  -2.585  -0.680
  345   HG13  VAL  47          HG13      VAL  47   0.174  -3.828  -0.861
  346   HG21  VAL  47          HG21      VAL  47  -3.038  -6.043  -1.766
  347   HG22  VAL  47          HG22      VAL  47  -2.567  -5.570  -0.134
  348   HG23  VAL  47          HG23      VAL  47  -1.417  -6.409  -1.175
  349    H    GLN  48           H        GLN  48  -2.196  -2.828  -4.444
  350    HA   GLN  48           HA       GLN  48  -4.420  -4.112  -5.789
  351    HB2  GLN  48           HB2      GLN  48  -3.251  -3.173  -7.865
  352    HB3  GLN  48           HB3      GLN  48  -3.928  -2.022  -6.723
  353    HG2  GLN  48           HG2      GLN  48  -1.745  -1.319  -7.536
  354    HG3  GLN  48           HG3      GLN  48  -1.728  -1.604  -5.798
  355   HE21  GLN  48          HE21      GLN  48   0.114  -2.463  -5.190
  356   HE22  GLN  48          HE22      GLN  48   1.016  -3.664  -6.044
  357    H    GLU  49           H        GLU  49  -1.270  -4.966  -4.868
  358    HA   GLU  49           HA       GLU  49  -1.477  -7.451  -6.335
  359    HB2  GLU  49           HB2      GLU  49   0.595  -5.381  -6.942
  360    HB3  GLU  49           HB3      GLU  49   1.037  -7.080  -7.032
  361    HG2  GLU  49           HG2      GLU  49  -1.216  -5.783  -8.550
  362    HG3  GLU  49           HG3      GLU  49   0.375  -6.170  -9.204
  363    H    ARG  50           H        ARG  50   0.287  -8.979  -5.713
  364    HA   ARG  50           HA       ARG  50   0.555  -9.037  -2.890
  365    HB2  ARG  50           HB2      ARG  50   1.709 -10.722  -5.105
  366    HB3  ARG  50           HB3      ARG  50   2.095 -11.016  -3.415
  367    HG2  ARG  50           HG2      ARG  50   0.360 -12.487  -3.822
  368    HG3  ARG  50           HG3      ARG  50  -0.455 -11.112  -3.075
  369    HD2  ARG  50           HD2      ARG  50  -1.668 -11.961  -5.038
  370    HD3  ARG  50           HD3      ARG  50  -1.137 -10.293  -5.248
  371    HE   ARG  50           HE       ARG  50   0.801 -12.029  -6.316
  372   HH11  ARG  50          HH11      ARG  50  -2.433 -10.885  -6.958
  373   HH12  ARG  50          HH12      ARG  50  -2.304 -11.100  -8.671
  374   HH21  ARG  50          HH21      ARG  50   0.973 -12.312  -8.569
  375   HH22  ARG  50          HH22      ARG  50  -0.370 -11.910  -9.586
  376    H    GLY  51           H        GLY  51   2.301  -8.669  -1.574
  377    HA2  GLY  51           HA2      GLY  51   4.934  -8.457  -2.032
  378    HA3  GLY  51           HA3      GLY  51   4.350  -6.926  -2.668
  379    H    ARG  52           H        ARG  52   6.036  -6.470  -0.816
  380    HA   ARG  52           HA       ARG  52   4.734  -6.407   1.798
  381    HB2  ARG  52           HB2      ARG  52   7.523  -6.175   0.817
  382    HB3  ARG  52           HB3      ARG  52   7.119  -5.241   2.252
  383    HG2  ARG  52           HG2      ARG  52   7.742  -7.140   3.290
  384    HG3  ARG  52           HG3      ARG  52   6.068  -7.594   2.964
  385    HD2  ARG  52           HD2      ARG  52   7.199  -9.440   2.184
  386    HD3  ARG  52           HD3      ARG  52   7.044  -8.480   0.714
  387    HE   ARG  52           HE       ARG  52   9.429  -7.692   1.709
  388   HH11  ARG  52          HH11      ARG  52   8.055 -10.826   1.023
  389   HH12  ARG  52          HH12      ARG  52   9.584 -11.556   0.666
  390   HH21  ARG  52          HH21      ARG  52  11.441  -8.651   1.241
  391   HH22  ARG  52          HH22      ARG  52  11.506 -10.323   0.790
  392    H    VAL  53           H        VAL  53   3.629  -4.689   2.435
  393    HA   VAL  53           HA       VAL  53   3.723  -2.234   0.919
  394    HB   VAL  53           HB       VAL  53   2.157  -2.786   3.440
  395   HG11  VAL  53          HG11      VAL  53   1.794  -0.767   1.228
  396   HG12  VAL  53          HG12      VAL  53   2.310  -0.434   2.881
  397   HG13  VAL  53          HG13      VAL  53   0.677  -1.021   2.568
  398   HG21  VAL  53          HG21      VAL  53   1.377  -3.246   0.563
  399   HG22  VAL  53          HG22      VAL  53   0.281  -3.345   1.941
  400   HG23  VAL  53          HG23      VAL  53   1.621  -4.483   1.796
  401    H    LYS  54           H        LYS  54   4.903  -0.504   1.375
  402    HA   LYS  54           HA       LYS  54   6.097  -0.289   4.061
  403    HB2  LYS  54           HB2      LYS  54   7.229   0.962   1.564
  404    HB3  LYS  54           HB3      LYS  54   8.026   0.710   3.111
  405    HG2  LYS  54           HG2      LYS  54   7.922  -1.731   2.717
  406    HG3  LYS  54           HG3      LYS  54   7.244  -1.409   1.120
  407    HD2  LYS  54           HD2      LYS  54   9.507  -1.678   0.674
  408    HD3  LYS  54           HD3      LYS  54   9.339   0.075   0.793
  409    HE2  LYS  54           HE2      LYS  54   9.897  -0.380   3.324
  410    HE3  LYS  54           HE3      LYS  54  10.623  -1.848   2.672
  411    HZ1  LYS  54           HZ1      LYS  54  11.281   0.919   1.815
  412    HZ2  LYS  54           HZ2      LYS  54  11.995  -0.496   1.226
  413    HZ3  LYS  54           HZ3      LYS  54  12.227  -0.042   2.838
  414    H    TYR  55           H        TYR  55   5.057   1.200   5.205
  415    HA   TYR  55           HA       TYR  55   3.379   3.180   4.197
  416    HB2  TYR  55           HB2      TYR  55   4.677   2.664   6.828
  417    HB3  TYR  55           HB3      TYR  55   3.959   4.250   6.564
  418    HD1  TYR  55           HD1      TYR  55   2.785   0.939   5.340
  419    HD2  TYR  55           HD2      TYR  55   2.063   4.235   7.930
  420    HE1  TYR  55           HE1      TYR  55   0.570   0.018   5.884
  421    HE2  TYR  55           HE2      TYR  55  -0.153   3.324   8.482
  422    HH   TYR  55           HH       TYR  55  -1.101   0.151   7.631
  423    H    ILE  56           H        ILE  56   3.670   5.172   3.423
  424    HA   ILE  56           HA       ILE  56   6.406   6.244   3.385
  425    HB   ILE  56           HB       ILE  56   4.147   6.367   1.455
  426   HG12  ILE  56          HG12      ILE  56   5.918   6.085  -0.171
  427   HG13  ILE  56          HG13      ILE  56   7.144   6.398   1.053
  428   HG21  ILE  56          HG21      ILE  56   5.258   8.364   0.353
  429   HG22  ILE  56          HG22      ILE  56   6.063   8.640   1.898
  430   HG23  ILE  56          HG23      ILE  56   4.303   8.692   1.798
  431   HD11  ILE  56          HD11      ILE  56   6.440   4.344   2.222
  432   HD12  ILE  56          HD12      ILE  56   7.041   4.048   0.591
  433   HD13  ILE  56          HD13      ILE  56   5.307   4.023   0.910
  434    H    LYS  57           H        LYS  57   3.029   7.267   3.689
  435    HA   LYS  57           HA       LYS  57   3.666   9.881   4.623
  436    HB2  LYS  57           HB2      LYS  57   1.277   8.280   4.095
  437    HB3  LYS  57           HB3      LYS  57   1.084   9.392   5.445
  438    HG2  LYS  57           HG2      LYS  57   1.862  10.089   2.621
  439    HG3  LYS  57           HG3      LYS  57   0.332  10.448   3.424
  440    HD2  LYS  57           HD2      LYS  57   1.247  12.427   3.925
  441    HD3  LYS  57           HD3      LYS  57   2.187  11.545   5.130
  442    HE2  LYS  57           HE2      LYS  57   3.885  12.578   4.012
  443    HE3  LYS  57           HE3      LYS  57   3.761  11.105   3.052
  444    HZ1  LYS  57           HZ1      LYS  57   2.277  13.563   2.340
  445    HZ2  LYS  57           HZ2      LYS  57   2.617  12.223   1.365
  446    HZ3  LYS  57           HZ3      LYS  57   3.858  13.286   1.802
  447    H    ARG  58           H        ARG  58   2.836  10.679   6.776
  448    HA   ARG  58           HA       ARG  58   3.862   8.919   8.862
  449    HB2  ARG  58           HB2      ARG  58   3.507  11.839   8.532
  450    HB3  ARG  58           HB3      ARG  58   3.291  11.220  10.163
  451    HG2  ARG  58           HG2      ARG  58   5.560  11.900   9.916
  452    HG3  ARG  58           HG3      ARG  58   5.523  10.136   9.979
  453    HD2  ARG  58           HD2      ARG  58   7.046  10.864   8.247
  454    HD3  ARG  58           HD3      ARG  58   5.650  10.069   7.521
  455    HE   ARG  58           HE       ARG  58   5.166  12.023   6.454
  456   HH11  ARG  58          HH11      ARG  58   7.222  12.746   9.180
  457   HH12  ARG  58          HH12      ARG  58   7.381  14.422   8.775
  458   HH21  ARG  58          HH21      ARG  58   5.374  14.228   5.921
  459   HH22  ARG  58          HH22      ARG  58   6.332  15.264   6.926
  460    HA   PRO  59           HA       PRO  59   0.008   7.928  10.741
  461    HB2  PRO  59           HB2      PRO  59   0.422   8.418  13.393
  462    HB3  PRO  59           HB3      PRO  59   1.101   7.025  12.543
  463    HG2  PRO  59           HG2      PRO  59   2.394   9.632  13.244
  464    HG3  PRO  59           HG3      PRO  59   3.053   7.990  13.358
  465    HD2  PRO  59           HD2      PRO  59   3.680   9.648  11.325
  466    HD3  PRO  59           HD3      PRO  59   3.539   7.893  11.101
  467    H    GLY  60           H        GLY  60  -1.878   8.953  10.770
  468    HA2  GLY  60           HA2      GLY  60  -3.471  10.510  11.491
  469    HA3  GLY  60           HA3      GLY  60  -2.181  11.468  12.201
  470    H    ALA  61           H        ALA  61  -0.771  11.116   9.462
  471    HA   ALA  61           HA       ALA  61  -1.344  13.630   8.426
  472    HB1  ALA  61           HB1      ALA  61   0.724  12.432   7.952
  473    HB2  ALA  61           HB2      ALA  61  -0.071  12.932   6.459
  474    HB3  ALA  61           HB3      ALA  61  -0.168  11.253   6.990
  475    H    VAL  62           H        VAL  62  -2.709  14.414   6.908
  476    HA   VAL  62           HA       VAL  62  -5.005  12.825   6.212
  477    HB   VAL  62           HB       VAL  62  -4.330  15.601   5.236
  478   HG11  VAL  62          HG11      VAL  62  -6.893  14.030   5.407
  479   HG12  VAL  62          HG12      VAL  62  -6.098  14.649   3.959
  480   HG13  VAL  62          HG13      VAL  62  -6.832  15.767   5.108
  481   HG21  VAL  62          HG21      VAL  62  -4.262  15.471   7.701
  482   HG22  VAL  62          HG22      VAL  62  -5.906  14.832   7.691
  483   HG23  VAL  62          HG23      VAL  62  -5.592  16.466   7.108
  484    H    LEU  63           H        LEU  63  -5.198  11.599   4.443
  485    HA   LEU  63           HA       LEU  63  -3.166  11.705   2.391
  486    HB2  LEU  63           HB2      LEU  63  -5.569   9.934   2.800
  487    HB3  LEU  63           HB3      LEU  63  -4.551   9.830   1.381
  488    HG   LEU  63           HG       LEU  63  -2.651   9.174   2.704
  489   HD11  LEU  63          HD11      LEU  63  -4.442   9.586   5.092
  490   HD12  LEU  63          HD12      LEU  63  -2.996  10.508   4.680
  491   HD13  LEU  63          HD13      LEU  63  -2.859   8.811   5.138
  492   HD21  LEU  63          HD21      LEU  63  -3.339   7.018   3.322
  493   HD22  LEU  63          HD22      LEU  63  -4.461   7.509   2.052
  494   HD23  LEU  63          HD23      LEU  63  -4.963   7.565   3.742
  495    H    GLU  64           H        GLU  64  -3.809  11.640   0.067
  496    HA   GLU  64           HA       GLU  64  -6.155  13.314  -0.500
  497    HB2  GLU  64           HB2      GLU  64  -3.503  13.736  -1.868
  498    HB3  GLU  64           HB3      GLU  64  -4.930  14.761  -1.934
  499    HG2  GLU  64           HG2      GLU  64  -4.617  15.218   0.499
  500    HG3  GLU  64           HG3      GLU  64  -3.085  14.350   0.403
  501    H    ALA  65           H        ALA  65  -6.871  13.211  -2.743
  502    HA   ALA  65           HA       ALA  65  -7.021  10.580  -3.705
  503    HB1  ALA  65           HB1      ALA  65  -8.708  12.340  -4.135
  504    HB2  ALA  65           HB2      ALA  65  -8.200  11.496  -5.597
  505    HB3  ALA  65           HB3      ALA  65  -7.578  13.109  -5.249
  506    H    GLY  66           H        GLY  66  -4.893   9.802  -3.939
  507    HA2  GLY  66           HA2      GLY  66  -3.615   9.196  -6.000
  508    HA3  GLY  66           HA3      GLY  66  -3.439  10.925  -6.255
  509    H    CYS  67           H        CYS  67  -3.192  10.862  -3.085
  510    HA   CYS  67           HA       CYS  67  -0.389  11.171  -3.045
  511    HB2  CYS  67           HB2      CYS  67  -1.961  12.248  -1.439
  512    HB3  CYS  67           HB3      CYS  67  -2.228  10.676  -0.695
  513    HG   CYS  67           HG       CYS  67   0.195  10.712   0.187
  514    H    VAL  68           H        VAL  68   1.238   9.877  -2.184
  515    HA   VAL  68           HA       VAL  68   0.785   7.040  -2.447
  516    HB   VAL  68           HB       VAL  68   3.329   8.421  -1.592
  517   HG11  VAL  68          HG11      VAL  68   4.442   6.434  -2.248
  518   HG12  VAL  68          HG12      VAL  68   2.984   5.781  -2.995
  519   HG13  VAL  68          HG13      VAL  68   3.082   5.937  -1.241
  520   HG21  VAL  68          HG21      VAL  68   2.584   9.363  -3.705
  521   HG22  VAL  68          HG22      VAL  68   2.381   7.745  -4.375
  522   HG23  VAL  68          HG23      VAL  68   3.991   8.330  -3.956
  523    H    VAL  69           H        VAL  69  -0.204   6.049  -0.798
  524    HA   VAL  69           HA       VAL  69   0.203   6.875   1.939
  525    HB   VAL  69           HB       VAL  69  -1.297   4.447   0.958
  526   HG11  VAL  69          HG11      VAL  69  -1.437   6.036   3.517
  527   HG12  VAL  69          HG12      VAL  69  -0.823   4.394   3.324
  528   HG13  VAL  69          HG13      VAL  69  -2.536   4.728   3.076
  529   HG21  VAL  69          HG21      VAL  69  -2.322   7.250   1.402
  530   HG22  VAL  69          HG22      VAL  69  -3.313   5.838   1.037
  531   HG23  VAL  69          HG23      VAL  69  -2.159   6.437  -0.154
  532    H    ALA  70           H        ALA  70   1.450   4.445  -0.205
  533    HA   ALA  70           HA       ALA  70   3.482   3.713   1.660
  534    HB1  ALA  70           HB1      ALA  70   1.411   2.400   2.393
  535    HB2  ALA  70           HB2      ALA  70   2.911   1.501   2.162
  536    HB3  ALA  70           HB3      ALA  70   1.653   1.450   0.927
  537    H    ARG  71           H        ARG  71   4.263   1.276   0.620
  538    HA   ARG  71           HA       ARG  71   4.465   1.643  -2.275
  539    HB2  ARG  71           HB2      ARG  71   6.708   1.803  -0.315
  540    HB3  ARG  71           HB3      ARG  71   7.012   1.015  -1.857
  541    HG2  ARG  71           HG2      ARG  71   5.911   3.801  -1.564
  542    HG3  ARG  71           HG3      ARG  71   7.615   3.417  -1.813
  543    HD2  ARG  71           HD2      ARG  71   5.982   2.057  -3.753
  544    HD3  ARG  71           HD3      ARG  71   5.639   3.786  -3.766
  545    HE   ARG  71           HE       ARG  71   8.010   2.500  -4.695
  546   HH11  ARG  71          HH11      ARG  71   6.795   5.441  -3.262
  547   HH12  ARG  71          HH12      ARG  71   8.071   6.424  -3.895
  548   HH21  ARG  71          HH21      ARG  71   9.690   3.792  -5.529
  549   HH22  ARG  71          HH22      ARG  71   9.715   5.489  -5.183
  550    H    LEU  72           H        LEU  72   4.678  -0.236  -3.418
  551    HA   LEU  72           HA       LEU  72   4.384  -2.700  -1.874
  552    HB2  LEU  72           HB2      LEU  72   3.361  -1.716  -4.380
  553    HB3  LEU  72           HB3      LEU  72   4.161  -3.258  -4.621
  554    HG   LEU  72           HG       LEU  72   1.747  -3.502  -4.207
  555   HD11  LEU  72          HD11      LEU  72   3.325  -5.287  -3.586
  556   HD12  LEU  72          HD12      LEU  72   1.902  -5.250  -2.545
  557   HD13  LEU  72          HD13      LEU  72   3.435  -4.600  -1.966
  558   HD21  LEU  72          HD21      LEU  72   1.977  -1.481  -2.457
  559   HD22  LEU  72          HD22      LEU  72   2.032  -2.848  -1.344
  560   HD23  LEU  72          HD23      LEU  72   0.654  -2.647  -2.425
  561    H    GLU  73           H        GLU  73   6.036  -4.022  -1.584
  562    HA   GLU  73           HA       GLU  73   8.475  -3.648  -3.126
  563    HB2  GLU  73           HB2      GLU  73   8.194  -4.024  -0.517
  564    HB3  GLU  73           HB3      GLU  73   8.237  -5.717  -0.990
  565    HG2  GLU  73           HG2      GLU  73  10.444  -5.105  -0.423
  566    HG3  GLU  73           HG3      GLU  73  10.387  -5.233  -2.180
  567    H    LEU  74           H        LEU  74   7.511  -4.499  -5.110
  568    HA   LEU  74           HA       LEU  74   6.583  -7.149  -5.343
  569    HB2  LEU  74           HB2      LEU  74   7.283  -4.959  -7.130
  570    HB3  LEU  74           HB3      LEU  74   7.697  -6.522  -7.808
  571    HG   LEU  74           HG       LEU  74   5.389  -7.274  -7.557
  572   HD11  LEU  74          HD11      LEU  74   3.645  -5.642  -6.898
  573   HD12  LEU  74          HD12      LEU  74   4.921  -4.527  -6.409
  574   HD13  LEU  74          HD13      LEU  74   4.736  -6.073  -5.581
  575   HD21  LEU  74          HD21      LEU  74   5.991  -4.768  -9.056
  576   HD22  LEU  74          HD22      LEU  74   4.343  -5.395  -9.047
  577   HD23  LEU  74          HD23      LEU  74   5.663  -6.391  -9.660
  578    H    ASP  75           H        ASP  75   7.634  -9.021  -5.283
  579    HA   ASP  75           HA       ASP  75  10.465  -9.112  -4.931
  580    HB2  ASP  75           HB2      ASP  75   8.625 -11.452  -5.450
  581    HB3  ASP  75           HB3      ASP  75  10.191 -11.478  -4.644
  582    H    ASP  76           H        ASP  76  10.621  -7.913  -7.142
  583    HA   ASP  76           HA       ASP  76  10.441  -9.577  -9.479
  584    HB2  ASP  76           HB2      ASP  76  10.486  -6.858  -9.054
  585    HB3  ASP  76           HB3      ASP  76  12.095  -7.164  -9.702
  586    H    LEU  77           H        LEU  77  12.432  -9.685 -10.957
  587    HA   LEU  77           HA       LEU  77  14.465 -10.618 -11.366
  588    HB2  LEU  77           HB2      LEU  77  15.132  -9.005  -8.908
  589    HB3  LEU  77           HB3      LEU  77  16.339  -9.867  -9.843
  590    HG   LEU  77           HG       LEU  77  14.565  -7.695 -10.958
  591   HD11  LEU  77          HD11      LEU  77  16.042  -6.760  -9.287
  592   HD12  LEU  77          HD12      LEU  77  16.592  -6.301 -10.899
  593   HD13  LEU  77          HD13      LEU  77  17.425  -7.579 -10.013
  594   HD21  LEU  77          HD21      LEU  77  16.292  -7.724 -12.775
  595   HD22  LEU  77          HD22      LEU  77  15.271  -9.160 -12.695
  596   HD23  LEU  77          HD23      LEU  77  16.918  -9.211 -12.065
  597    H    GLU  78           H        GLU  78  12.757 -12.371 -10.241
  598    HA   GLU  78           HA       GLU  78  14.523 -14.251  -9.022
  599    HB2  GLU  78           HB2      GLU  78  13.980 -12.914  -7.039
  600    HB3  GLU  78           HB3      GLU  78  12.264 -13.157  -7.335
  601    HG2  GLU  78           HG2      GLU  78  12.952 -14.638  -5.599
  602    HG3  GLU  78           HG3      GLU  78  12.610 -15.593  -7.042
  603    H    HIS  79           H        HIS  79  13.966 -16.145  -9.850
  604    HA   HIS  79           HA       HIS  79  11.137 -16.820 -10.147
  605    HB2  HIS  79           HB2      HIS  79  13.177 -16.859 -12.370
  606    HB3  HIS  79           HB3      HIS  79  11.680 -17.783 -12.438
  607    HD1  HIS  79           HD1      HIS  79   9.879 -16.613 -13.646
  608    HD2  HIS  79           HD2      HIS  79  12.503 -13.943 -11.843
  609    HE1  HIS  79           HE1      HIS  79   9.051 -14.325 -14.280
  610    HE2  HIS  79           HE2      HIS  79  10.704 -12.728 -13.248
  611    H    HIS  80           H        HIS  80  10.714 -19.075 -10.255
  612    HA   HIS  80           HA       HIS  80  12.621 -20.648  -8.784
  613    HB2  HIS  80           HB2      HIS  80  10.164 -20.777  -8.387
  614    HB3  HIS  80           HB3      HIS  80   9.977 -21.500  -9.981
  615    HD1  HIS  80           HD1      HIS  80   9.507 -23.901  -9.646
  616    HD2  HIS  80           HD2      HIS  80  12.434 -22.525  -7.038
  617    HE1  HIS  80           HE1      HIS  80  10.266 -25.924  -8.360
  618    HE2  HIS  80           HE2      HIS  80  11.976 -25.051  -6.728
  619    H    HIS  81           H        HIS  81  13.561 -22.612  -9.454
  620    HA   HIS  81           HA       HIS  81  13.487 -23.216 -12.316
  621    HB2  HIS  81           HB2      HIS  81  15.888 -22.363 -10.748
  622    HB3  HIS  81           HB3      HIS  81  16.088 -23.546 -12.036
  623    HD1  HIS  81           HD1      HIS  81  14.197 -22.378 -14.145
  624    HD2  HIS  81           HD2      HIS  81  16.863 -20.107 -11.909
  625    HE1  HIS  81           HE1      HIS  81  14.602 -20.296 -15.495
  626    HE2  HIS  81           HE2      HIS  81  16.284 -18.976 -14.162
  627    H    HIS  82           H        HIS  82  14.321 -25.337 -12.843
  628    HA   HIS  82           HA       HIS  82  14.106 -27.189 -10.566
  629    HB2  HIS  82           HB2      HIS  82  13.494 -28.893 -12.306
  630    HB3  HIS  82           HB3      HIS  82  12.339 -27.574 -12.140
  631    HD1  HIS  82           HD1      HIS  82  14.703 -29.135 -14.536
  632    HD2  HIS  82           HD2      HIS  82  12.263 -25.777 -14.334
  633    HE1  HIS  82           HE1      HIS  82  14.570 -28.258 -16.889
  634    HE2  HIS  82           HE2      HIS  82  13.159 -26.177 -16.727
  635    H    HIS  83           H        HIS  83  16.039 -26.246 -13.310
  636    HA   HIS  83           HA       HIS  83  17.781 -28.451 -13.393
  637    HB2  HIS  83           HB2      HIS  83  19.330 -26.919 -14.580
  638    HB3  HIS  83           HB3      HIS  83  17.692 -26.865 -15.224
  639    HD1  HIS  83           HD1      HIS  83  19.898 -24.880 -12.850
  640    HD2  HIS  83           HD2      HIS  83  16.660 -24.361 -15.403
  641    HE1  HIS  83           HE1      HIS  83  19.452 -22.406 -12.876
  642    HE2  HIS  83           HE2      HIS  83  17.545 -22.106 -14.495
  643    H    HIS  84           H        HIS  84  17.551 -25.788 -11.218
  644    HA   HIS  84           HA       HIS  84  20.234 -25.915 -10.235
  645    HB2  HIS  84           HB2      HIS  84  18.854 -23.873 -10.053
  646    HB3  HIS  84           HB3      HIS  84  17.768 -24.717  -8.953
  647    HD1  HIS  84           HD1      HIS  84  18.683 -25.232  -6.557
  648    HD2  HIS  84           HD2      HIS  84  21.201 -22.923  -8.922
  649    HE1  HIS  84           HE1      HIS  84  20.384 -24.262  -4.979
  650    HE2  HIS  84           HE2      HIS  84  21.948 -22.939  -6.446